NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
572863 | 2mfh | 19549 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H1 MET 1 8.481 10.986 -2.947 2 H2 MET 1 H2 MET 1 8.474 9.398 -2.518 3 H3 MET 1 H3 MET 1 8.424 10.561 -1.357 4 HA MET 1 HA MET 1 6.267 9.572 -1.637 5 HB2 MET 1 HB2 MET 1 6.419 11.965 -0.980 6 HB3 MET 1 HB3 MET 1 6.465 12.432 -2.688 7 HG2 MET 1 HG2 MET 1 4.217 12.745 -1.844 8 HG3 MET 1 HG3 MET 1 4.206 11.426 -3.009 9 HE1 MET 1 HE1 MET 1 1.403 10.507 -0.461 10 HE2 MET 1 HE2 MET 1 1.896 12.138 -0.987 11 HE3 MET 1 HE3 MET 1 1.825 10.816 -2.169 12 H LEU 2 H LEU 2 4.884 8.506 -3.026 13 HA LEU 2 HA LEU 2 4.946 9.325 -5.884 14 HB2 LEU 2 HB2 LEU 2 5.562 6.698 -4.649 15 HB3 LEU 2 HB3 LEU 2 4.344 6.613 -5.929 16 HG LEU 2 HG LEU 2 7.110 7.813 -6.202 17 HD11 LEU 2 HD11 LEU 2 7.541 5.886 -7.630 18 HD12 LEU 2 HD12 LEU 2 7.035 5.350 -6.011 19 HD13 LEU 2 HD13 LEU 2 5.886 5.274 -7.363 20 HD21 LEU 2 HD21 LEU 2 4.868 7.372 -8.240 21 HD22 LEU 2 HD22 LEU 2 5.532 8.948 -7.742 22 HD23 LEU 2 HD23 LEU 2 6.546 7.823 -8.648 23 H ILE 3 H ILE 3 2.979 8.983 -7.003 24 HA ILE 3 HA ILE 3 0.633 8.218 -5.346 25 HB ILE 3 HB ILE 3 0.840 10.717 -7.076 26 HG12 ILE 3 HG12 ILE 3 -0.090 11.651 -4.799 27 HG13 ILE 3 HG13 ILE 3 0.650 10.202 -4.092 28 HG21 ILE 3 HG21 ILE 3 -1.519 9.491 -5.592 29 HG22 ILE 3 HG22 ILE 3 -1.505 11.088 -6.357 30 HG23 ILE 3 HG23 ILE 3 -1.349 9.635 -7.365 31 HD11 ILE 3 HD11 ILE 3 2.060 12.307 -5.780 32 HD12 ILE 3 HD12 ILE 3 2.136 12.184 -4.000 33 HD13 ILE 3 HD13 ILE 3 2.861 10.922 -5.007 34 H LEU 4 H LEU 4 -0.832 7.052 -6.403 35 HA LEU 4 HA LEU 4 -0.514 6.483 -9.323 36 HB2 LEU 4 HB2 LEU 4 -0.761 4.632 -6.912 37 HB3 LEU 4 HB3 LEU 4 -1.339 4.134 -8.489 38 HG LEU 4 HG LEU 4 0.822 3.195 -8.006 39 HD11 LEU 4 HD11 LEU 4 1.876 3.682 -10.108 40 HD12 LEU 4 HD12 LEU 4 0.106 3.743 -10.333 41 HD13 LEU 4 HD13 LEU 4 1.049 5.251 -10.210 42 HD21 LEU 4 HD21 LEU 4 1.756 5.106 -6.640 43 HD22 LEU 4 HD22 LEU 4 2.863 4.429 -7.857 44 HD23 LEU 4 HD23 LEU 4 2.049 5.959 -8.184 45 H THR 5 H THR 5 -2.533 5.766 -10.305 46 HA THR 5 HA THR 5 -4.923 5.911 -8.564 47 HB THR 5 HB THR 5 -5.049 7.208 -11.298 48 HG1 THR 5 HG1 THR 5 -3.491 8.319 -10.009 49 HG21 THR 5 HG21 THR 5 -7.162 6.604 -10.208 50 HG22 THR 5 HG22 THR 5 -6.638 7.431 -8.717 51 HG23 THR 5 HG23 THR 5 -6.962 8.363 -10.202 52 H ARG 6 H ARG 6 -5.242 3.791 -8.605 53 HA ARG 6 HA ARG 6 -5.725 2.472 -11.227 54 HB2 ARG 6 HB2 ARG 6 -4.722 0.381 -9.993 55 HB3 ARG 6 HB3 ARG 6 -3.686 1.563 -10.804 56 HG2 ARG 6 HG2 ARG 6 -2.644 1.063 -8.738 57 HG3 ARG 6 HG3 ARG 6 -3.295 2.693 -8.602 58 HD2 ARG 6 HD2 ARG 6 -3.809 1.705 -6.570 59 HD3 ARG 6 HD3 ARG 6 -5.339 1.562 -7.449 60 HE ARG 6 HE ARG 6 -4.778 -0.796 -7.902 61 HH11 ARG 6 HH11 ARG 6 -2.989 0.887 -5.350 62 HH12 ARG 6 HH12 ARG 6 -2.448 -0.586 -4.581 63 HH21 ARG 6 HH21 ARG 6 -3.980 -2.737 -6.857 64 HH22 ARG 6 HH22 ARG 6 -3.006 -2.585 -5.412 65 H LYS 7 H LYS 7 -7.002 0.397 -10.922 66 HA LYS 7 HA LYS 7 -9.221 1.180 -9.073 67 HB2 LYS 7 HB2 LYS 7 -10.738 0.199 -10.725 68 HB3 LYS 7 HB3 LYS 7 -9.809 1.534 -11.420 69 HG2 LYS 7 HG2 LYS 7 -8.510 0.116 -12.750 70 HG3 LYS 7 HG3 LYS 7 -8.715 -1.263 -11.647 71 HD2 LYS 7 HD2 LYS 7 -11.128 -1.394 -12.277 72 HD3 LYS 7 HD3 LYS 7 -10.904 -0.030 -13.388 73 HE2 LYS 7 HE2 LYS 7 -10.896 -2.146 -14.592 74 HE3 LYS 7 HE3 LYS 7 -9.304 -1.361 -14.708 75 HZ1 LYS 7 HZ1 LYS 7 -9.985 -3.530 -12.834 76 HZ2 LYS 7 HZ2 LYS 7 -9.156 -3.722 -14.243 77 HZ3 LYS 7 HZ3 LYS 7 -8.505 -2.846 -13.018 78 H VAL 8 H VAL 8 -10.884 -0.746 -8.904 79 HA VAL 8 HA VAL 8 -9.600 -2.511 -7.117 80 HB VAL 8 HB VAL 8 -11.709 -3.590 -6.838 81 HG11 VAL 8 HG11 VAL 8 -12.115 -0.620 -7.433 82 HG12 VAL 8 HG12 VAL 8 -13.076 -1.619 -6.325 83 HG13 VAL 8 HG13 VAL 8 -11.368 -1.278 -5.962 84 HG21 VAL 8 HG21 VAL 8 -12.484 -3.892 -9.142 85 HG22 VAL 8 HG22 VAL 8 -13.682 -3.050 -8.145 86 HG23 VAL 8 HG23 VAL 8 -12.690 -2.126 -9.310 87 H GLY 9 H GLY 9 -8.737 -4.435 -7.208 88 HA2 GLY 9 HA2 GLY 9 -8.400 -6.616 -8.091 89 HA3 GLY 9 HA3 GLY 9 -8.957 -6.063 -9.677 90 H GLU 10 H GLU 10 -7.093 -3.552 -9.130 91 HA GLU 10 HA GLU 10 -4.816 -4.589 -10.577 92 HB2 GLU 10 HB2 GLU 10 -5.388 -1.913 -9.231 93 HB3 GLU 10 HB3 GLU 10 -3.969 -2.229 -10.223 94 HG2 GLU 10 HG2 GLU 10 -6.852 -2.483 -11.179 95 HG3 GLU 10 HG3 GLU 10 -5.784 -1.105 -11.484 96 H SER 11 H SER 11 -2.527 -3.971 -9.790 97 HA SER 11 HA SER 11 -2.188 -4.323 -6.864 98 HB2 SER 11 HB2 SER 11 -0.961 -6.124 -8.988 99 HB3 SER 11 HB3 SER 11 -0.469 -6.071 -7.279 100 HG SER 11 HG SER 11 -3.060 -6.685 -8.264 101 H ILE 12 H ILE 12 -0.042 -3.845 -6.146 102 HA ILE 12 HA ILE 12 1.713 -2.234 -7.912 103 HB ILE 12 HB ILE 12 0.504 -1.301 -5.269 104 HG12 ILE 12 HG12 ILE 12 -1.099 -1.138 -7.149 105 HG13 ILE 12 HG13 ILE 12 -0.645 0.435 -6.495 106 HG21 ILE 12 HG21 ILE 12 2.485 0.091 -7.113 107 HG22 ILE 12 HG22 ILE 12 1.598 0.889 -5.806 108 HG23 ILE 12 HG23 ILE 12 2.745 -0.402 -5.421 109 HD11 ILE 12 HD11 ILE 12 -0.743 0.412 -8.985 110 HD12 ILE 12 HD12 ILE 12 0.867 0.843 -8.379 111 HD13 ILE 12 HD13 ILE 12 0.555 -0.792 -9.010 112 H ASN 13 H ASN 13 3.850 -1.804 -6.618 113 HA ASN 13 HA ASN 13 4.322 -3.995 -4.660 114 HB2 ASN 13 HB2 ASN 13 5.701 -3.587 -7.330 115 HB3 ASN 13 HB3 ASN 13 6.465 -4.457 -5.992 116 HD21 ASN 13 HD22 ASN 13 5.600 -6.446 -5.251 117 HD22 ASN 13 HD21 ASN 13 4.486 -7.370 -6.231 118 H ILE 14 H ILE 14 6.201 -3.838 -3.438 119 HA ILE 14 HA ILE 14 7.688 -1.283 -3.514 120 HB ILE 14 HB ILE 14 6.417 -2.441 -0.995 121 HG12 ILE 14 HG12 ILE 14 5.697 0.049 -2.613 122 HG13 ILE 14 HG13 ILE 14 4.716 -1.421 -2.471 123 HG21 ILE 14 HG21 ILE 14 8.574 -1.323 -0.582 124 HG22 ILE 14 HG22 ILE 14 8.009 0.112 -1.465 125 HG23 ILE 14 HG23 ILE 14 7.249 -0.370 0.070 126 HD11 ILE 14 HD11 ILE 14 5.377 0.527 -0.229 127 HD12 ILE 14 HD12 ILE 14 3.811 0.245 -1.005 128 HD13 ILE 14 HD13 ILE 14 4.550 -1.036 -0.010 129 H GLY 15 H GLY 15 9.800 -1.461 -2.588 130 HA2 GLY 15 HA2 GLY 15 11.796 -2.555 -2.222 131 HA3 GLY 15 HA3 GLY 15 10.849 -3.672 -1.219 132 H ASP 16 H ASP 16 11.854 -5.549 -1.824 133 HA ASP 16 HA ASP 16 11.312 -6.481 -4.598 134 HB2 ASP 16 HB2 ASP 16 13.774 -7.017 -2.893 135 HB3 ASP 16 HB3 ASP 16 13.407 -7.823 -4.427 136 H ASP 17 H ASP 17 10.154 -6.632 -1.662 137 HA ASP 17 HA ASP 17 9.524 -9.517 -1.790 138 HB2 ASP 17 HB2 ASP 17 10.608 -8.111 0.686 139 HB3 ASP 17 HB3 ASP 17 9.961 -9.752 0.642 140 H ILE 18 H ILE 18 8.181 -6.555 -1.943 141 HA ILE 18 HA ILE 18 5.904 -7.404 -0.214 142 HB ILE 18 HB ILE 18 6.864 -4.545 -0.590 143 HG12 ILE 18 HG12 ILE 18 7.016 -4.880 2.048 144 HG13 ILE 18 HG13 ILE 18 7.313 -6.566 1.607 145 HG21 ILE 18 HG21 ILE 18 4.439 -4.683 -0.337 146 HG22 ILE 18 HG22 ILE 18 4.624 -5.775 1.059 147 HG23 ILE 18 HG23 ILE 18 5.156 -4.082 1.161 148 HD11 ILE 18 HD11 ILE 18 8.846 -4.133 0.573 149 HD12 ILE 18 HD12 ILE 18 9.414 -5.234 1.851 150 HD13 ILE 18 HD13 ILE 18 9.240 -5.828 0.191 151 H THR 19 H THR 19 3.868 -7.030 -0.972 152 HA THR 19 HA THR 19 3.519 -5.779 -3.642 153 HB THR 19 HB THR 19 2.395 -8.500 -2.841 154 HG1 THR 19 HG1 THR 19 4.593 -8.625 -3.280 155 HG21 THR 19 HG21 THR 19 2.277 -6.914 -5.444 156 HG22 THR 19 HG22 THR 19 1.802 -8.618 -5.272 157 HG23 THR 19 HG23 THR 19 0.910 -7.366 -4.393 158 H ILE 20 H ILE 20 1.348 -5.066 -4.003 159 HA ILE 20 HA ILE 20 -0.432 -4.976 -1.612 160 HB ILE 20 HB ILE 20 0.340 -2.658 -3.427 161 HG12 ILE 20 HG12 ILE 20 2.122 -3.247 -1.780 162 HG13 ILE 20 HG13 ILE 20 1.440 -1.636 -1.563 163 HG21 ILE 20 HG21 ILE 20 -1.579 -2.831 -1.074 164 HG22 ILE 20 HG22 ILE 20 -1.020 -1.305 -1.799 165 HG23 ILE 20 HG23 ILE 20 -1.973 -2.455 -2.760 166 HD11 ILE 20 HD11 ILE 20 1.788 -2.843 0.587 167 HD12 ILE 20 HD12 ILE 20 0.090 -2.405 0.325 168 HD13 ILE 20 HD13 ILE 20 0.628 -4.086 0.060 169 H THR 21 H THR 21 -2.632 -4.983 -2.148 170 HA THR 21 HA THR 21 -3.357 -4.946 -5.033 171 HB THR 21 HB THR 21 -4.186 -7.124 -3.068 172 HG1 THR 21 HG1 THR 21 -2.432 -7.189 -5.293 173 HG21 THR 21 HG21 THR 21 -4.646 -6.821 -6.067 174 HG22 THR 21 HG22 THR 21 -5.101 -8.229 -5.083 175 HG23 THR 21 HG23 THR 21 -5.889 -6.665 -4.803 176 H ILE 22 H ILE 22 -5.494 -4.285 -5.425 177 HA ILE 22 HA ILE 22 -6.869 -3.059 -3.081 178 HB ILE 22 HB ILE 22 -6.243 -1.393 -4.628 179 HG12 ILE 22 HG12 ILE 22 -8.356 -0.518 -5.514 180 HG13 ILE 22 HG13 ILE 22 -9.132 -2.096 -5.288 181 HG21 ILE 22 HG21 ILE 22 -6.716 -1.396 -6.985 182 HG22 ILE 22 HG22 ILE 22 -5.781 -2.858 -6.596 183 HG23 ILE 22 HG23 ILE 22 -7.531 -2.975 -6.881 184 HD11 ILE 22 HD11 ILE 22 -8.007 -0.353 -3.078 185 HD12 ILE 22 HD12 ILE 22 -9.731 -0.611 -3.488 186 HD13 ILE 22 HD13 ILE 22 -8.757 -1.965 -2.873 187 H LEU 23 H LEU 23 -8.209 -4.601 -2.285 188 HA LEU 23 HA LEU 23 -9.304 -6.649 -3.975 189 HB2 LEU 23 HB2 LEU 23 -10.232 -5.889 -1.192 190 HB3 LEU 23 HB3 LEU 23 -10.394 -7.451 -1.999 191 HG LEU 23 HG LEU 23 -7.874 -6.167 -0.896 192 HD11 LEU 23 HD11 LEU 23 -9.210 -8.866 -0.452 193 HD12 LEU 23 HD12 LEU 23 -7.790 -8.236 0.406 194 HD13 LEU 23 HD13 LEU 23 -9.386 -7.461 0.616 195 HD21 LEU 23 HD21 LEU 23 -8.091 -8.646 -2.658 196 HD22 LEU 23 HD22 LEU 23 -7.206 -7.152 -3.043 197 HD23 LEU 23 HD23 LEU 23 -6.663 -8.191 -1.705 198 H GLY 24 H GLY 24 -10.517 -3.491 -2.868 199 HA2 GLY 24 HA2 GLY 24 -12.192 -3.030 -4.938 200 HA3 GLY 24 HA3 GLY 24 -13.219 -4.032 -3.929 201 H VAL 25 H VAL 25 -14.479 -1.888 -4.131 202 HA VAL 25 HA VAL 25 -13.802 -0.200 -1.777 203 HB VAL 25 HB VAL 25 -14.333 1.824 -2.939 204 HG11 VAL 25 HG11 VAL 25 -12.603 1.957 -4.632 205 HG12 VAL 25 HG12 VAL 25 -12.028 0.942 -3.284 206 HG13 VAL 25 HG13 VAL 25 -12.565 0.192 -4.803 207 HG21 VAL 25 HG21 VAL 25 -14.943 1.887 -5.332 208 HG22 VAL 25 HG22 VAL 25 -15.072 0.111 -5.339 209 HG23 VAL 25 HG23 VAL 25 -16.171 1.090 -4.336 210 H SER 26 H SER 26 -15.629 1.067 -0.992 211 HA SER 26 HA SER 26 -18.340 0.229 -1.776 212 HB2 SER 26 HB2 SER 26 -17.218 -0.210 1.025 213 HB3 SER 26 HB3 SER 26 -18.930 -0.326 0.579 214 HG SER 26 HG SER 26 -17.887 -2.357 0.576 215 H GLY 27 H GLY 27 -18.572 2.435 -2.417 216 HA2 GLY 27 HA2 GLY 27 -19.377 4.560 -2.006 217 HA3 GLY 27 HA3 GLY 27 -19.347 4.208 -0.268 218 H GLN 28 H GLN 28 -17.496 4.700 0.961 219 HA GLN 28 HA GLN 28 -15.293 6.147 -0.470 220 HB2 GLN 28 HB2 GLN 28 -16.212 6.338 2.428 221 HB3 GLN 28 HB3 GLN 28 -14.816 7.180 1.745 222 HG2 GLN 28 HG2 GLN 28 -17.708 7.615 0.948 223 HG3 GLN 28 HG3 GLN 28 -16.725 8.628 2.034 224 HE21 GLN 28 HE22 GLN 28 -16.806 7.378 -1.370 225 HE22 GLN 28 HE21 GLN 28 -15.993 8.770 -2.055 226 H GLN 29 H GLN 29 -16.214 3.355 1.392 227 HA GLN 29 HA GLN 29 -13.629 2.982 2.612 228 HB2 GLN 29 HB2 GLN 29 -15.646 0.798 2.003 229 HB3 GLN 29 HB3 GLN 29 -14.379 0.792 3.218 230 HG2 GLN 29 HG2 GLN 29 -16.824 2.608 3.210 231 HG3 GLN 29 HG3 GLN 29 -16.564 1.179 4.227 232 HE21 GLN 29 HE22 GLN 29 -14.144 1.382 5.342 233 HE22 GLN 29 HE21 GLN 29 -13.962 2.892 6.209 234 H VAL 30 H VAL 30 -12.063 1.429 2.038 235 HA VAL 30 HA VAL 30 -11.999 0.441 -0.752 236 HB VAL 30 HB VAL 30 -9.838 2.165 0.563 237 HG11 VAL 30 HG11 VAL 30 -9.015 0.337 -0.960 238 HG12 VAL 30 HG12 VAL 30 -10.004 1.046 -2.259 239 HG13 VAL 30 HG13 VAL 30 -8.665 1.976 -1.550 240 HG21 VAL 30 HG21 VAL 30 -11.690 3.581 -0.193 241 HG22 VAL 30 HG22 VAL 30 -10.304 3.753 -1.288 242 HG23 VAL 30 HG23 VAL 30 -11.707 2.766 -1.770 243 H ARG 31 H ARG 31 -11.840 -1.721 -0.255 244 HA ARG 31 HA ARG 31 -10.294 -2.531 2.118 245 HB2 ARG 31 HB2 ARG 31 -12.466 -3.587 1.621 246 HB3 ARG 31 HB3 ARG 31 -11.832 -4.184 0.075 247 HG2 ARG 31 HG2 ARG 31 -10.133 -5.503 1.223 248 HG3 ARG 31 HG3 ARG 31 -10.582 -4.814 2.793 249 HD2 ARG 31 HD2 ARG 31 -12.568 -6.290 1.046 250 HD3 ARG 31 HD3 ARG 31 -11.523 -7.141 2.212 251 HE ARG 31 HE ARG 31 -12.802 -5.022 3.578 252 HH11 ARG 31 HH11 ARG 31 -13.620 -8.066 1.973 253 HH12 ARG 31 HH12 ARG 31 -15.015 -8.377 2.976 254 HH21 ARG 31 HH21 ARG 31 -14.626 -5.441 4.886 255 HH22 ARG 31 HH22 ARG 31 -15.594 -6.877 4.625 256 H ILE 32 H ILE 32 -8.299 -3.384 2.077 257 HA ILE 32 HA ILE 32 -6.949 -3.550 -0.571 258 HB ILE 32 HB ILE 32 -5.633 -2.264 1.826 259 HG12 ILE 32 HG12 ILE 32 -7.555 -0.917 -0.097 260 HG13 ILE 32 HG13 ILE 32 -7.620 -0.970 1.674 261 HG21 ILE 32 HG21 ILE 32 -5.300 -1.881 -1.182 262 HG22 ILE 32 HG22 ILE 32 -4.273 -1.191 0.098 263 HG23 ILE 32 HG23 ILE 32 -4.289 -2.936 -0.174 264 HD11 ILE 32 HD11 ILE 32 -5.572 0.514 -0.023 265 HD12 ILE 32 HD12 ILE 32 -6.864 1.221 0.963 266 HD13 ILE 32 HD13 ILE 32 -5.514 0.378 1.754 267 H GLY 33 H GLY 33 -4.982 -4.794 -0.547 268 HA2 GLY 33 HA2 GLY 33 -4.673 -6.569 1.829 269 HA3 GLY 33 HA3 GLY 33 -4.668 -7.212 0.177 270 H ILE 34 H ILE 34 -2.563 -7.436 2.095 271 HA ILE 34 HA ILE 34 -0.362 -6.076 0.657 272 HB ILE 34 HB ILE 34 -0.611 -6.159 3.706 273 HG12 ILE 34 HG12 ILE 34 -0.377 -3.549 3.238 274 HG13 ILE 34 HG13 ILE 34 -1.148 -3.954 1.704 275 HG21 ILE 34 HG21 ILE 34 1.438 -4.731 3.589 276 HG22 ILE 34 HG22 ILE 34 1.698 -6.365 2.967 277 HG23 ILE 34 HG23 ILE 34 1.500 -5.004 1.835 278 HD11 ILE 34 HD11 ILE 34 -2.220 -4.571 4.502 279 HD12 ILE 34 HD12 ILE 34 -2.795 -3.278 3.434 280 HD13 ILE 34 HD13 ILE 34 -3.059 -4.973 2.988 281 H ASN 35 H ASN 35 1.555 -7.252 0.647 282 HA ASN 35 HA ASN 35 1.468 -9.928 1.924 283 HB2 ASN 35 HB2 ASN 35 0.461 -9.950 -0.384 284 HB3 ASN 35 HB3 ASN 35 2.033 -9.480 -1.031 285 HD21 ASN 35 HD22 ASN 35 0.423 -11.947 -1.469 286 HD22 ASN 35 HD21 ASN 35 1.421 -13.286 -0.951 287 H ALA 36 H ALA 36 3.191 -9.789 3.198 288 HA ALA 36 HA ALA 36 5.849 -9.224 2.038 289 HB1 ALA 36 HB1 ALA 36 6.350 -7.673 3.919 290 HB2 ALA 36 HB2 ALA 36 5.066 -7.029 2.865 291 HB3 ALA 36 HB3 ALA 36 4.654 -7.758 4.437 292 HA PRO 37 HA PRO 37 7.009 -12.436 4.858 293 HB2 PRO 37 HB2 PRO 37 9.532 -11.578 5.611 294 HB3 PRO 37 HB3 PRO 37 9.158 -12.353 4.026 295 HG2 PRO 37 HG2 PRO 37 9.448 -9.417 4.696 296 HG3 PRO 37 HG3 PRO 37 10.101 -10.308 3.280 297 HD2 PRO 37 HD2 PRO 37 7.827 -8.835 3.116 298 HD3 PRO 37 HD3 PRO 37 7.981 -10.390 2.247 299 H LYS 38 H LYS 38 7.358 -12.859 7.133 300 HA LYS 38 HA LYS 38 6.254 -10.852 8.906 301 HB2 LYS 38 HB2 LYS 38 7.558 -13.568 9.370 302 HB3 LYS 38 HB3 LYS 38 6.791 -12.614 10.658 303 HG2 LYS 38 HG2 LYS 38 5.327 -13.378 8.093 304 HG3 LYS 38 HG3 LYS 38 5.327 -14.406 9.533 305 HD2 LYS 38 HD2 LYS 38 4.620 -11.491 9.874 306 HD3 LYS 38 HD3 LYS 38 3.463 -12.533 9.054 307 HE2 LYS 38 HE2 LYS 38 4.686 -13.109 11.795 308 HE3 LYS 38 HE3 LYS 38 3.095 -12.378 11.534 309 HZ1 LYS 38 HZ1 LYS 38 2.431 -14.355 10.372 310 HZ2 LYS 38 HZ2 LYS 38 3.906 -15.050 10.595 311 HZ3 LYS 38 HZ3 LYS 38 2.929 -14.750 11.880 312 H ASP 39 H ASP 39 9.214 -11.154 7.526 313 HA ASP 39 HA ASP 39 10.957 -10.274 9.662 314 HB2 ASP 39 HB2 ASP 39 11.096 -10.182 6.626 315 HB3 ASP 39 HB3 ASP 39 12.417 -9.648 7.666 316 H VAL 40 H VAL 40 8.382 -8.741 8.097 317 HA VAL 40 HA VAL 40 9.356 -6.087 8.976 318 HB VAL 40 HB VAL 40 8.491 -5.030 6.958 319 HG11 VAL 40 HG11 VAL 40 10.301 -7.356 6.170 320 HG12 VAL 40 HG12 VAL 40 10.119 -5.817 5.308 321 HG13 VAL 40 HG13 VAL 40 10.863 -5.843 6.928 322 HG21 VAL 40 HG21 VAL 40 6.723 -6.747 6.464 323 HG22 VAL 40 HG22 VAL 40 7.702 -6.286 5.048 324 HG23 VAL 40 HG23 VAL 40 8.025 -7.824 5.871 325 H ALA 41 H ALA 41 7.395 -4.506 8.998 326 HA ALA 41 HA ALA 41 5.135 -6.064 10.154 327 HB1 ALA 41 HB1 ALA 41 6.472 -4.739 11.780 328 HB2 ALA 41 HB2 ALA 41 6.135 -3.262 10.841 329 HB3 ALA 41 HB3 ALA 41 4.812 -4.123 11.638 330 H VAL 42 H VAL 42 2.989 -5.182 9.949 331 HA VAL 42 HA VAL 42 2.534 -2.930 8.150 332 HB VAL 42 HB VAL 42 2.703 -4.410 6.373 333 HG11 VAL 42 HG11 VAL 42 1.454 -6.532 8.151 334 HG12 VAL 42 HG12 VAL 42 1.719 -6.728 6.394 335 HG13 VAL 42 HG13 VAL 42 3.095 -6.485 7.474 336 HG21 VAL 42 HG21 VAL 42 0.490 -3.302 6.371 337 HG22 VAL 42 HG22 VAL 42 0.453 -4.896 5.573 338 HG23 VAL 42 HG23 VAL 42 -0.209 -4.718 7.200 339 H HIS 43 H HIS 43 0.886 -1.819 8.924 340 HA HIS 43 HA HIS 43 -1.498 -3.097 10.023 341 HB2 HIS 43 HB2 HIS 43 -0.102 -1.102 11.814 342 HB3 HIS 43 HB3 HIS 43 -1.372 -2.257 12.204 343 HD2 HIS 43 HD2 HIS 43 2.443 -2.127 11.507 344 HE1 HIS 43 HE1 HIS 43 1.685 -5.676 13.731 345 HE2 HIS 43 HE2 HIS 43 3.498 -4.199 12.728 346 H ARG 44 H ARG 44 -3.131 -1.225 10.672 347 HA ARG 44 HA ARG 44 -2.873 0.858 8.645 348 HB2 ARG 44 HB2 ARG 44 -5.051 1.591 9.375 349 HB3 ARG 44 HB3 ARG 44 -5.042 -0.155 9.107 350 HG2 ARG 44 HG2 ARG 44 -4.929 -0.560 11.526 351 HG3 ARG 44 HG3 ARG 44 -4.831 1.196 11.830 352 HD2 ARG 44 HD2 ARG 44 -7.023 1.461 10.638 353 HD3 ARG 44 HD3 ARG 44 -7.122 -0.304 10.485 354 HE ARG 44 HE ARG 44 -6.752 0.218 13.213 355 HH11 ARG 44 HH11 ARG 44 -9.106 1.041 10.718 356 HH12 ARG 44 HH12 ARG 44 -10.457 1.092 11.828 357 HH21 ARG 44 HH21 ARG 44 -8.531 0.371 14.669 358 HH22 ARG 44 HH22 ARG 44 -10.123 0.747 14.054 359 H GLU 45 H GLU 45 -3.259 3.226 9.379 360 HA GLU 45 HA GLU 45 -0.902 3.900 10.745 361 HB2 GLU 45 HB2 GLU 45 -2.230 5.193 9.028 362 HB3 GLU 45 HB3 GLU 45 -3.334 5.697 10.305 363 HG2 GLU 45 HG2 GLU 45 -0.328 6.199 10.339 364 HG3 GLU 45 HG3 GLU 45 -1.508 7.335 9.660 365 H GLU 46 H GLU 46 -4.118 3.276 12.019 366 HA GLU 46 HA GLU 46 -3.890 4.700 14.481 367 HB2 GLU 46 HB2 GLU 46 -5.984 3.713 13.463 368 HB3 GLU 46 HB3 GLU 46 -5.357 2.105 13.831 369 HG2 GLU 46 HG2 GLU 46 -6.954 2.796 15.541 370 HG3 GLU 46 HG3 GLU 46 -5.338 2.655 16.249 371 H ILE 47 H ILE 47 -3.018 1.341 13.523 372 HA ILE 47 HA ILE 47 -2.342 0.623 16.266 373 HB ILE 47 HB ILE 47 -1.838 -0.882 13.679 374 HG12 ILE 47 HG12 ILE 47 -4.166 -0.368 13.631 375 HG13 ILE 47 HG13 ILE 47 -4.003 -2.046 14.158 376 HG21 ILE 47 HG21 ILE 47 -2.190 -1.798 16.566 377 HG22 ILE 47 HG22 ILE 47 -2.053 -2.873 15.154 378 HG23 ILE 47 HG23 ILE 47 -0.690 -1.836 15.609 379 HD11 ILE 47 HD11 ILE 47 -4.562 0.372 15.928 380 HD12 ILE 47 HD12 ILE 47 -5.710 -0.904 15.481 381 HD13 ILE 47 HD13 ILE 47 -4.331 -1.294 16.530 382 H TYR 48 H TYR 48 -0.716 1.861 13.436 383 HA TYR 48 HA TYR 48 1.920 0.928 13.868 384 HB2 TYR 48 HB2 TYR 48 1.031 1.973 11.817 385 HB3 TYR 48 HB3 TYR 48 0.875 3.510 12.659 386 HD1 TYR 48 HD2 TYR 48 3.350 0.986 11.467 387 HD2 TYR 48 HD1 TYR 48 2.729 4.989 12.917 388 HE1 TYR 48 HE2 TYR 48 5.637 1.606 10.730 389 HE2 TYR 48 HE1 TYR 48 4.966 5.632 12.158 390 HH TYR 48 HH TYR 48 6.920 4.934 11.115 391 H GLN 49 H GLN 49 0.061 3.421 15.519 392 HA GLN 49 HA GLN 49 2.345 4.866 16.529 393 HB2 GLN 49 HB2 GLN 49 -0.595 4.774 17.306 394 HB3 GLN 49 HB3 GLN 49 0.574 5.920 17.994 395 HG2 GLN 49 HG2 GLN 49 0.991 6.922 15.830 396 HG3 GLN 49 HG3 GLN 49 0.089 5.653 15.001 397 HE21 GLN 49 HE22 GLN 49 -1.254 7.249 14.017 398 HE22 GLN 49 HE21 GLN 49 -2.548 8.018 14.894 399 H ARG 50 H ARG 50 0.626 1.968 17.519 400 HA ARG 50 HA ARG 50 1.574 1.977 20.297 401 HB2 ARG 50 HB2 ARG 50 0.240 -0.029 18.433 402 HB3 ARG 50 HB3 ARG 50 0.933 -0.539 19.972 403 HG2 ARG 50 HG2 ARG 50 -1.409 -0.139 20.311 404 HG3 ARG 50 HG3 ARG 50 -0.504 1.114 21.168 405 HD2 ARG 50 HD2 ARG 50 -0.939 2.699 19.325 406 HD3 ARG 50 HD3 ARG 50 -1.813 1.427 18.443 407 HE ARG 50 HE ARG 50 -2.893 1.752 21.090 408 HH11 ARG 50 HH11 ARG 50 -2.868 3.335 17.916 409 HH12 ARG 50 HH12 ARG 50 -4.387 4.140 18.187 410 HH21 ARG 50 HH21 ARG 50 -4.879 2.809 21.396 411 HH22 ARG 50 HH22 ARG 50 -5.526 3.833 20.133 412 H ILE 51 H ILE 51 2.949 1.394 17.242 413 HA ILE 51 HA ILE 51 4.864 -0.591 18.320 414 HB ILE 51 HB ILE 51 4.126 0.325 15.525 415 HG12 ILE 51 HG12 ILE 51 3.699 -2.334 16.964 416 HG13 ILE 51 HG13 ILE 51 2.473 -1.057 16.904 417 HG21 ILE 51 HG21 ILE 51 5.537 -1.516 14.708 418 HG22 ILE 51 HG22 ILE 51 6.508 -0.363 15.648 419 HG23 ILE 51 HG23 ILE 51 6.006 -1.915 16.373 420 HD11 ILE 51 HD11 ILE 51 2.015 -2.693 15.196 421 HD12 ILE 51 HD12 ILE 51 2.468 -1.149 14.445 422 HD13 ILE 51 HD13 ILE 51 3.647 -2.485 14.498 423 H GLN 52 H GLN 52 4.814 2.521 16.456 424 HA GLN 52 HA GLN 52 7.658 2.844 16.613 425 HB2 GLN 52 HB2 GLN 52 5.415 4.844 16.093 426 HB3 GLN 52 HB3 GLN 52 7.136 5.190 15.877 427 HG2 GLN 52 HG2 GLN 52 5.463 3.166 14.372 428 HG3 GLN 52 HG3 GLN 52 6.306 4.596 13.745 429 HE21 GLN 52 HE22 GLN 52 6.454 1.298 13.812 430 HE22 GLN 52 HE21 GLN 52 8.184 1.055 13.705 431 H ALA 53 H ALA 53 5.558 2.828 19.164 432 HA ALA 53 HA ALA 53 6.494 5.057 20.689 433 HB1 ALA 53 HB1 ALA 53 5.379 2.360 21.567 434 HB2 ALA 53 HB2 ALA 53 5.498 3.821 22.578 435 HB3 ALA 53 HB3 ALA 53 4.418 3.804 21.167 436 H GLY 54 H GLY 54 8.075 2.103 19.740 437 HA2 GLY 54 HA2 GLY 54 10.560 2.771 20.680 438 HA3 GLY 54 HA3 GLY 54 9.823 1.971 22.073 439 H LEU 55 H LEU 55 8.741 0.701 19.009 440 HA LEU 55 HA LEU 55 10.792 -1.377 18.903 441 HB2 LEU 55 HB2 LEU 55 9.035 -3.178 19.444 442 HB3 LEU 55 HB3 LEU 55 9.737 -2.246 20.761 443 HG LEU 55 HG LEU 55 7.655 -0.734 20.661 444 HD11 LEU 55 HD11 LEU 55 5.623 -1.732 19.789 445 HD12 LEU 55 HD12 LEU 55 6.785 -1.512 18.465 446 HD13 LEU 55 HD13 LEU 55 6.530 -3.132 19.170 447 HD21 LEU 55 HD21 LEU 55 7.402 -3.642 21.466 448 HD22 LEU 55 HD22 LEU 55 8.138 -2.327 22.423 449 HD23 LEU 55 HD23 LEU 55 6.399 -2.293 22.050 450 H THR 56 H THR 56 9.737 -3.304 17.437 451 HA THR 56 HA THR 56 8.012 -2.134 15.349 452 HB THR 56 HB THR 56 10.655 -3.390 14.551 453 HG1 THR 56 HG1 THR 56 11.115 -1.501 15.698 454 HG21 THR 56 HG21 THR 56 8.593 -1.635 13.142 455 HG22 THR 56 HG22 THR 56 10.180 -2.045 12.460 456 HG23 THR 56 HG23 THR 56 8.994 -3.326 12.760 457 H ALA 57 H ALA 57 8.600 -4.636 17.404 458 HA ALA 57 HA ALA 57 7.107 -6.494 15.675 459 HB1 ALA 57 HB1 ALA 57 8.682 -8.339 16.213 460 HB2 ALA 57 HB2 ALA 57 9.465 -7.048 15.268 461 HB3 ALA 57 HB3 ALA 57 9.754 -7.175 17.020 462 HA PRO 58 HA PRO 58 4.973 -6.917 19.630 463 HB2 PRO 58 HB2 PRO 58 4.013 -9.308 18.067 464 HB3 PRO 58 HB3 PRO 58 3.068 -8.196 19.116 465 HG2 PRO 58 HG2 PRO 58 2.996 -7.915 16.412 466 HG3 PRO 58 HG3 PRO 58 3.193 -6.456 17.447 467 HD2 PRO 58 HD2 PRO 58 5.326 -8.021 15.967 468 HD3 PRO 58 HD3 PRO 58 5.109 -6.248 16.081 469 H ASP 59 H ASP 59 4.539 -8.832 21.110 470 HA ASP 59 HA ASP 59 6.945 -9.900 22.060 471 HB2 ASP 59 HB2 ASP 59 4.758 -9.452 23.247 472 HB3 ASP 59 HB3 ASP 59 4.134 -10.941 22.537 473 H5' U 36 H5' U 36 -3.531 6.904 -12.726 474 H5'' U 36 H5'' U 36 -2.232 7.764 -13.574 475 H4' U 36 H4' U 36 -3.551 6.593 -15.206 476 H3' U 36 H3' U 36 -2.984 9.253 -15.438 477 H2' U 36 H2' U 36 -5.070 9.997 -14.498 478 HO2' U 36 HO2' U 36 -5.502 9.742 -17.308 479 H1' U 36 H1' U 36 -6.419 7.867 -16.181 480 H3 U 36 H3 U 36 -10.572 8.613 -14.657 481 H5 U 36 H5 U 36 -8.176 10.060 -11.522 482 H6 U 36 H6 U 36 -6.221 9.379 -12.783 483 HO5' U 36 HO5' U 36 -3.252 9.084 -12.007 484 H5' C 37 H5' C 37 -1.556 6.792 -16.715 485 H5'' C 37 H5'' C 37 -0.335 7.968 -17.210 486 H4' C 37 H4' C 37 0.896 6.210 -17.873 487 H3' C 37 H3' C 37 -0.397 6.906 -20.138 488 H2' C 37 H2' C 37 -2.413 5.739 -19.825 489 HO2' C 37 HO2' C 37 -1.469 4.874 -21.751 490 H1' C 37 H1' C 37 -1.215 3.217 -18.826 491 H41 C 37 H41 C 37 -6.329 2.908 -15.090 492 H42 C 37 H42 C 37 -6.705 4.604 -15.335 493 H5 C 37 H5 C 37 -5.328 6.071 -16.765 494 H6 C 37 H6 C 37 -3.385 6.156 -18.168 495 H5' A 38 H5' A 38 4.335 5.182 -18.855 496 H5'' A 38 H5'' A 38 2.795 4.726 -18.099 497 H4' A 38 H4' A 38 4.440 7.138 -17.220 498 H3' A 38 H3' A 38 5.493 4.662 -16.955 499 H2' A 38 H2' A 38 3.351 3.691 -16.358 500 HO2' A 38 HO2' A 38 4.702 4.157 -13.891 501 H1' A 38 H1' A 38 3.208 5.833 -14.220 502 H8 A 38 H8 A 38 1.207 3.407 -16.480 503 H61 A 38 H61 A 38 -3.310 4.192 -12.300 504 H62 A 38 H62 A 38 -2.778 3.249 -13.681 505 H2 A 38 H2 A 38 -0.008 7.024 -11.337 506 H5' G 39 H5' G 39 5.133 8.715 -14.766 507 H5'' G 39 H5'' G 39 6.543 9.643 -15.289 508 H4' G 39 H4' G 39 5.809 10.778 -13.379 509 H3' G 39 H3' G 39 8.307 9.800 -13.200 510 H2' G 39 H2' G 39 7.772 7.673 -12.338 511 HO2' G 39 HO2' G 39 8.162 7.627 -10.129 512 H1' G 39 H1' G 39 5.747 8.623 -10.364 513 H8 G 39 H8 G 39 3.554 7.113 -12.448 514 H1 G 39 H1 G 39 7.570 2.442 -10.652 515 H21 G 39 H21 G 39 9.387 3.302 -9.797 516 H22 G 39 H22 G 39 9.643 5.028 -9.655 517 H5' G 40 H5' G 40 7.107 11.035 -8.859 518 H5'' G 40 H5'' G 40 8.104 12.449 -8.488 519 H4' G 40 H4' G 40 7.717 11.070 -6.507 520 H3' G 40 H3' G 40 10.263 12.030 -7.296 521 H2' G 40 H2' G 40 10.974 9.799 -7.873 522 HO2' G 40 HO2' G 40 11.459 10.186 -5.090 523 H1' G 40 H1' G 40 9.353 8.917 -5.455 524 H8 G 40 H8 G 40 9.989 7.588 -9.062 525 H1 G 40 H1 G 40 11.807 3.645 -4.336 526 H21 G 40 H21 G 40 11.559 4.661 -2.365 527 H22 G 40 H22 G 40 10.874 6.262 -2.246 528 H5' A 41 H5' A 41 7.307 14.017 -4.150 529 H5'' A 41 H5'' A 41 7.091 12.727 -5.348 530 H4' A 41 H4' A 41 7.047 15.656 -6.156 531 H3' A 41 H3' A 41 4.971 14.028 -4.747 532 H2' A 41 H2' A 41 3.304 14.482 -6.314 533 HO2' A 41 HO2' A 41 3.097 16.411 -7.204 534 H1' A 41 H1' A 41 4.942 15.003 -8.561 535 H8 A 41 H8 A 41 4.336 11.919 -6.239 536 H61 A 41 H61 A 41 2.184 9.285 -11.451 537 H62 A 41 H62 A 41 2.391 9.051 -9.722 538 H2 A 41 H2 A 41 3.637 13.340 -12.445 539 H5' C 42 H5' C 42 1.688 15.180 -2.346 540 H5'' C 42 H5'' C 42 2.737 14.051 -3.240 541 H4' C 42 H4' C 42 1.342 14.053 -5.142 542 H3' C 42 H3' C 42 0.733 16.644 -4.757 543 H2' C 42 H2' C 42 -0.369 16.320 -2.650 544 HO2' C 42 HO2' C 42 -2.380 16.130 -4.658 545 H1' C 42 H1' C 42 -1.921 13.998 -3.823 546 H41 C 42 H41 C 42 -3.425 13.908 2.388 547 H42 C 42 H42 C 42 -1.735 13.740 2.822 548 H5 C 42 H5 C 42 0.064 13.755 1.173 549 H6 C 42 H6 C 42 0.561 13.981 -1.216 550 H5' A 43 H5' A 43 -2.329 14.496 -7.321 551 H5'' A 43 H5'' A 43 -2.438 14.481 -9.088 552 H4' A 43 H4' A 43 -4.231 15.784 -7.842 553 H3' A 43 H3' A 43 -3.299 16.321 -10.309 554 H2' A 43 H2' A 43 -1.353 17.520 -9.587 555 HO2' A 43 HO2' A 43 -1.754 19.692 -10.097 556 H1' A 43 H1' A 43 -3.068 19.170 -7.751 557 H8 A 43 H8 A 43 -1.182 17.972 -5.255 558 H61 A 43 H61 A 43 3.951 21.024 -6.937 559 H62 A 43 H62 A 43 3.153 20.175 -5.632 560 H2 A 43 H2 A 43 1.225 20.910 -10.436 561 H5' U 44 H5' U 44 -7.629 18.081 -7.251 562 H5'' U 44 H5'' U 44 -5.933 18.584 -7.294 563 H4' U 44 H4' U 44 -7.062 16.514 -5.356 564 H3' U 44 H3' U 44 -6.541 19.488 -5.101 565 HO3' U 44 HO3' U 44 -8.581 17.761 -4.094 566 H2' U 44 H2' U 44 -6.026 19.123 -2.784 567 HO2' U 44 HO2' U 44 -7.593 17.515 -2.294 568 H1' U 44 H1' U 44 -4.368 17.037 -3.279 569 H3 U 44 H3 U 44 -1.895 20.819 -2.449 570 H5 U 44 H5 U 44 -2.903 21.037 -6.526 571 H6 U 44 H6 U 44 -4.341 19.125 -6.216 572 H1 MET 1 H1 MET 1 -0.076 -13.351 4.811 573 H2 MET 1 H2 MET 1 0.870 -12.008 4.728 574 H3 MET 1 H3 MET 1 0.859 -13.086 3.486 575 HA MET 1 HA MET 1 -0.397 -11.154 2.888 576 HB2 MET 1 HB2 MET 1 -1.083 -13.375 2.009 577 HB3 MET 1 HB3 MET 1 -2.127 -13.603 3.422 578 HG2 MET 1 HG2 MET 1 -3.476 -12.882 1.543 579 HG3 MET 1 HG3 MET 1 -3.449 -11.608 2.748 580 HE1 MET 1 HE1 MET 1 -3.789 -9.837 -0.735 581 HE2 MET 1 HE2 MET 1 -4.414 -11.435 -0.239 582 HE3 MET 1 HE3 MET 1 -4.491 -10.070 0.891 583 H LEU 2 H LEU 2 -1.882 -9.545 3.438 584 HA LEU 2 HA LEU 2 -3.486 -9.946 5.893 585 HB2 LEU 2 HB2 LEU 2 -1.220 -8.102 5.565 586 HB3 LEU 2 HB3 LEU 2 -2.716 -7.218 5.870 587 HG LEU 2 HG LEU 2 -1.491 -9.388 7.588 588 HD11 LEU 2 HD11 LEU 2 -0.467 -7.140 7.672 589 HD12 LEU 2 HD12 LEU 2 -2.039 -6.439 8.107 590 HD13 LEU 2 HD13 LEU 2 -1.241 -7.604 9.209 591 HD21 LEU 2 HD21 LEU 2 -4.112 -7.851 7.973 592 HD22 LEU 2 HD22 LEU 2 -3.950 -9.614 7.775 593 HD23 LEU 2 HD23 LEU 2 -3.311 -8.839 9.224 594 H ILE 3 H ILE 3 -5.407 -8.783 5.934 595 HA ILE 3 HA ILE 3 -6.004 -7.033 3.619 596 HB ILE 3 HB ILE 3 -7.757 -9.342 4.586 597 HG12 ILE 3 HG12 ILE 3 -7.610 -9.800 2.007 598 HG13 ILE 3 HG13 ILE 3 -6.110 -8.865 2.080 599 HG21 ILE 3 HG21 ILE 3 -8.217 -7.148 2.525 600 HG22 ILE 3 HG22 ILE 3 -9.254 -8.581 2.745 601 HG23 ILE 3 HG23 ILE 3 -9.118 -7.381 4.042 602 HD11 ILE 3 HD11 ILE 3 -6.769 -11.326 3.762 603 HD12 ILE 3 HD12 ILE 3 -5.770 -11.335 2.286 604 HD13 ILE 3 HD13 ILE 3 -5.196 -10.505 3.735 605 H LEU 4 H LEU 4 -7.193 -5.279 4.171 606 HA LEU 4 HA LEU 4 -8.871 -5.182 6.501 607 HB2 LEU 4 HB2 LEU 4 -7.468 -3.159 7.430 608 HB3 LEU 4 HB3 LEU 4 -7.126 -4.818 7.900 609 HG LEU 4 HG LEU 4 -5.270 -4.935 6.253 610 HD11 LEU 4 HD11 LEU 4 -5.785 -1.947 5.979 611 HD12 LEU 4 HD12 LEU 4 -4.361 -2.826 5.365 612 HD13 LEU 4 HD13 LEU 4 -5.968 -3.157 4.682 613 HD21 LEU 4 HD21 LEU 4 -4.903 -4.419 8.620 614 HD22 LEU 4 HD22 LEU 4 -3.750 -3.541 7.596 615 HD23 LEU 4 HD23 LEU 4 -5.151 -2.688 8.298 616 H THR 5 H THR 5 -9.758 -2.856 6.757 617 HA THR 5 HA THR 5 -10.075 -1.801 3.977 618 HB THR 5 HB THR 5 -12.327 -1.913 6.011 619 HG1 THR 5 HG1 THR 5 -11.644 -4.033 5.610 620 HG21 THR 5 HG21 THR 5 -12.281 -1.796 2.981 621 HG22 THR 5 HG22 THR 5 -13.719 -1.787 4.029 622 HG23 THR 5 HG23 THR 5 -12.599 -0.412 4.068 623 H ARG 6 H ARG 6 -10.516 0.361 3.741 624 HA ARG 6 HA ARG 6 -9.942 2.165 6.030 625 HB2 ARG 6 HB2 ARG 6 -7.845 1.298 4.756 626 HB3 ARG 6 HB3 ARG 6 -8.489 2.133 3.349 627 HG2 ARG 6 HG2 ARG 6 -6.892 3.583 4.186 628 HG3 ARG 6 HG3 ARG 6 -8.395 4.281 4.798 629 HD2 ARG 6 HD2 ARG 6 -6.635 2.363 6.392 630 HD3 ARG 6 HD3 ARG 6 -6.395 4.111 6.398 631 HE ARG 6 HE ARG 6 -9.122 3.357 7.086 632 HH11 ARG 6 HH11 ARG 6 -5.844 3.853 8.320 633 HH12 ARG 6 HH12 ARG 6 -6.395 4.175 9.951 634 HH21 ARG 6 HH21 ARG 6 -9.794 3.764 9.219 635 HH22 ARG 6 HH22 ARG 6 -8.613 4.131 10.452 636 H LYS 7 H LYS 7 -10.282 4.585 5.117 637 HA LYS 7 HA LYS 7 -11.806 4.549 2.576 638 HB2 LYS 7 HB2 LYS 7 -13.409 6.176 3.350 639 HB3 LYS 7 HB3 LYS 7 -13.608 4.646 4.196 640 HG2 LYS 7 HG2 LYS 7 -12.710 5.559 6.217 641 HG3 LYS 7 HG3 LYS 7 -11.974 6.939 5.360 642 HD2 LYS 7 HD2 LYS 7 -14.257 7.728 4.719 643 HD3 LYS 7 HD3 LYS 7 -14.959 6.406 5.674 644 HE2 LYS 7 HE2 LYS 7 -14.985 8.464 6.947 645 HE3 LYS 7 HE3 LYS 7 -13.855 7.309 7.696 646 HZ1 LYS 7 HZ1 LYS 7 -13.106 9.561 5.936 647 HZ2 LYS 7 HZ2 LYS 7 -12.944 9.535 7.567 648 HZ3 LYS 7 HZ3 LYS 7 -12.057 8.512 6.640 649 H VAL 8 H VAL 8 -12.181 6.949 1.862 650 HA VAL 8 HA VAL 8 -9.561 7.823 1.297 651 HB VAL 8 HB VAL 8 -10.519 9.629 0.109 652 HG11 VAL 8 HG11 VAL 8 -12.400 7.224 -0.036 653 HG12 VAL 8 HG12 VAL 8 -12.098 8.407 -1.320 654 HG13 VAL 8 HG13 VAL 8 -10.797 7.317 -0.797 655 HG21 VAL 8 HG21 VAL 8 -12.170 10.511 1.691 656 HG22 VAL 8 HG22 VAL 8 -12.881 10.172 0.100 657 HG23 VAL 8 HG23 VAL 8 -13.173 9.053 1.464 658 H GLY 9 H GLY 9 -8.172 9.170 2.111 659 HA2 GLY 9 HA2 GLY 9 -7.529 11.168 3.223 660 HA3 GLY 9 HA3 GLY 9 -9.037 11.151 4.151 661 H GLU 10 H GLU 10 -7.967 7.995 4.239 662 HA GLU 10 HA GLU 10 -6.565 8.459 6.830 663 HB2 GLU 10 HB2 GLU 10 -8.010 6.003 5.793 664 HB3 GLU 10 HB3 GLU 10 -7.296 6.204 7.403 665 HG2 GLU 10 HG2 GLU 10 -9.622 7.790 6.245 666 HG3 GLU 10 HG3 GLU 10 -9.730 6.524 7.468 667 H SER 11 H SER 11 -5.189 6.204 7.289 668 HA SER 11 HA SER 11 -3.424 5.812 4.930 669 HB2 SER 11 HB2 SER 11 -2.505 6.845 7.635 670 HB3 SER 11 HB3 SER 11 -1.451 6.435 6.272 671 HG SER 11 HG SER 11 -1.902 8.662 6.343 672 H ILE 12 H ILE 12 -1.648 4.302 5.393 673 HA ILE 12 HA ILE 12 -2.074 2.266 7.490 674 HB ILE 12 HB ILE 12 -1.818 1.645 4.516 675 HG12 ILE 12 HG12 ILE 12 -4.210 1.332 6.376 676 HG13 ILE 12 HG13 ILE 12 -4.052 2.508 5.057 677 HG21 ILE 12 HG21 ILE 12 -2.268 -0.270 6.858 678 HG22 ILE 12 HG22 ILE 12 -2.160 -0.719 5.154 679 HG23 ILE 12 HG23 ILE 12 -0.743 -0.079 5.957 680 HD11 ILE 12 HD11 ILE 12 -5.422 0.686 4.282 681 HD12 ILE 12 HD12 ILE 12 -3.860 0.638 3.430 682 HD13 ILE 12 HD13 ILE 12 -4.203 -0.513 4.747 683 H ASN 13 H ASN 13 -0.006 0.819 7.527 684 HA ASN 13 HA ASN 13 2.365 2.328 6.545 685 HB2 ASN 13 HB2 ASN 13 1.677 1.626 9.417 686 HB3 ASN 13 HB3 ASN 13 3.335 1.943 8.888 687 HD21 ASN 13 HD22 ASN 13 3.924 4.047 8.149 688 HD22 ASN 13 HD21 ASN 13 2.942 5.442 8.537 689 H ILE 14 H ILE 14 4.311 1.189 6.516 690 HA ILE 14 HA ILE 14 4.215 -1.731 6.971 691 HB ILE 14 HB ILE 14 5.167 -0.426 4.391 692 HG12 ILE 14 HG12 ILE 14 2.730 -2.182 4.938 693 HG13 ILE 14 HG13 ILE 14 2.700 -0.456 4.549 694 HG21 ILE 14 HG21 ILE 14 4.986 -3.360 5.197 695 HG22 ILE 14 HG22 ILE 14 5.532 -2.735 3.622 696 HG23 ILE 14 HG23 ILE 14 6.487 -2.414 5.065 697 HD11 ILE 14 HD11 ILE 14 3.633 -2.697 2.720 698 HD12 ILE 14 HD12 ILE 14 2.173 -1.700 2.558 699 HD13 ILE 14 HD13 ILE 14 3.774 -0.958 2.355 700 H GLY 15 H GLY 15 6.249 -2.587 7.505 701 HA2 GLY 15 HA2 GLY 15 8.332 -2.516 8.522 702 HA3 GLY 15 HA3 GLY 15 8.745 -1.328 7.272 703 H ASP 16 H ASP 16 9.921 0.062 8.523 704 HA ASP 16 HA ASP 16 8.341 1.682 10.440 705 HB2 ASP 16 HB2 ASP 16 10.271 1.930 11.877 706 HB3 ASP 16 HB3 ASP 16 9.875 0.213 11.702 707 H ASP 17 H ASP 17 9.418 1.689 7.481 708 HA ASP 17 HA ASP 17 10.157 4.556 7.525 709 HB2 ASP 17 HB2 ASP 17 11.615 2.381 5.958 710 HB3 ASP 17 HB3 ASP 17 11.842 4.117 5.739 711 H ILE 18 H ILE 18 7.779 2.513 6.594 712 HA ILE 18 HA ILE 18 7.424 4.007 4.041 713 HB ILE 18 HB ILE 18 6.670 1.099 4.483 714 HG12 ILE 18 HG12 ILE 18 8.357 0.984 2.412 715 HG13 ILE 18 HG13 ILE 18 9.072 2.388 3.207 716 HG21 ILE 18 HG21 ILE 18 6.491 2.935 2.063 717 HG22 ILE 18 HG22 ILE 18 6.174 1.188 2.047 718 HG23 ILE 18 HG23 ILE 18 5.127 2.253 2.986 719 HD11 ILE 18 HD11 ILE 18 10.109 0.236 3.935 720 HD12 ILE 18 HD12 ILE 18 9.313 1.042 5.302 721 HD13 ILE 18 HD13 ILE 18 8.518 -0.327 4.497 722 H THR 19 H THR 19 5.369 4.668 3.549 723 HA THR 19 HA THR 19 3.159 4.060 5.438 724 HB THR 19 HB THR 19 3.999 6.861 4.584 725 HG1 THR 19 HG1 THR 19 5.368 6.015 6.151 726 HG21 THR 19 HG21 THR 19 1.778 5.848 6.414 727 HG22 THR 19 HG22 THR 19 2.314 7.546 6.308 728 HG23 THR 19 HG23 THR 19 1.595 6.758 4.897 729 H ILE 20 H ILE 20 1.082 4.480 4.510 730 HA ILE 20 HA ILE 20 0.998 4.902 1.559 731 HB ILE 20 HB ILE 20 -0.452 2.764 3.173 732 HG12 ILE 20 HG12 ILE 20 1.933 2.212 2.757 733 HG13 ILE 20 HG13 ILE 20 0.797 1.104 1.985 734 HG21 ILE 20 HG21 ILE 20 -0.579 3.461 0.215 735 HG22 ILE 20 HG22 ILE 20 -1.273 1.994 0.937 736 HG23 ILE 20 HG23 ILE 20 -1.894 3.588 1.404 737 HD11 ILE 20 HD11 ILE 20 2.198 3.399 0.554 738 HD12 ILE 20 HD12 ILE 20 2.708 1.697 0.514 739 HD13 ILE 20 HD13 ILE 20 1.146 2.161 -0.185 740 H THR 21 H THR 21 -0.830 6.065 0.900 741 HA THR 21 HA THR 21 -2.816 6.784 3.003 742 HB THR 21 HB THR 21 -1.412 8.817 1.232 743 HG1 THR 21 HG1 THR 21 -0.417 9.445 3.183 744 HG21 THR 21 HG21 THR 21 -2.523 10.444 2.725 745 HG22 THR 21 HG22 THR 21 -3.723 9.403 1.940 746 HG23 THR 21 HG23 THR 21 -3.273 9.116 3.635 747 H ILE 22 H ILE 22 -4.815 6.547 2.239 748 HA ILE 22 HA ILE 22 -5.278 6.238 -0.634 749 HB ILE 22 HB ILE 22 -6.373 4.666 0.704 750 HG12 ILE 22 HG12 ILE 22 -8.737 4.991 0.329 751 HG13 ILE 22 HG13 ILE 22 -8.516 6.746 0.147 752 HG21 ILE 22 HG21 ILE 22 -6.229 5.660 2.895 753 HG22 ILE 22 HG22 ILE 22 -7.420 6.915 2.452 754 HG23 ILE 22 HG23 ILE 22 -7.908 5.210 2.563 755 HD11 ILE 22 HD11 ILE 22 -7.318 4.652 -1.685 756 HD12 ILE 22 HD12 ILE 22 -8.752 5.667 -2.025 757 HD13 ILE 22 HD13 ILE 22 -7.164 6.429 -1.838 758 H LEU 23 H LEU 23 -5.107 8.142 -1.709 759 HA LEU 23 HA LEU 23 -5.711 10.647 -0.449 760 HB2 LEU 23 HB2 LEU 23 -5.359 10.141 -3.414 761 HB3 LEU 23 HB3 LEU 23 -5.096 11.650 -2.527 762 HG LEU 23 HG LEU 23 -3.428 9.110 -2.417 763 HD11 LEU 23 HD11 LEU 23 -2.775 11.969 -3.229 764 HD12 LEU 23 HD12 LEU 23 -1.649 10.590 -3.243 765 HD13 LEU 23 HD13 LEU 23 -3.037 10.617 -4.352 766 HD21 LEU 23 HD21 LEU 23 -3.484 10.057 -0.148 767 HD22 LEU 23 HD22 LEU 23 -1.907 10.351 -0.914 768 HD23 LEU 23 HD23 LEU 23 -3.092 11.671 -0.801 769 H GLY 24 H GLY 24 -7.583 8.428 -2.476 770 HA2 GLY 24 HA2 GLY 24 -10.075 9.160 -1.767 771 HA3 GLY 24 HA3 GLY 24 -9.743 10.390 -2.967 772 H VAL 25 H VAL 25 -11.732 9.147 -3.874 773 HA VAL 25 HA VAL 25 -10.689 7.045 -5.719 774 HB VAL 25 HB VAL 25 -12.687 5.782 -5.580 775 HG11 VAL 25 HG11 VAL 25 -11.047 5.384 -3.771 776 HG12 VAL 25 HG12 VAL 25 -11.914 6.537 -2.734 777 HG13 VAL 25 HG13 VAL 25 -12.714 5.039 -3.261 778 HG21 VAL 25 HG21 VAL 25 -14.347 7.543 -5.412 779 HG22 VAL 25 HG22 VAL 25 -14.573 6.373 -4.108 780 HG23 VAL 25 HG23 VAL 25 -13.804 7.937 -3.754 781 H SER 26 H SER 26 -11.912 6.792 -7.689 782 HA SER 26 HA SER 26 -13.676 8.972 -8.557 783 HB2 SER 26 HB2 SER 26 -11.010 8.354 -9.905 784 HB3 SER 26 HB3 SER 26 -12.283 9.412 -10.560 785 HG SER 26 HG SER 26 -10.669 10.593 -9.472 786 H GLY 27 H GLY 27 -15.273 7.336 -8.752 787 HA2 GLY 27 HA2 GLY 27 -16.357 5.560 -9.801 788 HA3 GLY 27 HA3 GLY 27 -15.118 5.649 -11.076 789 H GLN 28 H GLN 28 -14.560 3.430 -11.232 790 HA GLN 28 HA GLN 28 -13.998 1.890 -8.828 791 HB2 GLN 28 HB2 GLN 28 -13.201 1.383 -11.734 792 HB3 GLN 28 HB3 GLN 28 -12.975 0.260 -10.393 793 HG2 GLN 28 HG2 GLN 28 -15.578 1.173 -11.620 794 HG3 GLN 28 HG3 GLN 28 -14.901 -0.466 -11.491 795 HE21 GLN 28 HE22 GLN 28 -14.363 -1.043 -9.000 796 HE22 GLN 28 HE21 GLN 28 -15.671 -0.693 -7.892 797 H GLN 29 H GLN 29 -12.218 4.268 -10.677 798 HA GLN 29 HA GLN 29 -9.607 3.233 -10.036 799 HB2 GLN 29 HB2 GLN 29 -10.592 5.291 -11.667 800 HB3 GLN 29 HB3 GLN 29 -9.829 6.154 -10.338 801 HG2 GLN 29 HG2 GLN 29 -8.172 5.828 -12.030 802 HG3 GLN 29 HG3 GLN 29 -7.774 4.671 -10.737 803 HE21 GLN 29 HE22 GLN 29 -9.908 4.826 -13.675 804 HE22 GLN 29 HE21 GLN 29 -9.439 3.253 -14.283 805 H VAL 30 H VAL 30 -8.180 3.978 -8.400 806 HA VAL 30 HA VAL 30 -9.389 5.445 -6.122 807 HB VAL 30 HB VAL 30 -7.912 2.774 -5.971 808 HG11 VAL 30 HG11 VAL 30 -9.164 4.474 -3.783 809 HG12 VAL 30 HG12 VAL 30 -8.329 2.917 -3.577 810 HG13 VAL 30 HG13 VAL 30 -7.419 4.352 -4.097 811 HG21 VAL 30 HG21 VAL 30 -10.042 1.942 -4.999 812 HG22 VAL 30 HG22 VAL 30 -10.801 3.513 -5.348 813 HG23 VAL 30 HG23 VAL 30 -10.249 2.470 -6.683 814 H ARG 31 H ARG 31 -8.069 7.141 -5.770 815 HA ARG 31 HA ARG 31 -5.329 7.050 -6.844 816 HB2 ARG 31 HB2 ARG 31 -6.789 9.036 -7.209 817 HB3 ARG 31 HB3 ARG 31 -6.839 9.300 -5.452 818 HG2 ARG 31 HG2 ARG 31 -4.420 9.546 -5.378 819 HG3 ARG 31 HG3 ARG 31 -4.268 9.179 -7.105 820 HD2 ARG 31 HD2 ARG 31 -5.928 11.507 -6.087 821 HD3 ARG 31 HD3 ARG 31 -4.191 11.646 -6.424 822 HE ARG 31 HE ARG 31 -5.373 10.499 -8.707 823 HH11 ARG 31 HH11 ARG 31 -5.555 13.538 -6.895 824 HH12 ARG 31 HH12 ARG 31 -5.911 14.487 -8.321 825 HH21 ARG 31 HH21 ARG 31 -5.848 11.803 -10.551 826 HH22 ARG 31 HH22 ARG 31 -6.062 13.532 -10.343 827 H ILE 32 H ILE 32 -3.589 6.631 -5.647 828 HA ILE 32 HA ILE 32 -3.854 6.653 -2.680 829 HB ILE 32 HB ILE 32 -2.408 4.421 -4.098 830 HG12 ILE 32 HG12 ILE 32 -5.407 4.570 -3.638 831 HG13 ILE 32 HG13 ILE 32 -4.530 4.251 -5.142 832 HG21 ILE 32 HG21 ILE 32 -3.872 4.600 -1.430 833 HG22 ILE 32 HG22 ILE 32 -2.875 3.236 -1.990 834 HG23 ILE 32 HG23 ILE 32 -2.118 4.794 -1.654 835 HD11 ILE 32 HD11 ILE 32 -4.732 2.411 -2.736 836 HD12 ILE 32 HD12 ILE 32 -5.432 2.169 -4.348 837 HD13 ILE 32 HD13 ILE 32 -3.668 2.123 -4.136 838 H GLY 33 H GLY 33 -1.817 6.812 -1.579 839 HA2 GLY 33 HA2 GLY 33 0.435 7.732 -3.309 840 HA3 GLY 33 HA3 GLY 33 -0.019 8.574 -1.816 841 H ILE 34 H ILE 34 2.530 7.536 -2.297 842 HA ILE 34 HA ILE 34 2.780 5.461 -0.196 843 HB ILE 34 HB ILE 34 4.178 5.392 -2.909 844 HG12 ILE 34 HG12 ILE 34 1.987 3.531 -1.889 845 HG13 ILE 34 HG13 ILE 34 1.744 4.811 -3.089 846 HG21 ILE 34 HG21 ILE 34 5.006 3.180 -2.142 847 HG22 ILE 34 HG22 ILE 34 5.520 4.470 -1.052 848 HG23 ILE 34 HG23 ILE 34 4.170 3.412 -0.593 849 HD11 ILE 34 HD11 ILE 34 3.550 2.394 -3.420 850 HD12 ILE 34 HD12 ILE 34 2.022 2.728 -4.254 851 HD13 ILE 34 HD13 ILE 34 3.434 3.761 -4.561 852 H ASN 35 H ASN 35 4.676 5.667 0.994 853 HA ASN 35 HA ASN 35 6.489 7.882 0.223 854 HB2 ASN 35 HB2 ASN 35 4.571 8.694 1.639 855 HB3 ASN 35 HB3 ASN 35 5.142 7.651 2.937 856 HD21 ASN 35 HD22 ASN 35 4.901 10.636 2.711 857 HD22 ASN 35 HD21 ASN 35 6.500 11.273 3.025 858 H ALA 36 H ALA 36 8.334 6.792 0.026 859 HA ALA 36 HA ALA 36 9.416 5.370 2.378 860 HB1 ALA 36 HB1 ALA 36 8.356 3.587 1.020 861 HB2 ALA 36 HB2 ALA 36 9.221 4.172 -0.417 862 HB3 ALA 36 HB3 ALA 36 10.132 3.479 0.940 863 HA PRO 37 HA PRO 37 13.133 7.371 1.022 864 HB2 PRO 37 HB2 PRO 37 15.012 5.441 1.691 865 HB3 PRO 37 HB3 PRO 37 14.241 6.569 2.864 866 HG2 PRO 37 HG2 PRO 37 13.553 3.688 2.243 867 HG3 PRO 37 HG3 PRO 37 13.630 4.490 3.840 868 HD2 PRO 37 HD2 PRO 37 11.292 4.053 2.526 869 HD3 PRO 37 HD3 PRO 37 11.552 5.531 3.506 870 H LYS 38 H LYS 38 14.796 7.273 -0.633 871 HA LYS 38 HA LYS 38 14.118 5.591 -2.885 872 HB2 LYS 38 HB2 LYS 38 16.437 7.481 -2.310 873 HB3 LYS 38 HB3 LYS 38 16.224 6.647 -3.863 874 HG2 LYS 38 HG2 LYS 38 14.108 8.436 -2.593 875 HG3 LYS 38 HG3 LYS 38 15.283 9.013 -3.781 876 HD2 LYS 38 HD2 LYS 38 13.680 6.580 -4.534 877 HD3 LYS 38 HD3 LYS 38 12.817 8.113 -4.392 878 HE2 LYS 38 HE2 LYS 38 13.554 7.819 -6.688 879 HE3 LYS 38 HE3 LYS 38 14.411 9.177 -5.953 880 HZ1 LYS 38 HZ1 LYS 38 15.486 6.448 -6.266 881 HZ2 LYS 38 HZ2 LYS 38 15.872 7.733 -7.207 882 HZ3 LYS 38 HZ3 LYS 38 16.297 7.732 -5.622 883 H ASP 39 H ASP 39 15.668 4.911 -0.072 884 HA ASP 39 HA ASP 39 17.719 3.077 -0.930 885 HB2 ASP 39 HB2 ASP 39 16.078 3.378 1.614 886 HB3 ASP 39 HB3 ASP 39 17.355 2.176 1.431 887 H VAL 40 H VAL 40 14.355 2.982 -1.295 888 HA VAL 40 HA VAL 40 14.418 0.052 -1.774 889 HB VAL 40 HB VAL 40 12.232 -0.222 -0.753 890 HG11 VAL 40 HG11 VAL 40 14.086 1.241 1.180 891 HG12 VAL 40 HG12 VAL 40 12.813 0.091 1.612 892 HG13 VAL 40 HG13 VAL 40 14.242 -0.471 0.705 893 HG21 VAL 40 HG21 VAL 40 11.407 2.115 -1.165 894 HG22 VAL 40 HG22 VAL 40 11.114 1.521 0.484 895 HG23 VAL 40 HG23 VAL 40 12.450 2.651 0.187 896 H ALA 41 H ALA 41 12.376 -0.566 -3.097 897 HA ALA 41 HA ALA 41 12.077 1.570 -5.148 898 HB1 ALA 41 HB1 ALA 41 13.377 -0.426 -5.854 899 HB2 ALA 41 HB2 ALA 41 11.984 -1.462 -5.458 900 HB3 ALA 41 HB3 ALA 41 11.865 -0.262 -6.765 901 H VAL 42 H VAL 42 10.071 1.664 -6.332 902 HA VAL 42 HA VAL 42 7.794 0.100 -5.400 903 HB VAL 42 HB VAL 42 7.535 1.660 -3.700 904 HG11 VAL 42 HG11 VAL 42 8.443 3.813 -5.644 905 HG12 VAL 42 HG12 VAL 42 7.781 4.143 -4.023 906 HG13 VAL 42 HG13 VAL 42 9.283 3.225 -4.191 907 HG21 VAL 42 HG21 VAL 42 5.476 1.517 -5.075 908 HG22 VAL 42 HG22 VAL 42 5.654 3.104 -4.291 909 HG23 VAL 42 HG23 VAL 42 6.012 2.936 -6.015 910 H HIS 43 H HIS 43 6.534 -0.333 -7.100 911 HA HIS 43 HA HIS 43 6.130 1.623 -9.236 912 HB2 HIS 43 HB2 HIS 43 7.174 -1.106 -10.045 913 HB3 HIS 43 HB3 HIS 43 7.011 0.361 -11.009 914 HD2 HIS 43 HD2 HIS 43 9.314 -1.260 -8.366 915 HE1 HIS 43 HE1 HIS 43 11.489 1.940 -10.132 916 HE2 HIS 43 HE2 HIS 43 11.629 -0.036 -8.535 917 H ARG 44 H ARG 44 4.670 0.521 -11.022 918 HA ARG 44 HA ARG 44 2.452 -0.757 -9.669 919 HB2 ARG 44 HB2 ARG 44 2.226 0.863 -11.550 920 HB3 ARG 44 HB3 ARG 44 3.014 -0.290 -12.637 921 HG2 ARG 44 HG2 ARG 44 1.166 -1.884 -12.331 922 HG3 ARG 44 HG3 ARG 44 0.410 -0.808 -11.136 923 HD2 ARG 44 HD2 ARG 44 0.181 0.949 -12.855 924 HD3 ARG 44 HD3 ARG 44 0.920 -0.131 -14.052 925 HE ARG 44 HE ARG 44 -1.323 -1.427 -12.830 926 HH11 ARG 44 HH11 ARG 44 -0.546 1.180 -15.076 927 HH12 ARG 44 HH12 ARG 44 -2.014 0.993 -16.000 928 HH21 ARG 44 HH21 ARG 44 -3.265 -1.628 -14.017 929 HH22 ARG 44 HH22 ARG 44 -3.562 -0.579 -15.384 930 H GLU 45 H GLU 45 1.612 -2.921 -10.311 931 HA GLU 45 HA GLU 45 3.611 -4.873 -10.061 932 HB2 GLU 45 HB2 GLU 45 1.142 -4.972 -9.499 933 HB3 GLU 45 HB3 GLU 45 0.813 -5.276 -11.207 934 HG2 GLU 45 HG2 GLU 45 2.642 -7.000 -9.467 935 HG3 GLU 45 HG3 GLU 45 0.910 -7.307 -9.664 936 H GLU 46 H GLU 46 2.396 -3.246 -12.904 937 HA GLU 46 HA GLU 46 3.210 -5.163 -14.879 938 HB2 GLU 46 HB2 GLU 46 1.624 -3.255 -15.238 939 HB3 GLU 46 HB3 GLU 46 2.959 -2.122 -15.004 940 HG2 GLU 46 HG2 GLU 46 4.116 -3.046 -16.975 941 HG3 GLU 46 HG3 GLU 46 2.862 -4.286 -17.149 942 H ILE 47 H ILE 47 4.787 -2.259 -13.459 943 HA ILE 47 HA ILE 47 7.115 -2.490 -15.169 944 HB ILE 47 HB ILE 47 6.837 -0.919 -12.593 945 HG12 ILE 47 HG12 ILE 47 4.865 -0.335 -13.812 946 HG13 ILE 47 HG13 ILE 47 6.022 0.984 -13.994 947 HG21 ILE 47 HG21 ILE 47 8.445 -0.467 -15.143 948 HG22 ILE 47 HG22 ILE 47 8.356 0.658 -13.768 949 HG23 ILE 47 HG23 ILE 47 9.075 -0.946 -13.552 950 HD11 ILE 47 HD11 ILE 47 6.630 0.090 -16.253 951 HD12 ILE 47 HD12 ILE 47 5.393 -1.179 -16.053 952 HD13 ILE 47 HD13 ILE 47 4.914 0.530 -16.112 953 H TYR 48 H TYR 48 6.132 -3.735 -12.045 954 HA TYR 48 HA TYR 48 8.659 -4.127 -10.839 955 HB2 TYR 48 HB2 TYR 48 6.437 -4.197 -9.745 956 HB3 TYR 48 HB3 TYR 48 6.052 -5.680 -10.610 957 HD1 TYR 48 HD1 TYR 48 8.395 -4.199 -8.109 958 HD2 TYR 48 HD2 TYR 48 6.733 -7.796 -9.787 959 HE1 TYR 48 HE1 TYR 48 9.356 -5.505 -6.236 960 HE2 TYR 48 HE2 TYR 48 7.651 -9.106 -7.917 961 HH TYR 48 HH TYR 48 9.523 -7.576 -5.253 962 H GLN 49 H GLN 49 6.908 -5.977 -13.304 963 HA GLN 49 HA GLN 49 8.411 -8.416 -12.979 964 HB2 GLN 49 HB2 GLN 49 6.703 -7.306 -15.246 965 HB3 GLN 49 HB3 GLN 49 7.380 -8.948 -15.220 966 HG2 GLN 49 HG2 GLN 49 6.134 -9.511 -13.214 967 HG3 GLN 49 HG3 GLN 49 5.612 -7.842 -13.008 968 HE21 GLN 49 HE22 GLN 49 3.401 -8.556 -13.016 969 HE22 GLN 49 HE21 GLN 49 2.580 -8.956 -14.496 970 H ARG 50 H ARG 50 9.030 -5.376 -14.616 971 HA ARG 50 HA ARG 50 11.031 -6.426 -16.480 972 HB2 ARG 50 HB2 ARG 50 10.172 -3.660 -15.536 973 HB3 ARG 50 HB3 ARG 50 11.639 -3.894 -16.476 974 HG2 ARG 50 HG2 ARG 50 9.867 -3.302 -17.982 975 HG3 ARG 50 HG3 ARG 50 10.306 -4.984 -18.282 976 HD2 ARG 50 HD2 ARG 50 8.361 -5.748 -16.975 977 HD3 ARG 50 HD3 ARG 50 7.934 -4.061 -16.620 978 HE ARG 50 HE ARG 50 8.139 -4.245 -19.411 979 HH11 ARG 50 HH11 ARG 50 6.080 -5.644 -16.888 980 HH12 ARG 50 HH12 ARG 50 4.780 -5.997 -17.999 981 HH21 ARG 50 HH21 ARG 50 6.403 -4.658 -20.802 982 HH22 ARG 50 HH22 ARG 50 4.934 -5.383 -20.189 983 H ILE 51 H ILE 51 10.877 -5.672 -13.126 984 HA ILE 51 HA ILE 51 13.771 -5.054 -12.978 985 HB ILE 51 HB ILE 51 11.438 -4.773 -11.044 986 HG12 ILE 51 HG12 ILE 51 13.134 -2.700 -12.507 987 HG13 ILE 51 HG13 ILE 51 11.555 -3.255 -13.068 988 HG21 ILE 51 HG21 ILE 51 14.318 -3.844 -10.724 989 HG22 ILE 51 HG22 ILE 51 12.984 -3.574 -9.574 990 HG23 ILE 51 HG23 ILE 51 13.586 -5.215 -9.847 991 HD11 ILE 51 HD11 ILE 51 12.098 -1.835 -10.436 992 HD12 ILE 51 HD12 ILE 51 11.307 -1.165 -11.884 993 HD13 ILE 51 HD13 ILE 51 10.515 -2.467 -10.972 994 H GLN 52 H GLN 52 11.280 -7.265 -11.542 995 HA GLN 52 HA GLN 52 13.259 -8.735 -10.064 996 HB2 GLN 52 HB2 GLN 52 10.399 -9.439 -10.855 997 HB3 GLN 52 HB3 GLN 52 11.385 -10.350 -9.698 998 HG2 GLN 52 HG2 GLN 52 10.377 -7.510 -9.435 999 HG3 GLN 52 HG3 GLN 52 10.049 -8.915 -8.396 1000 HE21 GLN 52 HE22 GLN 52 11.877 -6.091 -8.703 1001 HE22 GLN 52 HE21 GLN 52 13.164 -6.469 -7.582 1002 H ALA 53 H ALA 53 12.981 -8.519 -13.324 1003 HA ALA 53 HA ALA 53 13.285 -11.231 -14.154 1004 HB1 ALA 53 HB1 ALA 53 14.209 -10.208 -16.201 1005 HB2 ALA 53 HB2 ALA 53 12.743 -9.346 -15.667 1006 HB3 ALA 53 HB3 ALA 53 14.350 -8.645 -15.360 1007 H GLY 54 H GLY 54 15.419 -9.104 -12.374 1008 HA2 GLY 54 HA2 GLY 54 17.186 -10.879 -11.469 1009 HA3 GLY 54 HA3 GLY 54 17.819 -10.666 -13.110 1010 H LEU 55 H LEU 55 16.370 -7.847 -11.462 1011 HA LEU 55 HA LEU 55 18.997 -6.798 -10.714 1012 HB2 LEU 55 HB2 LEU 55 18.900 -5.015 -12.503 1013 HB3 LEU 55 HB3 LEU 55 19.230 -6.655 -13.061 1014 HG LEU 55 HG LEU 55 16.747 -6.874 -13.630 1015 HD11 LEU 55 HD11 LEU 55 16.847 -3.850 -13.228 1016 HD12 LEU 55 HD12 LEU 55 15.558 -4.740 -14.067 1017 HD13 LEU 55 HD13 LEU 55 15.816 -5.002 -12.337 1018 HD21 LEU 55 HD21 LEU 55 18.499 -6.549 -15.265 1019 HD22 LEU 55 HD22 LEU 55 17.037 -5.658 -15.735 1020 HD23 LEU 55 HD23 LEU 55 18.429 -4.780 -15.043 1021 H THR 56 H THR 56 18.782 -4.275 -10.543 1022 HA THR 56 HA THR 56 16.088 -3.344 -9.809 1023 HB THR 56 HB THR 56 17.071 -2.270 -7.713 1024 HG1 THR 56 HG1 THR 56 19.249 -2.663 -8.148 1025 HG21 THR 56 HG21 THR 56 15.524 -4.212 -7.709 1026 HG22 THR 56 HG22 THR 56 16.934 -5.305 -7.713 1027 HG23 THR 56 HG23 THR 56 16.655 -4.213 -6.339 1028 H ALA 57 H ALA 57 18.715 -2.954 -11.648 1029 HA ALA 57 HA ALA 57 18.188 -0.089 -12.002 1030 HB1 ALA 57 HB1 ALA 57 20.960 -1.187 -11.398 1031 HB2 ALA 57 HB2 ALA 57 20.592 0.477 -11.914 1032 HB3 ALA 57 HB3 ALA 57 20.008 -0.125 -10.341 1033 HA PRO 58 HA PRO 58 18.384 -1.807 -16.170 1034 HB2 PRO 58 HB2 PRO 58 18.613 1.138 -16.726 1035 HB3 PRO 58 HB3 PRO 58 17.625 -0.098 -17.569 1036 HG2 PRO 58 HG2 PRO 58 16.477 1.568 -15.745 1037 HG3 PRO 58 HG3 PRO 58 16.070 -0.182 -15.726 1038 HD2 PRO 58 HD2 PRO 58 18.009 1.314 -13.956 1039 HD3 PRO 58 HD3 PRO 58 16.810 0.057 -13.519 1040 H ASP 59 H ASP 59 19.739 -1.341 -18.180 1041 HA ASP 59 HA ASP 59 22.478 -1.745 -17.614 1042 HB2 ASP 59 HB2 ASP 59 21.081 -2.446 -19.628 1043 HB3 ASP 59 HB3 ASP 59 21.219 -0.793 -20.211 1044 H5' U 36 H5' U 36 -12.980 -1.672 7.900 1045 H5'' U 36 H5'' U 36 -13.125 -2.084 9.620 1046 H4' U 36 H4' U 36 -13.132 0.344 9.283 1047 H3' U 36 H3' U 36 -14.932 -1.034 10.907 1048 H2' U 36 H2' U 36 -16.691 -1.001 9.298 1049 HO2' U 36 HO2' U 36 -16.895 1.392 10.823 1050 H1' U 36 H1' U 36 -15.912 1.860 8.659 1051 H3 U 36 H3 U 36 -19.292 2.334 5.718 1052 H5 U 36 H5 U 36 -18.233 -1.712 5.272 1053 H6 U 36 H6 U 36 -16.552 -1.398 6.992 1054 HO5' U 36 HO5' U 36 -14.489 -3.345 8.272 1055 H5' C 37 H5' C 37 -12.283 -1.189 13.214 1056 H5'' C 37 H5'' C 37 -13.748 -1.738 12.378 1057 H4' C 37 H4' C 37 -13.489 -1.347 15.392 1058 H3' C 37 H3' C 37 -12.187 -3.343 14.107 1059 H2' C 37 H2' C 37 -13.951 -4.035 12.724 1060 HO2' C 37 HO2' C 37 -13.271 -5.884 13.920 1061 H1' C 37 H1' C 37 -15.857 -4.009 15.053 1062 H41 C 37 H41 C 37 -20.223 -3.910 10.423 1063 H42 C 37 H42 C 37 -19.027 -3.435 9.229 1064 H5 C 37 H5 C 37 -16.685 -3.011 9.793 1065 H6 C 37 H6 C 37 -15.076 -2.958 11.608 1066 H5' A 38 H5' A 38 -11.751 -6.161 15.872 1067 H5'' A 38 H5'' A 38 -10.599 -6.163 17.217 1068 H4' A 38 H4' A 38 -9.806 -7.558 15.347 1069 H3' A 38 H3' A 38 -8.131 -5.877 16.674 1070 H2' A 38 H2' A 38 -8.686 -3.942 15.302 1071 HO2' A 38 HO2' A 38 -6.369 -5.179 14.211 1072 H1' A 38 H1' A 38 -8.224 -5.735 12.906 1073 H8 A 38 H8 A 38 -9.972 -2.603 14.332 1074 H61 A 38 H61 A 38 -10.621 -0.965 8.392 1075 H62 A 38 H62 A 38 -10.862 -0.460 10.057 1076 H2 A 38 H2 A 38 -9.207 -5.177 8.509 1077 H5' G 39 H5' G 39 -8.294 -9.024 13.332 1078 H5'' G 39 H5'' G 39 -8.135 -10.573 14.170 1079 H4' G 39 H4' G 39 -7.652 -11.209 12.021 1080 H3' G 39 H3' G 39 -5.470 -11.331 13.631 1081 H2' G 39 H2' G 39 -4.578 -9.187 13.146 1082 HO2' G 39 HO2' G 39 -3.559 -10.926 11.150 1083 H1' G 39 H1' G 39 -5.158 -9.314 10.214 1084 H8 G 39 H8 G 39 -7.491 -6.958 11.295 1085 H1 G 39 H1 G 39 -1.672 -4.320 11.931 1086 H21 G 39 H21 G 39 -0.136 -5.870 11.862 1087 H22 G 39 H22 G 39 -0.525 -7.572 11.690 1088 H5' G 40 H5' G 40 -4.327 -12.174 9.145 1089 H5'' G 40 H5'' G 40 -3.925 -13.894 9.185 1090 H4' G 40 H4' G 40 -2.659 -12.704 7.477 1091 H3' G 40 H3' G 40 -1.549 -14.527 9.300 1092 H2' G 40 H2' G 40 -0.509 -12.696 10.543 1093 HO2' G 40 HO2' G 40 1.271 -13.563 8.482 1094 H1' G 40 H1' G 40 0.071 -11.549 7.809 1095 H8 G 40 H8 G 40 -1.042 -10.151 11.272 1096 H1 G 40 H1 G 40 4.562 -7.905 9.086 1097 H21 G 40 H21 G 40 5.111 -8.958 7.194 1098 H22 G 40 H22 G 40 4.055 -10.137 6.462 1099 H5' A 41 H5' A 41 -2.780 -15.292 4.761 1100 H5'' A 41 H5'' A 41 -3.074 -13.928 5.846 1101 H4' A 41 H4' A 41 -4.726 -16.480 5.981 1102 H3' A 41 H3' A 41 -4.861 -14.188 4.056 1103 H2' A 41 H2' A 41 -7.120 -13.766 4.459 1104 HO2' A 41 HO2' A 41 -8.546 -15.356 4.811 1105 H1' A 41 H1' A 41 -7.310 -14.858 7.066 1106 H8 A 41 H8 A 41 -5.357 -11.904 5.420 1107 H61 A 41 H61 A 41 -8.785 -8.419 9.272 1108 H62 A 41 H62 A 41 -7.608 -8.363 7.975 1109 H2 A 41 H2 A 41 -9.782 -12.662 9.996 1110 H5' C 42 H5' C 42 -6.644 -13.941 0.195 1111 H5'' C 42 H5'' C 42 -5.793 -13.308 1.618 1112 H4' C 42 H4' C 42 -7.800 -12.543 2.633 1113 H3' C 42 H3' C 42 -9.187 -14.585 1.544 1114 H2' C 42 H2' C 42 -8.832 -13.932 -0.731 1115 HO2' C 42 HO2' C 42 -11.256 -12.659 0.046 1116 H1' C 42 H1' C 42 -9.566 -11.084 -0.029 1117 H41 C 42 H41 C 42 -7.606 -10.690 -6.092 1118 H42 C 42 H42 C 42 -6.050 -11.393 -5.681 1119 H5 C 42 H5 C 42 -5.520 -12.184 -3.427 1120 H6 C 42 H6 C 42 -6.420 -12.457 -1.159 1121 H5' A 43 H5' A 43 -11.746 -11.023 2.750 1122 H5'' A 43 H5'' A 43 -12.709 -10.814 4.216 1123 H4' A 43 H4' A 43 -13.982 -11.170 2.051 1124 H3' A 43 H3' A 43 -14.812 -11.861 4.511 1125 H2' A 43 H2' A 43 -13.522 -13.914 4.601 1126 HO2' A 43 HO2' A 43 -15.075 -15.577 4.488 1127 H1' A 43 H1' A 43 -14.690 -14.649 1.916 1128 H8 A 43 H8 A 43 -11.497 -14.759 0.860 1129 H61 A 43 H61 A 43 -10.092 -19.918 4.010 1130 H62 A 43 H62 A 43 -9.602 -18.870 2.692 1131 H2 A 43 H2 A 43 -13.757 -18.195 5.791 1132 H5' U 44 H5' U 44 -14.540 -9.942 0.583 1133 H5'' U 44 H5'' U 44 -16.022 -9.677 -0.356 1134 H4' U 44 H4' U 44 -14.204 -10.154 -1.882 1135 H3' U 44 H3' U 44 -16.016 -12.571 -1.574 1136 HO3' U 44 HO3' U 44 -16.959 -11.655 -3.455 1137 H2' U 44 H2' U 44 -14.816 -13.445 -3.457 1138 HO2' U 44 HO2' U 44 -14.701 -11.424 -4.649 1139 H1' U 44 H1' U 44 -12.365 -12.587 -2.514 1140 H3 U 44 H3 U 44 -12.103 -17.090 -2.192 1141 H5 U 44 H5 U 44 -15.193 -16.123 0.484 1142 H6 U 44 H6 U 44 -14.961 -13.803 -0.166 Start of MODEL 2 1 H1 MET 1 H1 MET 1 8.689 10.365 -1.278 2 H2 MET 1 H2 MET 1 8.737 10.785 -2.863 3 H3 MET 1 H3 MET 1 8.694 9.193 -2.440 4 HA MET 1 HA MET 1 6.503 9.418 -1.539 5 HB2 MET 1 HB2 MET 1 6.736 11.818 -0.890 6 HB3 MET 1 HB3 MET 1 6.732 12.265 -2.608 7 HG2 MET 1 HG2 MET 1 4.505 12.604 -1.720 8 HG3 MET 1 HG3 MET 1 4.453 11.246 -2.830 9 HE1 MET 1 HE1 MET 1 2.272 10.197 -2.075 10 HE2 MET 1 HE2 MET 1 1.726 10.192 -0.378 11 HE3 MET 1 HE3 MET 1 2.119 11.736 -1.205 12 H LEU 2 H LEU 2 4.946 8.530 -2.904 13 HA LEU 2 HA LEU 2 5.042 9.315 -5.766 14 HB2 LEU 2 HB2 LEU 2 5.640 6.685 -4.545 15 HB3 LEU 2 HB3 LEU 2 4.402 6.616 -5.817 16 HG LEU 2 HG LEU 2 7.176 7.801 -6.129 17 HD11 LEU 2 HD11 LEU 2 7.590 5.816 -7.525 18 HD12 LEU 2 HD12 LEU 2 7.137 5.338 -5.870 19 HD13 LEU 2 HD13 LEU 2 5.950 5.208 -7.183 20 HD21 LEU 2 HD21 LEU 2 5.562 8.892 -7.659 21 HD22 LEU 2 HD22 LEU 2 6.591 7.764 -8.557 22 HD23 LEU 2 HD23 LEU 2 4.924 7.302 -8.142 23 H ILE 3 H ILE 3 3.052 9.000 -6.863 24 HA ILE 3 HA ILE 3 0.702 8.256 -5.213 25 HB ILE 3 HB ILE 3 0.972 10.811 -6.869 26 HG12 ILE 3 HG12 ILE 3 -0.001 11.669 -4.568 27 HG13 ILE 3 HG13 ILE 3 0.706 10.187 -3.912 28 HG21 ILE 3 HG21 ILE 3 -1.444 9.622 -5.455 29 HG22 ILE 3 HG22 ILE 3 -1.359 11.226 -6.216 30 HG23 ILE 3 HG23 ILE 3 -1.246 9.775 -7.221 31 HD11 ILE 3 HD11 ILE 3 2.150 12.414 -5.418 32 HD12 ILE 3 HD12 ILE 3 2.220 12.104 -3.675 33 HD13 ILE 3 HD13 ILE 3 2.950 10.944 -4.799 34 H LEU 4 H LEU 4 -0.993 7.375 -6.452 35 HA LEU 4 HA LEU 4 -0.528 6.859 -9.334 36 HB2 LEU 4 HB2 LEU 4 -0.794 4.736 -7.163 37 HB3 LEU 4 HB3 LEU 4 -0.899 4.416 -8.893 38 HG LEU 4 HG LEU 4 1.573 5.509 -7.478 39 HD11 LEU 4 HD11 LEU 4 0.767 2.753 -8.483 40 HD12 LEU 4 HD12 LEU 4 2.406 3.189 -7.910 41 HD13 LEU 4 HD13 LEU 4 1.015 3.238 -6.798 42 HD21 LEU 4 HD21 LEU 4 1.485 6.171 -9.862 43 HD22 LEU 4 HD22 LEU 4 2.690 4.897 -9.619 44 HD23 LEU 4 HD23 LEU 4 1.098 4.496 -10.316 45 H THR 5 H THR 5 -2.438 5.765 -10.313 46 HA THR 5 HA THR 5 -4.834 5.767 -8.570 47 HB THR 5 HB THR 5 -5.191 6.591 -11.440 48 HG1 THR 5 HG1 THR 5 -3.676 8.059 -10.618 49 HG21 THR 5 HG21 THR 5 -6.568 7.308 -8.822 50 HG22 THR 5 HG22 THR 5 -7.164 7.634 -10.473 51 HG23 THR 5 HG23 THR 5 -7.059 5.964 -9.878 52 H ARG 6 H ARG 6 -4.998 3.705 -8.285 53 HA ARG 6 HA ARG 6 -4.829 1.769 -10.539 54 HB2 ARG 6 HB2 ARG 6 -3.480 1.671 -8.314 55 HB3 ARG 6 HB3 ARG 6 -5.021 1.412 -7.512 56 HG2 ARG 6 HG2 ARG 6 -4.149 -0.700 -7.682 57 HG3 ARG 6 HG3 ARG 6 -5.268 -0.659 -9.055 58 HD2 ARG 6 HD2 ARG 6 -2.318 0.043 -9.335 59 HD3 ARG 6 HD3 ARG 6 -2.875 -1.640 -9.350 60 HE ARG 6 HE ARG 6 -4.388 -0.099 -11.233 61 HH11 ARG 6 HH11 ARG 6 -1.224 -1.602 -10.746 62 HH12 ARG 6 HH12 ARG 6 -0.930 -1.793 -12.460 63 HH21 ARG 6 HH21 ARG 6 -4.000 -0.389 -13.426 64 HH22 ARG 6 HH22 ARG 6 -2.518 -1.135 -13.986 65 H LYS 7 H LYS 7 -6.669 0.126 -10.688 66 HA LYS 7 HA LYS 7 -9.058 0.997 -9.114 67 HB2 LYS 7 HB2 LYS 7 -10.533 0.209 -10.829 68 HB3 LYS 7 HB3 LYS 7 -9.583 1.565 -11.396 69 HG2 LYS 7 HG2 LYS 7 -8.264 0.150 -12.816 70 HG3 LYS 7 HG3 LYS 7 -8.791 -1.326 -11.961 71 HD2 LYS 7 HD2 LYS 7 -11.098 -0.994 -12.708 72 HD3 LYS 7 HD3 LYS 7 -10.664 0.526 -13.499 73 HE2 LYS 7 HE2 LYS 7 -10.880 -1.370 -15.069 74 HE3 LYS 7 HE3 LYS 7 -9.266 -0.622 -15.100 75 HZ1 LYS 7 HZ1 LYS 7 -8.422 -2.404 -13.827 76 HZ2 LYS 7 HZ2 LYS 7 -9.914 -3.075 -13.606 77 HZ3 LYS 7 HZ3 LYS 7 -9.221 -3.054 -15.094 78 H VAL 8 H VAL 8 -10.757 -0.835 -9.076 79 HA VAL 8 HA VAL 8 -9.589 -2.708 -7.344 80 HB VAL 8 HB VAL 8 -11.750 -3.683 -7.132 81 HG11 VAL 8 HG11 VAL 8 -12.047 -0.699 -7.726 82 HG12 VAL 8 HG12 VAL 8 -13.065 -1.665 -6.641 83 HG13 VAL 8 HG13 VAL 8 -11.360 -1.380 -6.230 84 HG21 VAL 8 HG21 VAL 8 -12.435 -3.947 -9.464 85 HG22 VAL 8 HG22 VAL 8 -13.648 -3.062 -8.508 86 HG23 VAL 8 HG23 VAL 8 -12.579 -2.184 -9.642 87 H GLY 9 H GLY 9 -8.864 -4.679 -7.422 88 HA2 GLY 9 HA2 GLY 9 -8.601 -6.858 -8.256 89 HA3 GLY 9 HA3 GLY 9 -9.267 -6.349 -9.827 90 H GLU 10 H GLU 10 -7.014 -4.018 -8.944 91 HA GLU 10 HA GLU 10 -4.899 -5.374 -10.548 92 HB2 GLU 10 HB2 GLU 10 -5.431 -2.426 -10.062 93 HB3 GLU 10 HB3 GLU 10 -4.163 -3.105 -11.113 94 HG2 GLU 10 HG2 GLU 10 -5.863 -4.132 -12.547 95 HG3 GLU 10 HG3 GLU 10 -7.158 -3.552 -11.494 96 H SER 11 H SER 11 -2.636 -4.065 -9.965 97 HA SER 11 HA SER 11 -2.290 -4.260 -7.029 98 HB2 SER 11 HB2 SER 11 -0.950 -6.082 -9.046 99 HB3 SER 11 HB3 SER 11 -0.497 -5.963 -7.326 100 HG SER 11 HG SER 11 -1.973 -7.670 -7.788 101 H ILE 12 H ILE 12 0.065 -4.114 -6.460 102 HA ILE 12 HA ILE 12 1.728 -2.277 -8.037 103 HB ILE 12 HB ILE 12 0.662 -1.515 -5.282 104 HG12 ILE 12 HG12 ILE 12 -0.072 -0.335 -7.991 105 HG13 ILE 12 HG13 ILE 12 -1.131 -1.315 -6.954 106 HG21 ILE 12 HG21 ILE 12 1.799 0.644 -5.675 107 HG22 ILE 12 HG22 ILE 12 2.963 -0.659 -5.786 108 HG23 ILE 12 HG23 ILE 12 2.336 0.092 -7.270 109 HD11 ILE 12 HD11 ILE 12 -0.018 1.417 -6.256 110 HD12 ILE 12 HD12 ILE 12 -1.695 1.005 -6.657 111 HD13 ILE 12 HD13 ILE 12 -0.962 0.380 -5.162 112 H ASN 13 H ASN 13 3.909 -2.085 -6.903 113 HA ASN 13 HA ASN 13 4.351 -4.258 -4.909 114 HB2 ASN 13 HB2 ASN 13 5.768 -3.885 -7.567 115 HB3 ASN 13 HB3 ASN 13 6.543 -4.686 -6.201 116 HD21 ASN 13 HD22 ASN 13 3.281 -4.785 -7.719 117 HD22 ASN 13 HD21 ASN 13 3.187 -6.535 -7.789 118 H ILE 14 H ILE 14 6.224 -4.086 -3.668 119 HA ILE 14 HA ILE 14 7.680 -1.506 -3.722 120 HB ILE 14 HB ILE 14 6.393 -2.682 -1.222 121 HG12 ILE 14 HG12 ILE 14 5.644 -0.221 -2.858 122 HG13 ILE 14 HG13 ILE 14 4.685 -1.699 -2.699 123 HG21 ILE 14 HG21 ILE 14 7.931 -0.088 -1.681 124 HG22 ILE 14 HG22 ILE 14 7.196 -0.609 -0.147 125 HG23 ILE 14 HG23 ILE 14 8.547 -1.519 -0.821 126 HD11 ILE 14 HD11 ILE 14 4.527 -1.290 -0.225 127 HD12 ILE 14 HD12 ILE 14 5.327 0.283 -0.483 128 HD13 ILE 14 HD13 ILE 14 3.758 -0.035 -1.229 129 H GLY 15 H GLY 15 9.794 -1.690 -2.900 130 HA2 GLY 15 HA2 GLY 15 11.804 -2.817 -2.694 131 HA3 GLY 15 HA3 GLY 15 10.939 -3.866 -1.554 132 H ASP 16 H ASP 16 11.764 -5.818 -2.137 133 HA ASP 16 HA ASP 16 10.890 -6.836 -4.787 134 HB2 ASP 16 HB2 ASP 16 13.326 -6.391 -4.803 135 HB3 ASP 16 HB3 ASP 16 13.513 -7.423 -3.378 136 H ASP 17 H ASP 17 10.123 -6.815 -1.721 137 HA ASP 17 HA ASP 17 9.425 -9.692 -1.636 138 HB2 ASP 17 HB2 ASP 17 10.592 -8.149 0.722 139 HB3 ASP 17 HB3 ASP 17 10.019 -9.816 0.735 140 H ILE 18 H ILE 18 8.148 -6.714 -1.915 141 HA ILE 18 HA ILE 18 5.886 -7.440 -0.129 142 HB ILE 18 HB ILE 18 6.901 -4.609 -0.581 143 HG12 ILE 18 HG12 ILE 18 7.091 -4.904 2.071 144 HG13 ILE 18 HG13 ILE 18 7.387 -6.594 1.638 145 HG21 ILE 18 HG21 ILE 18 5.232 -4.065 1.188 146 HG22 ILE 18 HG22 ILE 18 4.485 -4.687 -0.287 147 HG23 ILE 18 HG23 ILE 18 4.654 -5.743 1.134 148 HD11 ILE 18 HD11 ILE 18 9.255 -5.865 0.157 149 HD12 ILE 18 HD12 ILE 18 8.880 -4.168 0.527 150 HD13 ILE 18 HD13 ILE 18 9.479 -5.248 1.809 151 H THR 19 H THR 19 3.843 -7.035 -0.914 152 HA THR 19 HA THR 19 3.561 -5.824 -3.607 153 HB THR 19 HB THR 19 2.406 -8.529 -2.798 154 HG1 THR 19 HG1 THR 19 3.862 -9.320 -4.346 155 HG21 THR 19 HG21 THR 19 1.843 -8.652 -5.240 156 HG22 THR 19 HG22 THR 19 0.949 -7.381 -4.386 157 HG23 THR 19 HG23 THR 19 2.352 -6.956 -5.407 158 H ILE 20 H ILE 20 1.363 -5.180 -4.046 159 HA ILE 20 HA ILE 20 -0.437 -4.945 -1.684 160 HB ILE 20 HB ILE 20 0.471 -2.712 -3.545 161 HG12 ILE 20 HG12 ILE 20 2.157 -3.272 -1.798 162 HG13 ILE 20 HG13 ILE 20 1.493 -1.646 -1.655 163 HG21 ILE 20 HG21 ILE 20 -1.556 -2.718 -1.273 164 HG22 ILE 20 HG22 ILE 20 -0.911 -1.246 -2.042 165 HG23 ILE 20 HG23 ILE 20 -1.863 -2.393 -2.992 166 HD11 ILE 20 HD11 ILE 20 0.545 -4.020 -0.001 167 HD12 ILE 20 HD12 ILE 20 1.724 -2.804 0.539 168 HD13 ILE 20 HD13 ILE 20 0.054 -2.317 0.199 169 H THR 21 H THR 21 -2.621 -4.892 -2.256 170 HA THR 21 HA THR 21 -3.320 -4.937 -5.139 171 HB THR 21 HB THR 21 -4.133 -7.096 -3.145 172 HG1 THR 21 HG1 THR 21 -2.383 -7.192 -5.360 173 HG21 THR 21 HG21 THR 21 -5.056 -8.230 -5.134 174 HG22 THR 21 HG22 THR 21 -5.850 -6.667 -4.883 175 HG23 THR 21 HG23 THR 21 -4.610 -6.832 -6.146 176 H ILE 22 H ILE 22 -5.391 -4.247 -5.554 177 HA ILE 22 HA ILE 22 -6.867 -3.089 -3.240 178 HB ILE 22 HB ILE 22 -6.210 -1.371 -4.676 179 HG12 ILE 22 HG12 ILE 22 -8.223 -0.456 -5.650 180 HG13 ILE 22 HG13 ILE 22 -9.006 -2.053 -5.661 181 HG21 ILE 22 HG21 ILE 22 -5.440 -2.604 -6.594 182 HG22 ILE 22 HG22 ILE 22 -7.114 -3.052 -7.039 183 HG23 ILE 22 HG23 ILE 22 -6.583 -1.358 -7.117 184 HD11 ILE 22 HD11 ILE 22 -8.120 -0.572 -3.166 185 HD12 ILE 22 HD12 ILE 22 -9.789 -0.687 -3.800 186 HD13 ILE 22 HD13 ILE 22 -8.951 -2.153 -3.241 187 H LEU 23 H LEU 23 -8.193 -4.692 -2.529 188 HA LEU 23 HA LEU 23 -9.222 -6.726 -4.258 189 HB2 LEU 23 HB2 LEU 23 -10.286 -5.954 -1.522 190 HB3 LEU 23 HB3 LEU 23 -10.458 -7.494 -2.361 191 HG LEU 23 HG LEU 23 -8.006 -6.334 -1.025 192 HD11 LEU 23 HD11 LEU 23 -8.056 -8.568 0.084 193 HD12 LEU 23 HD12 LEU 23 -9.584 -7.686 0.315 194 HD13 LEU 23 HD13 LEU 23 -9.486 -9.000 -0.878 195 HD21 LEU 23 HD21 LEU 23 -8.085 -8.664 -2.968 196 HD22 LEU 23 HD22 LEU 23 -7.144 -7.156 -3.136 197 HD23 LEU 23 HD23 LEU 23 -6.744 -8.310 -1.846 198 H GLY 24 H GLY 24 -10.551 -3.589 -3.199 199 HA2 GLY 24 HA2 GLY 24 -12.224 -3.175 -5.295 200 HA3 GLY 24 HA3 GLY 24 -13.218 -4.198 -4.285 201 H VAL 25 H VAL 25 -14.514 -2.047 -4.473 202 HA VAL 25 HA VAL 25 -13.857 -0.409 -2.078 203 HB VAL 25 HB VAL 25 -14.410 1.638 -3.160 204 HG11 VAL 25 HG11 VAL 25 -12.096 0.787 -3.550 205 HG12 VAL 25 HG12 VAL 25 -12.645 0.099 -5.100 206 HG13 VAL 25 HG13 VAL 25 -12.679 1.858 -4.844 207 HG21 VAL 25 HG21 VAL 25 -15.024 1.770 -5.557 208 HG22 VAL 25 HG22 VAL 25 -15.140 -0.005 -5.610 209 HG23 VAL 25 HG23 VAL 25 -16.240 0.947 -4.572 210 H SER 26 H SER 26 -15.692 0.806 -1.246 211 HA SER 26 HA SER 26 -18.384 0.046 -2.118 212 HB2 SER 26 HB2 SER 26 -17.775 -1.785 -0.587 213 HB3 SER 26 HB3 SER 26 -17.342 -0.612 0.671 214 HG SER 26 HG SER 26 -19.488 0.077 0.697 215 H GLY 27 H GLY 27 -18.585 2.302 -2.604 216 HA2 GLY 27 HA2 GLY 27 -19.292 4.445 -2.038 217 HA3 GLY 27 HA3 GLY 27 -19.262 3.973 -0.330 218 H GLN 28 H GLN 28 -17.541 4.645 0.946 219 HA GLN 28 HA GLN 28 -15.270 5.977 -0.475 220 HB2 GLN 28 HB2 GLN 28 -16.108 6.181 2.449 221 HB3 GLN 28 HB3 GLN 28 -14.786 7.050 1.670 222 HG2 GLN 28 HG2 GLN 28 -17.747 7.434 1.291 223 HG3 GLN 28 HG3 GLN 28 -16.508 8.585 1.845 224 HE21 GLN 28 HE22 GLN 28 -14.554 8.648 0.024 225 HE22 GLN 28 HE21 GLN 28 -15.144 8.930 -1.600 226 H GLN 29 H GLN 29 -16.238 3.217 1.406 227 HA GLN 29 HA GLN 29 -13.632 2.715 2.548 228 HB2 GLN 29 HB2 GLN 29 -16.022 0.856 2.074 229 HB3 GLN 29 HB3 GLN 29 -14.537 0.422 2.907 230 HG2 GLN 29 HG2 GLN 29 -16.153 0.984 4.580 231 HG3 GLN 29 HG3 GLN 29 -14.849 2.183 4.555 232 HE21 GLN 29 HE22 GLN 29 -15.524 4.216 4.775 233 HE22 GLN 29 HE21 GLN 29 -17.043 4.851 4.167 234 H VAL 30 H VAL 30 -12.068 1.296 1.854 235 HA VAL 30 HA VAL 30 -12.170 0.349 -0.958 236 HB VAL 30 HB VAL 30 -9.998 2.049 0.367 237 HG11 VAL 30 HG11 VAL 30 -10.109 0.942 -2.462 238 HG12 VAL 30 HG12 VAL 30 -8.799 1.896 -1.718 239 HG13 VAL 30 HG13 VAL 30 -9.123 0.243 -1.154 240 HG21 VAL 30 HG21 VAL 30 -10.489 3.647 -1.472 241 HG22 VAL 30 HG22 VAL 30 -11.834 2.612 -1.999 242 HG23 VAL 30 HG23 VAL 30 -11.890 3.410 -0.411 243 H ARG 31 H ARG 31 -11.953 -1.819 -0.656 244 HA ARG 31 HA ARG 31 -10.578 -2.803 1.734 245 HB2 ARG 31 HB2 ARG 31 -12.727 -3.762 0.738 246 HB3 ARG 31 HB3 ARG 31 -11.711 -4.466 -0.539 247 HG2 ARG 31 HG2 ARG 31 -10.361 -5.643 1.174 248 HG3 ARG 31 HG3 ARG 31 -11.264 -4.825 2.456 249 HD2 ARG 31 HD2 ARG 31 -13.372 -5.872 1.445 250 HD3 ARG 31 HD3 ARG 31 -12.272 -6.942 0.551 251 HE ARG 31 HE ARG 31 -12.342 -6.672 3.539 252 HH11 ARG 31 HH11 ARG 31 -11.987 -8.723 0.658 253 HH12 ARG 31 HH12 ARG 31 -11.743 -10.172 1.623 254 HH21 ARG 31 HH21 ARG 31 -12.046 -8.604 4.708 255 HH22 ARG 31 HH22 ARG 31 -11.785 -10.104 3.842 256 H ILE 32 H ILE 32 -8.514 -3.360 1.803 257 HA ILE 32 HA ILE 32 -7.018 -3.549 -0.781 258 HB ILE 32 HB ILE 32 -5.899 -2.226 1.701 259 HG12 ILE 32 HG12 ILE 32 -7.550 -0.949 -0.504 260 HG13 ILE 32 HG13 ILE 32 -7.864 -0.964 1.240 261 HG21 ILE 32 HG21 ILE 32 -5.230 -1.967 -1.262 262 HG22 ILE 32 HG22 ILE 32 -4.354 -1.201 0.084 263 HG23 ILE 32 HG23 ILE 32 -4.324 -2.959 -0.096 264 HD11 ILE 32 HD11 ILE 32 -7.013 1.211 0.635 265 HD12 ILE 32 HD12 ILE 32 -5.782 0.371 1.602 266 HD13 ILE 32 HD13 ILE 32 -5.602 0.497 -0.166 267 H GLY 33 H GLY 33 -5.039 -4.771 -0.697 268 HA2 GLY 33 HA2 GLY 33 -4.782 -6.573 1.664 269 HA3 GLY 33 HA3 GLY 33 -4.735 -7.196 0.001 270 H ILE 34 H ILE 34 -2.658 -7.437 1.955 271 HA ILE 34 HA ILE 34 -0.424 -6.001 0.631 272 HB ILE 34 HB ILE 34 -0.829 -6.201 3.649 273 HG12 ILE 34 HG12 ILE 34 -1.008 -3.686 1.944 274 HG13 ILE 34 HG13 ILE 34 -2.416 -4.571 2.557 275 HG21 ILE 34 HG21 ILE 34 1.284 -4.790 1.969 276 HG22 ILE 34 HG22 ILE 34 1.159 -4.688 3.736 277 HG23 ILE 34 HG23 ILE 34 1.519 -6.239 2.973 278 HD11 ILE 34 HD11 ILE 34 -1.566 -4.306 4.875 279 HD12 ILE 34 HD12 ILE 34 -0.280 -3.237 4.252 280 HD13 ILE 34 HD13 ILE 34 -1.979 -2.764 4.082 281 H ASN 35 H ASN 35 1.489 -7.189 0.640 282 HA ASN 35 HA ASN 35 1.402 -9.830 1.984 283 HB2 ASN 35 HB2 ASN 35 0.434 -9.946 -0.326 284 HB3 ASN 35 HB3 ASN 35 1.988 -9.431 -0.974 285 HD21 ASN 35 HD22 ASN 35 0.477 -11.964 -1.376 286 HD22 ASN 35 HD21 ASN 35 1.526 -13.254 -0.838 287 H ALA 36 H ALA 36 3.110 -9.689 3.272 288 HA ALA 36 HA ALA 36 5.771 -9.209 2.089 289 HB1 ALA 36 HB1 ALA 36 6.359 -7.665 3.958 290 HB2 ALA 36 HB2 ALA 36 5.071 -6.980 2.935 291 HB3 ALA 36 HB3 ALA 36 4.687 -7.698 4.517 292 HA PRO 37 HA PRO 37 6.838 -12.463 4.880 293 HB2 PRO 37 HB2 PRO 37 9.397 -11.692 5.643 294 HB3 PRO 37 HB3 PRO 37 8.989 -12.455 4.061 295 HG2 PRO 37 HG2 PRO 37 9.367 -9.521 4.722 296 HG3 PRO 37 HG3 PRO 37 10.007 -10.439 3.318 297 HD2 PRO 37 HD2 PRO 37 7.781 -8.913 3.116 298 HD3 PRO 37 HD3 PRO 37 7.901 -10.509 2.294 299 H LYS 38 H LYS 38 7.162 -12.922 7.163 300 HA LYS 38 HA LYS 38 6.234 -10.848 8.952 301 HB2 LYS 38 HB2 LYS 38 7.446 -13.611 9.441 302 HB3 LYS 38 HB3 LYS 38 6.713 -12.611 10.712 303 HG2 LYS 38 HG2 LYS 38 5.221 -13.437 8.178 304 HG3 LYS 38 HG3 LYS 38 5.168 -14.379 9.675 305 HD2 LYS 38 HD2 LYS 38 4.499 -11.419 9.723 306 HD3 LYS 38 HD3 LYS 38 3.328 -12.603 9.137 307 HE2 LYS 38 HE2 LYS 38 3.540 -13.872 11.250 308 HE3 LYS 38 HE3 LYS 38 4.733 -12.704 11.850 309 HZ1 LYS 38 HZ1 LYS 38 3.038 -11.013 11.731 310 HZ2 LYS 38 HZ2 LYS 38 1.940 -12.106 11.148 311 HZ3 LYS 38 HZ3 LYS 38 2.529 -12.250 12.679 312 H ASP 39 H ASP 39 9.054 -11.254 7.431 313 HA ASP 39 HA ASP 39 11.033 -10.514 9.347 314 HB2 ASP 39 HB2 ASP 39 11.238 -11.444 6.931 315 HB3 ASP 39 HB3 ASP 39 10.962 -9.795 6.394 316 H VAL 40 H VAL 40 8.344 -8.819 8.095 317 HA VAL 40 HA VAL 40 9.425 -6.220 9.037 318 HB VAL 40 HB VAL 40 8.519 -5.062 7.103 319 HG11 VAL 40 HG11 VAL 40 10.172 -7.441 6.135 320 HG12 VAL 40 HG12 VAL 40 10.018 -5.850 5.358 321 HG13 VAL 40 HG13 VAL 40 10.841 -5.992 6.924 322 HG21 VAL 40 HG21 VAL 40 6.613 -6.588 6.634 323 HG22 VAL 40 HG22 VAL 40 7.562 -6.180 5.195 324 HG23 VAL 40 HG23 VAL 40 7.765 -7.769 5.959 325 H ALA 41 H ALA 41 7.552 -4.589 9.226 326 HA ALA 41 HA ALA 41 5.257 -6.064 10.423 327 HB1 ALA 41 HB1 ALA 41 5.029 -4.092 11.882 328 HB2 ALA 41 HB2 ALA 41 6.670 -4.777 11.992 329 HB3 ALA 41 HB3 ALA 41 6.374 -3.298 11.041 330 H VAL 42 H VAL 42 3.139 -5.155 10.222 331 HA VAL 42 HA VAL 42 2.697 -2.881 8.443 332 HB VAL 42 HB VAL 42 2.843 -4.376 6.658 333 HG11 VAL 42 HG11 VAL 42 3.169 -6.468 7.769 334 HG12 VAL 42 HG12 VAL 42 1.515 -6.457 8.424 335 HG13 VAL 42 HG13 VAL 42 1.798 -6.659 6.672 336 HG21 VAL 42 HG21 VAL 42 0.662 -3.205 6.642 337 HG22 VAL 42 HG22 VAL 42 0.568 -4.807 5.871 338 HG23 VAL 42 HG23 VAL 42 -0.077 -4.583 7.503 339 H HIS 43 H HIS 43 1.020 -1.777 9.147 340 HA HIS 43 HA HIS 43 -1.339 -3.062 10.297 341 HB2 HIS 43 HB2 HIS 43 0.016 -0.946 11.978 342 HB3 HIS 43 HB3 HIS 43 -1.238 -2.094 12.433 343 HD2 HIS 43 HD2 HIS 43 2.576 -1.806 11.952 344 HE1 HIS 43 HE1 HIS 43 1.885 -5.438 14.048 345 HE2 HIS 43 HE2 HIS 43 3.669 -3.821 13.223 346 H ARG 44 H ARG 44 -2.955 -1.127 10.952 347 HA ARG 44 HA ARG 44 -2.762 0.883 8.836 348 HB2 ARG 44 HB2 ARG 44 -4.929 1.641 9.633 349 HB3 ARG 44 HB3 ARG 44 -4.941 -0.109 9.386 350 HG2 ARG 44 HG2 ARG 44 -4.649 -0.476 11.805 351 HG3 ARG 44 HG3 ARG 44 -4.587 1.286 12.068 352 HD2 ARG 44 HD2 ARG 44 -6.860 1.495 11.089 353 HD3 ARG 44 HD3 ARG 44 -6.924 -0.266 10.866 354 HE ARG 44 HE ARG 44 -7.397 1.213 13.315 355 HH11 ARG 44 HH11 ARG 44 -6.161 -1.867 12.083 356 HH12 ARG 44 HH12 ARG 44 -6.552 -2.728 13.549 357 HH21 ARG 44 HH21 ARG 44 -7.897 0.092 15.162 358 HH22 ARG 44 HH22 ARG 44 -7.566 -1.626 15.303 359 H GLU 45 H GLU 45 -3.196 3.256 9.558 360 HA GLU 45 HA GLU 45 -0.844 4.025 10.909 361 HB2 GLU 45 HB2 GLU 45 -2.271 5.218 9.158 362 HB3 GLU 45 HB3 GLU 45 -3.310 5.765 10.470 363 HG2 GLU 45 HG2 GLU 45 -0.299 6.265 10.349 364 HG3 GLU 45 HG3 GLU 45 -1.501 7.366 9.657 365 H GLU 46 H GLU 46 -3.992 3.219 12.212 366 HA GLU 46 HA GLU 46 -3.789 4.739 14.642 367 HB2 GLU 46 HB2 GLU 46 -5.894 3.768 13.654 368 HB3 GLU 46 HB3 GLU 46 -5.288 2.147 14.051 369 HG2 GLU 46 HG2 GLU 46 -5.298 2.699 16.442 370 HG3 GLU 46 HG3 GLU 46 -5.723 4.383 16.082 371 H ILE 47 H ILE 47 -2.755 1.415 13.704 372 HA ILE 47 HA ILE 47 -2.130 0.776 16.501 373 HB ILE 47 HB ILE 47 -1.565 -0.794 13.969 374 HG12 ILE 47 HG12 ILE 47 -3.920 -0.436 13.895 375 HG13 ILE 47 HG13 ILE 47 -3.679 -2.059 14.534 376 HG21 ILE 47 HG21 ILE 47 -1.668 -2.742 15.534 377 HG22 ILE 47 HG22 ILE 47 -0.360 -1.611 15.924 378 HG23 ILE 47 HG23 ILE 47 -1.854 -1.610 16.892 379 HD11 ILE 47 HD11 ILE 47 -4.461 0.444 16.077 380 HD12 ILE 47 HD12 ILE 47 -5.396 -1.041 15.847 381 HD13 ILE 47 HD13 ILE 47 -3.958 -1.071 16.877 382 H TYR 48 H TYR 48 -0.549 1.936 13.585 383 HA TYR 48 HA TYR 48 2.093 1.108 14.037 384 HB2 TYR 48 HB2 TYR 48 1.203 2.125 11.977 385 HB3 TYR 48 HB3 TYR 48 1.063 3.666 12.829 386 HD1 TYR 48 HD2 TYR 48 3.460 1.087 11.621 387 HD2 TYR 48 HD1 TYR 48 3.009 5.082 13.165 388 HE1 TYR 48 HE2 TYR 48 5.801 1.590 10.986 389 HE2 TYR 48 HE1 TYR 48 5.288 5.623 12.469 390 HH TYR 48 HH TYR 48 7.242 4.845 11.499 391 H GLN 49 H GLN 49 0.190 3.714 15.515 392 HA GLN 49 HA GLN 49 2.383 5.209 16.594 393 HB2 GLN 49 HB2 GLN 49 -0.553 4.982 17.306 394 HB3 GLN 49 HB3 GLN 49 0.545 6.169 18.047 395 HG2 GLN 49 HG2 GLN 49 0.973 7.240 15.938 396 HG3 GLN 49 HG3 GLN 49 0.225 5.931 15.034 397 HE21 GLN 49 HE22 GLN 49 -1.173 7.505 14.015 398 HE22 GLN 49 HE21 GLN 49 -2.556 8.162 14.844 399 H ARG 50 H ARG 50 0.844 2.210 17.580 400 HA ARG 50 HA ARG 50 1.900 2.387 20.327 401 HB2 ARG 50 HB2 ARG 50 0.336 0.310 18.756 402 HB3 ARG 50 HB3 ARG 50 1.117 -0.081 20.290 403 HG2 ARG 50 HG2 ARG 50 -1.176 0.485 20.736 404 HG3 ARG 50 HG3 ARG 50 -0.131 1.737 21.415 405 HD2 ARG 50 HD2 ARG 50 -0.633 3.202 19.474 406 HD3 ARG 50 HD3 ARG 50 -1.690 1.930 18.810 407 HE ARG 50 HE ARG 50 -2.387 2.626 21.524 408 HH11 ARG 50 HH11 ARG 50 -2.789 3.674 18.149 409 HH12 ARG 50 HH12 ARG 50 -4.221 4.603 18.509 410 HH21 ARG 50 HH21 ARG 50 -4.264 3.832 21.922 411 HH22 ARG 50 HH22 ARG 50 -5.067 4.676 20.616 412 H ILE 51 H ILE 51 2.855 1.260 17.158 413 HA ILE 51 HA ILE 51 4.901 -0.581 18.034 414 HB ILE 51 HB ILE 51 4.989 1.058 15.486 415 HG12 ILE 51 HG12 ILE 51 2.674 0.281 15.682 416 HG13 ILE 51 HG13 ILE 51 3.556 -0.438 14.322 417 HG21 ILE 51 HG21 ILE 51 5.785 -1.792 16.170 418 HG22 ILE 51 HG22 ILE 51 5.981 -1.000 14.580 419 HG23 ILE 51 HG23 ILE 51 6.867 -0.397 15.997 420 HD11 ILE 51 HD11 ILE 51 3.002 -1.796 16.980 421 HD12 ILE 51 HD12 ILE 51 2.089 -2.015 15.461 422 HD13 ILE 51 HD13 ILE 51 3.802 -2.523 15.549 423 H GLN 52 H GLN 52 4.778 2.822 16.991 424 HA GLN 52 HA GLN 52 7.633 3.251 17.350 425 HB2 GLN 52 HB2 GLN 52 5.349 5.167 16.699 426 HB3 GLN 52 HB3 GLN 52 7.076 5.528 16.538 427 HG2 GLN 52 HG2 GLN 52 5.440 3.540 14.943 428 HG3 GLN 52 HG3 GLN 52 6.340 4.951 14.360 429 HE21 GLN 52 HE22 GLN 52 6.375 1.647 14.491 430 HE22 GLN 52 HE21 GLN 52 8.100 1.347 14.428 431 H ALA 53 H ALA 53 5.259 2.914 19.594 432 HA ALA 53 HA ALA 53 5.667 5.219 21.247 433 HB1 ALA 53 HB1 ALA 53 4.721 2.408 21.948 434 HB2 ALA 53 HB2 ALA 53 4.520 3.855 22.957 435 HB3 ALA 53 HB3 ALA 53 3.688 3.743 21.388 436 H GLY 54 H GLY 54 7.669 2.432 20.622 437 HA2 GLY 54 HA2 GLY 54 9.966 3.186 21.679 438 HA3 GLY 54 HA3 GLY 54 9.119 2.778 23.185 439 H LEU 55 H LEU 55 8.593 0.877 20.189 440 HA LEU 55 HA LEU 55 10.216 -1.293 21.320 441 HB2 LEU 55 HB2 LEU 55 8.177 -2.771 21.476 442 HB3 LEU 55 HB3 LEU 55 8.336 -1.509 22.710 443 HG LEU 55 HG LEU 55 6.755 -0.085 21.211 444 HD11 LEU 55 HD11 LEU 55 6.282 -2.869 20.067 445 HD12 LEU 55 HD12 LEU 55 5.163 -1.493 19.880 446 HD13 LEU 55 HD13 LEU 55 6.779 -1.423 19.161 447 HD21 LEU 55 HD21 LEU 55 6.196 -1.022 23.358 448 HD22 LEU 55 HD22 LEU 55 4.815 -1.188 22.251 449 HD23 LEU 55 HD23 LEU 55 5.838 -2.605 22.627 450 H THR 56 H THR 56 9.872 0.195 18.594 451 HA THR 56 HA THR 56 8.824 -1.778 16.843 452 HB THR 56 HB THR 56 11.106 0.074 16.073 453 HG1 THR 56 HG1 THR 56 9.634 1.730 15.939 454 HG21 THR 56 HG21 THR 56 10.175 -1.371 14.300 455 HG22 THR 56 HG22 THR 56 8.530 -0.844 14.701 456 HG23 THR 56 HG23 THR 56 9.696 0.308 14.011 457 H ALA 57 H ALA 57 11.503 -1.932 18.841 458 HA ALA 57 HA ALA 57 12.441 -4.399 17.546 459 HB1 ALA 57 HB1 ALA 57 14.802 -3.720 17.805 460 HB2 ALA 57 HB2 ALA 57 13.938 -2.645 16.687 461 HB3 ALA 57 HB3 ALA 57 14.283 -2.104 18.345 462 HA PRO 58 HA PRO 58 11.079 -4.487 21.974 463 HB2 PRO 58 HB2 PRO 58 10.975 -7.377 21.130 464 HB3 PRO 58 HB3 PRO 58 9.838 -6.463 22.176 465 HG2 PRO 58 HG2 PRO 58 9.214 -6.909 19.594 466 HG3 PRO 58 HG3 PRO 58 8.963 -5.275 20.289 467 HD2 PRO 58 HD2 PRO 58 11.260 -6.253 18.577 468 HD3 PRO 58 HD3 PRO 58 10.349 -4.720 18.465 469 H ASP 59 H ASP 59 11.625 -6.006 23.829 470 HA ASP 59 HA ASP 59 14.434 -5.949 24.318 471 HB2 ASP 59 HB2 ASP 59 12.425 -5.698 25.918 472 HB3 ASP 59 HB3 ASP 59 12.276 -7.446 25.856 473 H5' U 36 H5' U 36 -9.026 9.506 -17.360 474 H5'' U 36 H5'' U 36 -8.622 7.995 -18.199 475 H4' U 36 H4' U 36 -6.569 9.078 -17.544 476 H3' U 36 H3' U 36 -7.086 6.464 -16.939 477 H2' U 36 H2' U 36 -7.830 6.779 -14.735 478 HO2' U 36 HO2' U 36 -5.776 5.556 -14.679 479 H1' U 36 H1' U 36 -5.699 8.846 -14.236 480 H3 U 36 H3 U 36 -7.424 10.785 -10.581 481 H5 U 36 H5 U 36 -10.554 8.318 -11.911 482 H6 U 36 H6 U 36 -9.238 7.787 -13.863 483 HO5' U 36 HO5' U 36 -10.297 7.723 -16.665 484 H5' C 37 H5' C 37 -3.710 7.949 -19.101 485 H5'' C 37 H5'' C 37 -3.585 6.370 -19.873 486 H4' C 37 H4' C 37 -1.573 6.961 -20.665 487 H3' C 37 H3' C 37 -0.746 6.000 -18.311 488 H2' C 37 H2' C 37 -1.245 7.834 -16.910 489 HO2' C 37 HO2' C 37 1.063 7.543 -16.801 490 H1' C 37 H1' C 37 -0.215 9.943 -18.721 491 H41 C 37 H41 C 37 -4.953 13.415 -16.328 492 H42 C 37 H42 C 37 -5.681 12.002 -15.582 493 H5 C 37 H5 C 37 -4.781 9.731 -15.868 494 H6 C 37 H6 C 37 -3.050 8.441 -16.884 495 H5' A 38 H5' A 38 3.020 7.925 -18.158 496 H5'' A 38 H5'' A 38 4.237 6.749 -18.670 497 H4' A 38 H4' A 38 4.750 7.753 -16.462 498 H3' A 38 H3' A 38 5.176 5.147 -17.069 499 H2' A 38 H2' A 38 2.950 4.407 -16.534 500 HO2' A 38 HO2' A 38 4.529 4.090 -14.187 501 H1' A 38 H1' A 38 3.131 5.924 -13.935 502 H8 A 38 H8 A 38 0.872 4.400 -16.646 503 H61 A 38 H61 A 38 -3.756 5.668 -12.709 504 H62 A 38 H62 A 38 -3.350 4.985 -14.268 505 H2 A 38 H2 A 38 -0.030 7.530 -11.126 506 H5' G 39 H5' G 39 5.112 8.566 -14.511 507 H5'' G 39 H5'' G 39 6.522 9.432 -15.146 508 H4' G 39 H4' G 39 5.845 10.734 -13.327 509 H3' G 39 H3' G 39 8.341 9.787 -13.111 510 H2' G 39 H2' G 39 7.857 7.703 -12.104 511 HO2' G 39 HO2' G 39 8.222 9.539 -9.996 512 H1' G 39 H1' G 39 5.818 8.654 -10.169 513 H8 G 39 H8 G 39 3.587 7.239 -12.242 514 H1 G 39 H1 G 39 7.575 2.464 -10.685 515 H21 G 39 H21 G 39 9.418 3.263 -9.826 516 H22 G 39 H22 G 39 9.699 4.980 -9.624 517 H5' G 40 H5' G 40 7.148 11.040 -8.823 518 H5'' G 40 H5'' G 40 8.145 12.446 -8.433 519 H4' G 40 H4' G 40 7.812 11.032 -6.466 520 H3' G 40 H3' G 40 10.342 11.985 -7.349 521 H2' G 40 H2' G 40 11.007 9.733 -7.949 522 HO2' G 40 HO2' G 40 11.605 10.171 -5.199 523 H1' G 40 H1' G 40 9.455 8.914 -5.468 524 H8 G 40 H8 G 40 10.122 7.519 -9.064 525 H1 G 40 H1 G 40 11.638 3.591 -4.220 526 H21 G 40 H21 G 40 11.281 4.612 -2.276 527 H22 G 40 H22 G 40 10.617 6.222 -2.189 528 H5' A 41 H5' A 41 7.525 13.926 -4.034 529 H5'' A 41 H5'' A 41 7.269 12.645 -5.225 530 H4' A 41 H4' A 41 7.143 15.590 -5.990 531 H3' A 41 H3' A 41 5.107 13.877 -4.607 532 H2' A 41 H2' A 41 3.415 14.444 -6.135 533 HO2' A 41 HO2' A 41 3.756 16.722 -5.891 534 H1' A 41 H1' A 41 5.043 14.973 -8.385 535 H8 A 41 H8 A 41 4.368 11.884 -6.087 536 H61 A 41 H61 A 41 2.220 9.313 -11.339 537 H62 A 41 H62 A 41 2.401 9.065 -9.612 538 H2 A 41 H2 A 41 3.813 13.312 -12.317 539 H5' C 42 H5' C 42 2.024 14.882 -1.831 540 H5'' C 42 H5'' C 42 2.904 13.744 -2.859 541 H4' C 42 H4' C 42 1.220 13.935 -4.607 542 H3' C 42 H3' C 42 0.730 16.468 -3.951 543 H2' C 42 H2' C 42 0.081 15.947 -1.659 544 HO2' C 42 HO2' C 42 -2.265 16.137 -3.275 545 H1' C 42 H1' C 42 -1.746 13.896 -2.925 546 H41 C 42 H41 C 42 -2.858 13.181 3.349 547 H42 C 42 H42 C 42 -1.199 12.683 3.612 548 H5 C 42 H5 C 42 0.466 12.631 1.806 549 H6 C 42 H6 C 42 0.837 13.125 -0.544 550 H5' A 43 H5' A 43 0.638 18.348 -5.721 551 H5'' A 43 H5'' A 43 -0.490 17.812 -4.466 552 H4' A 43 H4' A 43 -2.204 19.267 -5.911 553 H3' A 43 H3' A 43 -0.179 20.369 -7.195 554 H2' A 43 H2' A 43 1.336 20.278 -5.308 555 HO2' A 43 HO2' A 43 1.665 22.472 -4.688 556 H1' A 43 H1' A 43 -0.552 21.735 -3.501 557 H8 A 43 H8 A 43 -0.492 18.322 -2.403 558 H61 A 43 H61 A 43 4.837 19.412 0.612 559 H62 A 43 H62 A 43 3.489 18.300 0.450 560 H2 A 43 H2 A 43 4.187 22.711 -2.263 561 H5' U 44 H5' U 44 -4.005 18.979 -6.666 562 H5'' U 44 H5'' U 44 -5.476 19.958 -6.654 563 H4' U 44 H4' U 44 -5.652 18.152 -5.026 564 H3' U 44 H3' U 44 -5.254 20.844 -3.677 565 HO3' U 44 HO3' U 44 -7.549 20.736 -3.616 566 H2' U 44 H2' U 44 -5.868 19.663 -1.669 567 HO2' U 44 HO2' U 44 -7.568 18.378 -2.672 568 H1' U 44 H1' U 44 -4.355 17.439 -2.311 569 H3 U 44 H3 U 44 -2.079 19.142 1.195 570 H5 U 44 H5 U 44 -1.819 22.198 -1.683 571 H6 U 44 H6 U 44 -3.199 20.868 -3.143 572 H1 MET 1 H1 MET 1 0.944 -11.692 5.087 573 H2 MET 1 H2 MET 1 1.019 -12.863 3.928 574 H3 MET 1 H3 MET 1 0.049 -13.059 5.239 575 HA MET 1 HA MET 1 -0.282 -11.019 3.157 576 HB2 MET 1 HB2 MET 1 -0.839 -13.336 2.404 577 HB3 MET 1 HB3 MET 1 -1.948 -13.503 3.770 578 HG2 MET 1 HG2 MET 1 -3.228 -12.924 1.799 579 HG3 MET 1 HG3 MET 1 -3.249 -11.547 2.898 580 HE1 MET 1 HE1 MET 1 -4.315 -11.065 0.294 581 HE2 MET 1 HE2 MET 1 -3.903 -9.686 1.331 582 HE3 MET 1 HE3 MET 1 -3.434 -9.668 -0.394 583 H LEU 2 H LEU 2 -1.758 -9.368 3.624 584 HA LEU 2 HA LEU 2 -3.527 -9.746 5.968 585 HB2 LEU 2 HB2 LEU 2 -1.263 -7.872 5.694 586 HB3 LEU 2 HB3 LEU 2 -2.796 -7.062 6.066 587 HG LEU 2 HG LEU 2 -1.520 -9.302 7.666 588 HD11 LEU 2 HD11 LEU 2 -1.179 -7.556 9.347 589 HD12 LEU 2 HD12 LEU 2 -0.398 -7.099 7.818 590 HD13 LEU 2 HD13 LEU 2 -1.934 -6.339 8.270 591 HD21 LEU 2 HD21 LEU 2 -3.983 -9.425 7.881 592 HD22 LEU 2 HD22 LEU 2 -3.292 -8.732 9.353 593 HD23 LEU 2 HD23 LEU 2 -4.063 -7.665 8.154 594 H ILE 3 H ILE 3 -5.400 -8.418 5.916 595 HA ILE 3 HA ILE 3 -5.884 -6.885 3.425 596 HB ILE 3 HB ILE 3 -7.723 -9.033 4.576 597 HG12 ILE 3 HG12 ILE 3 -7.603 -9.654 2.014 598 HG13 ILE 3 HG13 ILE 3 -6.077 -8.770 2.041 599 HG21 ILE 3 HG21 ILE 3 -8.168 -7.074 2.289 600 HG22 ILE 3 HG22 ILE 3 -9.238 -8.420 2.744 601 HG23 ILE 3 HG23 ILE 3 -9.020 -7.060 3.859 602 HD11 ILE 3 HD11 ILE 3 -6.839 -11.201 3.721 603 HD12 ILE 3 HD12 ILE 3 -5.716 -11.163 2.347 604 HD13 ILE 3 HD13 ILE 3 -5.277 -10.353 3.856 605 H LEU 4 H LEU 4 -7.316 -5.161 3.731 606 HA LEU 4 HA LEU 4 -8.290 -4.550 6.465 607 HB2 LEU 4 HB2 LEU 4 -6.371 -2.844 4.822 608 HB3 LEU 4 HB3 LEU 4 -7.227 -2.280 6.255 609 HG LEU 4 HG LEU 4 -5.173 -4.530 6.230 610 HD11 LEU 4 HD11 LEU 4 -5.096 -1.605 7.076 611 HD12 LEU 4 HD12 LEU 4 -3.796 -2.789 7.396 612 HD13 LEU 4 HD13 LEU 4 -4.215 -2.338 5.722 613 HD21 LEU 4 HD21 LEU 4 -6.579 -3.059 8.508 614 HD22 LEU 4 HD22 LEU 4 -6.826 -4.766 8.075 615 HD23 LEU 4 HD23 LEU 4 -5.256 -4.239 8.699 616 H THR 5 H THR 5 -9.642 -2.536 6.420 617 HA THR 5 HA THR 5 -10.440 -1.729 3.681 618 HB THR 5 HB THR 5 -12.533 -2.084 5.852 619 HG1 THR 5 HG1 THR 5 -11.697 -4.118 5.260 620 HG21 THR 5 HG21 THR 5 -13.040 -0.480 4.134 621 HG22 THR 5 HG22 THR 5 -12.506 -1.616 2.857 622 HG23 THR 5 HG23 THR 5 -13.974 -1.958 3.819 623 H ARG 6 H ARG 6 -9.505 0.149 3.631 624 HA ARG 6 HA ARG 6 -9.780 2.085 5.867 625 HB2 ARG 6 HB2 ARG 6 -7.550 1.271 4.762 626 HB3 ARG 6 HB3 ARG 6 -8.061 2.178 3.348 627 HG2 ARG 6 HG2 ARG 6 -6.525 3.526 4.526 628 HG3 ARG 6 HG3 ARG 6 -8.116 4.246 4.838 629 HD2 ARG 6 HD2 ARG 6 -6.791 2.244 6.719 630 HD3 ARG 6 HD3 ARG 6 -6.469 3.979 6.815 631 HE ARG 6 HE ARG 6 -8.969 4.266 7.093 632 HH11 ARG 6 HH11 ARG 6 -7.358 1.313 8.199 633 HH12 ARG 6 HH12 ARG 6 -8.564 1.006 9.432 634 HH21 ARG 6 HH21 ARG 6 -10.460 3.862 8.688 635 HH22 ARG 6 HH22 ARG 6 -10.318 2.448 9.713 636 H LYS 7 H LYS 7 -10.333 4.415 5.161 637 HA LYS 7 HA LYS 7 -11.645 4.471 2.486 638 HB2 LYS 7 HB2 LYS 7 -13.324 6.029 3.325 639 HB3 LYS 7 HB3 LYS 7 -13.502 4.431 4.029 640 HG2 LYS 7 HG2 LYS 7 -12.516 5.194 6.127 641 HG3 LYS 7 HG3 LYS 7 -12.076 6.765 5.388 642 HD2 LYS 7 HD2 LYS 7 -14.510 7.159 4.926 643 HD3 LYS 7 HD3 LYS 7 -14.890 5.686 5.845 644 HE2 LYS 7 HE2 LYS 7 -13.496 8.186 6.884 645 HE3 LYS 7 HE3 LYS 7 -15.162 7.688 7.223 646 HZ1 LYS 7 HZ1 LYS 7 -14.244 5.690 8.268 647 HZ2 LYS 7 HZ2 LYS 7 -12.715 6.274 8.052 648 HZ3 LYS 7 HZ3 LYS 7 -13.763 7.071 9.023 649 H VAL 8 H VAL 8 -12.074 6.813 1.800 650 HA VAL 8 HA VAL 8 -9.487 7.753 1.247 651 HB VAL 8 HB VAL 8 -10.480 9.504 0.026 652 HG11 VAL 8 HG11 VAL 8 -12.341 7.074 -0.021 653 HG12 VAL 8 HG12 VAL 8 -12.079 8.223 -1.351 654 HG13 VAL 8 HG13 VAL 8 -10.755 7.160 -0.813 655 HG21 VAL 8 HG21 VAL 8 -12.115 10.417 1.589 656 HG22 VAL 8 HG22 VAL 8 -12.854 10.009 0.028 657 HG23 VAL 8 HG23 VAL 8 -13.109 8.946 1.444 658 H GLY 9 H GLY 9 -8.124 9.102 2.065 659 HA2 GLY 9 HA2 GLY 9 -7.473 11.093 3.171 660 HA3 GLY 9 HA3 GLY 9 -9.006 11.111 4.055 661 H GLU 10 H GLU 10 -7.883 7.940 4.178 662 HA GLU 10 HA GLU 10 -6.546 8.435 6.798 663 HB2 GLU 10 HB2 GLU 10 -8.147 6.050 5.808 664 HB3 GLU 10 HB3 GLU 10 -7.368 6.189 7.403 665 HG2 GLU 10 HG2 GLU 10 -8.768 8.138 7.934 666 HG3 GLU 10 HG3 GLU 10 -9.519 8.066 6.333 667 H SER 11 H SER 11 -5.217 6.136 7.300 668 HA SER 11 HA SER 11 -3.421 5.737 4.965 669 HB2 SER 11 HB2 SER 11 -2.519 6.845 7.648 670 HB3 SER 11 HB3 SER 11 -1.464 6.432 6.286 671 HG SER 11 HG SER 11 -1.967 8.655 6.332 672 H ILE 12 H ILE 12 -1.603 4.295 5.466 673 HA ILE 12 HA ILE 12 -2.040 2.245 7.551 674 HB ILE 12 HB ILE 12 -1.695 1.621 4.582 675 HG12 ILE 12 HG12 ILE 12 -4.178 1.337 6.329 676 HG13 ILE 12 HG13 ILE 12 -3.945 2.547 5.053 677 HG21 ILE 12 HG21 ILE 12 -2.282 -0.236 6.931 678 HG22 ILE 12 HG22 ILE 12 -2.126 -0.716 5.236 679 HG23 ILE 12 HG23 ILE 12 -0.720 -0.102 6.098 680 HD11 ILE 12 HD11 ILE 12 -5.297 0.753 4.182 681 HD12 ILE 12 HD12 ILE 12 -3.711 0.741 3.374 682 HD13 ILE 12 HD13 ILE 12 -4.086 -0.458 4.636 683 H ASN 13 H ASN 13 0.052 0.806 7.608 684 HA ASN 13 HA ASN 13 2.417 2.329 6.643 685 HB2 ASN 13 HB2 ASN 13 1.766 1.603 9.519 686 HB3 ASN 13 HB3 ASN 13 3.394 2.017 8.973 687 HD21 ASN 13 HD22 ASN 13 3.905 4.151 8.350 688 HD22 ASN 13 HD21 ASN 13 2.842 5.489 8.722 689 H ILE 14 H ILE 14 4.368 1.172 6.611 690 HA ILE 14 HA ILE 14 4.277 -1.735 7.130 691 HB ILE 14 HB ILE 14 5.201 -0.519 4.491 692 HG12 ILE 14 HG12 ILE 14 2.728 -2.187 5.126 693 HG13 ILE 14 HG13 ILE 14 2.742 -0.472 4.659 694 HG21 ILE 14 HG21 ILE 14 5.473 -2.870 3.790 695 HG22 ILE 14 HG22 ILE 14 6.476 -2.534 5.198 696 HG23 ILE 14 HG23 ILE 14 4.945 -3.421 5.395 697 HD11 ILE 14 HD11 ILE 14 3.778 -1.115 2.477 698 HD12 ILE 14 HD12 ILE 14 3.561 -2.830 2.921 699 HD13 ILE 14 HD13 ILE 14 2.147 -1.775 2.734 700 H GLY 15 H GLY 15 6.351 -2.608 7.566 701 HA2 GLY 15 HA2 GLY 15 8.457 -2.532 8.504 702 HA3 GLY 15 HA3 GLY 15 8.824 -1.334 7.249 703 H ASP 16 H ASP 16 10.047 0.046 8.488 704 HA ASP 16 HA ASP 16 8.534 1.624 10.484 705 HB2 ASP 16 HB2 ASP 16 10.500 1.831 11.878 706 HB3 ASP 16 HB3 ASP 16 10.105 0.125 11.657 707 H ASP 17 H ASP 17 9.525 1.682 7.485 708 HA ASP 17 HA ASP 17 10.239 4.551 7.564 709 HB2 ASP 17 HB2 ASP 17 11.687 2.420 5.930 710 HB3 ASP 17 HB3 ASP 17 11.894 4.164 5.735 711 H ILE 18 H ILE 18 7.880 2.480 6.647 712 HA ILE 18 HA ILE 18 7.466 3.971 4.098 713 HB ILE 18 HB ILE 18 6.730 1.057 4.560 714 HG12 ILE 18 HG12 ILE 18 8.417 0.937 2.485 715 HG13 ILE 18 HG13 ILE 18 9.133 2.350 3.279 716 HG21 ILE 18 HG21 ILE 18 5.179 2.184 3.074 717 HG22 ILE 18 HG22 ILE 18 6.520 2.890 2.143 718 HG23 ILE 18 HG23 ILE 18 6.241 1.133 2.120 719 HD11 ILE 18 HD11 ILE 18 10.166 0.201 4.007 720 HD12 ILE 18 HD12 ILE 18 9.379 1.022 5.370 721 HD13 ILE 18 HD13 ILE 18 8.572 -0.352 4.574 722 H THR 19 H THR 19 5.417 4.627 3.628 723 HA THR 19 HA THR 19 3.222 3.996 5.517 724 HB THR 19 HB THR 19 4.052 6.804 4.675 725 HG1 THR 19 HG1 THR 19 5.405 5.944 6.254 726 HG21 THR 19 HG21 THR 19 2.339 7.490 6.377 727 HG22 THR 19 HG22 THR 19 1.634 6.670 4.972 728 HG23 THR 19 HG23 THR 19 1.840 5.791 6.506 729 H ILE 20 H ILE 20 1.137 4.428 4.575 730 HA ILE 20 HA ILE 20 1.065 4.819 1.623 731 HB ILE 20 HB ILE 20 -0.372 2.682 3.245 732 HG12 ILE 20 HG12 ILE 20 2.027 2.143 2.886 733 HG13 ILE 20 HG13 ILE 20 0.921 1.011 2.099 734 HG21 ILE 20 HG21 ILE 20 -0.446 3.326 0.271 735 HG22 ILE 20 HG22 ILE 20 -1.129 1.856 1.000 736 HG23 ILE 20 HG23 ILE 20 -1.784 3.443 1.437 737 HD11 ILE 20 HD11 ILE 20 2.302 3.312 0.658 738 HD12 ILE 20 HD12 ILE 20 2.869 1.629 0.676 739 HD13 ILE 20 HD13 ILE 20 1.316 2.027 -0.077 740 H THR 21 H THR 21 -0.823 5.855 0.923 741 HA THR 21 HA THR 21 -2.822 6.616 2.993 742 HB THR 21 HB THR 21 -1.504 8.597 1.096 743 HG1 THR 21 HG1 THR 21 -0.501 9.369 2.991 744 HG21 THR 21 HG21 THR 21 -3.351 8.964 3.492 745 HG22 THR 21 HG22 THR 21 -2.618 10.276 2.539 746 HG23 THR 21 HG23 THR 21 -3.804 9.193 1.785 747 H ILE 22 H ILE 22 -4.894 6.979 2.167 748 HA ILE 22 HA ILE 22 -5.266 6.243 -0.691 749 HB ILE 22 HB ILE 22 -6.286 4.631 0.645 750 HG12 ILE 22 HG12 ILE 22 -8.648 4.784 0.249 751 HG13 ILE 22 HG13 ILE 22 -8.574 6.552 0.118 752 HG21 ILE 22 HG21 ILE 22 -7.865 5.115 2.485 753 HG22 ILE 22 HG22 ILE 22 -6.213 5.654 2.827 754 HG23 ILE 22 HG23 ILE 22 -7.455 6.845 2.367 755 HD11 ILE 22 HD11 ILE 22 -7.199 4.632 -1.787 756 HD12 ILE 22 HD12 ILE 22 -8.743 5.483 -2.079 757 HD13 ILE 22 HD13 ILE 22 -7.247 6.419 -1.895 758 H LEU 23 H LEU 23 -5.067 8.181 -1.728 759 HA LEU 23 HA LEU 23 -5.859 10.659 -0.561 760 HB2 LEU 23 HB2 LEU 23 -5.494 10.114 -3.526 761 HB3 LEU 23 HB3 LEU 23 -5.355 11.652 -2.673 762 HG LEU 23 HG LEU 23 -3.427 9.316 -2.668 763 HD11 LEU 23 HD11 LEU 23 -3.195 12.303 -3.233 764 HD12 LEU 23 HD12 LEU 23 -1.863 11.128 -3.338 765 HD13 LEU 23 HD13 LEU 23 -3.254 11.012 -4.450 766 HD21 LEU 23 HD21 LEU 23 -3.540 9.972 -0.332 767 HD22 LEU 23 HD22 LEU 23 -2.054 10.629 -1.053 768 HD23 LEU 23 HD23 LEU 23 -3.462 11.697 -0.775 769 H GLY 24 H GLY 24 -7.642 8.329 -2.582 770 HA2 GLY 24 HA2 GLY 24 -10.167 9.067 -1.863 771 HA3 GLY 24 HA3 GLY 24 -9.827 10.223 -3.126 772 H VAL 25 H VAL 25 -11.821 8.953 -3.957 773 HA VAL 25 HA VAL 25 -10.823 6.832 -5.782 774 HB VAL 25 HB VAL 25 -12.726 5.430 -5.415 775 HG11 VAL 25 HG11 VAL 25 -11.714 6.291 -2.679 776 HG12 VAL 25 HG12 VAL 25 -12.431 4.724 -3.107 777 HG13 VAL 25 HG13 VAL 25 -10.854 5.196 -3.788 778 HG21 VAL 25 HG21 VAL 25 -14.458 5.948 -3.730 779 HG22 VAL 25 HG22 VAL 25 -13.762 7.568 -3.517 780 HG23 VAL 25 HG23 VAL 25 -14.458 7.084 -5.089 781 H SER 26 H SER 26 -12.266 6.448 -7.618 782 HA SER 26 HA SER 26 -14.331 8.439 -8.195 783 HB2 SER 26 HB2 SER 26 -12.235 9.535 -8.946 784 HB3 SER 26 HB3 SER 26 -11.881 8.128 -9.973 785 HG SER 26 HG SER 26 -12.951 9.807 -11.116 786 H GLY 27 H GLY 27 -15.751 6.646 -8.175 787 HA2 GLY 27 HA2 GLY 27 -16.940 4.959 -9.246 788 HA3 GLY 27 HA3 GLY 27 -15.819 5.093 -10.621 789 H GLN 28 H GLN 28 -14.216 3.566 -10.865 790 HA GLN 28 HA GLN 28 -13.879 1.610 -8.632 791 HB2 GLN 28 HB2 GLN 28 -13.067 1.354 -11.561 792 HB3 GLN 28 HB3 GLN 28 -12.939 0.113 -10.310 793 HG2 GLN 28 HG2 GLN 28 -15.424 1.219 -11.603 794 HG3 GLN 28 HG3 GLN 28 -14.803 -0.449 -11.587 795 HE21 GLN 28 HE22 GLN 28 -14.408 -1.215 -9.100 796 HE22 GLN 28 HE21 GLN 28 -15.790 -0.947 -8.056 797 H GLN 29 H GLN 29 -12.363 4.182 -10.416 798 HA GLN 29 HA GLN 29 -9.646 3.371 -9.914 799 HB2 GLN 29 HB2 GLN 29 -10.949 6.060 -10.500 800 HB3 GLN 29 HB3 GLN 29 -9.214 5.852 -10.287 801 HG2 GLN 29 HG2 GLN 29 -10.869 4.328 -12.344 802 HG3 GLN 29 HG3 GLN 29 -9.927 5.786 -12.687 803 HE21 GLN 29 HE22 GLN 29 -9.594 3.119 -13.853 804 HE22 GLN 29 HE21 GLN 29 -7.949 2.633 -13.480 805 H VAL 30 H VAL 30 -8.266 4.036 -8.341 806 HA VAL 30 HA VAL 30 -9.360 5.281 -5.879 807 HB VAL 30 HB VAL 30 -7.852 2.630 -6.071 808 HG11 VAL 30 HG11 VAL 30 -8.944 4.057 -3.624 809 HG12 VAL 30 HG12 VAL 30 -8.029 2.530 -3.662 810 HG13 VAL 30 HG13 VAL 30 -7.230 4.058 -4.100 811 HG21 VAL 30 HG21 VAL 30 -10.224 2.356 -6.621 812 HG22 VAL 30 HG22 VAL 30 -9.892 1.687 -5.016 813 HG23 VAL 30 HG23 VAL 30 -10.688 3.273 -5.168 814 H ARG 31 H ARG 31 -8.068 7.045 -5.694 815 HA ARG 31 HA ARG 31 -5.361 6.957 -6.826 816 HB2 ARG 31 HB2 ARG 31 -7.047 8.915 -7.002 817 HB3 ARG 31 HB3 ARG 31 -6.599 9.284 -5.318 818 HG2 ARG 31 HG2 ARG 31 -4.213 9.449 -6.006 819 HG3 ARG 31 HG3 ARG 31 -4.658 8.949 -7.652 820 HD2 ARG 31 HD2 ARG 31 -6.211 10.970 -7.715 821 HD3 ARG 31 HD3 ARG 31 -5.378 11.539 -6.258 822 HE ARG 31 HE ARG 31 -4.047 10.972 -8.887 823 HH11 ARG 31 HH11 ARG 31 -4.280 12.949 -5.941 824 HH12 ARG 31 HH12 ARG 31 -2.946 13.977 -6.440 825 HH21 ARG 31 HH21 ARG 31 -2.328 12.346 -9.446 826 HH22 ARG 31 HH22 ARG 31 -1.883 13.649 -8.357 827 H ILE 32 H ILE 32 -3.550 6.661 -5.673 828 HA ILE 32 HA ILE 32 -3.814 6.445 -2.709 829 HB ILE 32 HB ILE 32 -2.255 4.455 -4.372 830 HG12 ILE 32 HG12 ILE 32 -5.207 4.322 -3.672 831 HG13 ILE 32 HG13 ILE 32 -4.457 4.285 -5.275 832 HG21 ILE 32 HG21 ILE 32 -1.820 4.619 -1.932 833 HG22 ILE 32 HG22 ILE 32 -3.543 4.282 -1.617 834 HG23 ILE 32 HG23 ILE 32 -2.501 3.055 -2.372 835 HD11 ILE 32 HD11 ILE 32 -4.256 2.120 -3.145 836 HD12 ILE 32 HD12 ILE 32 -5.134 2.045 -4.680 837 HD13 ILE 32 HD13 ILE 32 -3.354 2.120 -4.684 838 H GLY 33 H GLY 33 -1.797 6.637 -1.564 839 HA2 GLY 33 HA2 GLY 33 0.446 7.793 -3.160 840 HA3 GLY 33 HA3 GLY 33 -0.113 8.528 -1.643 841 H ILE 34 H ILE 34 2.514 7.517 -2.202 842 HA ILE 34 HA ILE 34 2.777 5.417 -0.116 843 HB ILE 34 HB ILE 34 4.137 5.382 -2.840 844 HG12 ILE 34 HG12 ILE 34 1.992 3.480 -1.807 845 HG13 ILE 34 HG13 ILE 34 1.704 4.788 -2.973 846 HG21 ILE 34 HG21 ILE 34 4.976 3.147 -2.092 847 HG22 ILE 34 HG22 ILE 34 5.526 4.446 -1.038 848 HG23 ILE 34 HG23 ILE 34 4.186 3.396 -0.523 849 HD11 ILE 34 HD11 ILE 34 3.525 2.398 -3.397 850 HD12 ILE 34 HD12 ILE 34 1.986 2.750 -4.209 851 HD13 ILE 34 HD13 ILE 34 3.392 3.799 -4.493 852 H ASN 35 H ASN 35 4.661 5.624 1.086 853 HA ASN 35 HA ASN 35 6.484 7.832 0.315 854 HB2 ASN 35 HB2 ASN 35 4.571 8.665 1.732 855 HB3 ASN 35 HB3 ASN 35 5.112 7.595 3.021 856 HD21 ASN 35 HD22 ASN 35 4.885 10.506 3.040 857 HD22 ASN 35 HD21 ASN 35 6.487 11.159 3.314 858 H ALA 36 H ALA 36 8.302 6.724 0.098 859 HA ALA 36 HA ALA 36 9.433 5.343 2.456 860 HB1 ALA 36 HB1 ALA 36 8.362 3.538 1.146 861 HB2 ALA 36 HB2 ALA 36 9.200 4.094 -0.321 862 HB3 ALA 36 HB3 ALA 36 10.138 3.438 1.025 863 HA PRO 37 HA PRO 37 13.112 7.338 0.993 864 HB2 PRO 37 HB2 PRO 37 15.025 5.439 1.639 865 HB3 PRO 37 HB3 PRO 37 14.243 6.529 2.841 866 HG2 PRO 37 HG2 PRO 37 13.561 3.660 2.148 867 HG3 PRO 37 HG3 PRO 37 13.716 4.415 3.775 868 HD2 PRO 37 HD2 PRO 37 11.299 4.045 2.593 869 HD3 PRO 37 HD3 PRO 37 11.659 5.519 3.542 870 H LYS 38 H LYS 38 14.718 7.223 -0.704 871 HA LYS 38 HA LYS 38 14.082 5.444 -2.899 872 HB2 LYS 38 HB2 LYS 38 16.447 7.323 -2.417 873 HB3 LYS 38 HB3 LYS 38 16.077 6.531 -3.964 874 HG2 LYS 38 HG2 LYS 38 14.189 8.445 -2.496 875 HG3 LYS 38 HG3 LYS 38 15.242 8.896 -3.843 876 HD2 LYS 38 HD2 LYS 38 13.143 6.681 -4.005 877 HD3 LYS 38 HD3 LYS 38 12.791 8.358 -4.341 878 HE2 LYS 38 HE2 LYS 38 14.977 6.761 -5.762 879 HE3 LYS 38 HE3 LYS 38 13.327 6.950 -6.377 880 HZ1 LYS 38 HZ1 LYS 38 14.751 8.551 -7.359 881 HZ2 LYS 38 HZ2 LYS 38 13.671 9.321 -6.393 882 HZ3 LYS 38 HZ3 LYS 38 15.224 9.146 -5.892 883 H ASP 39 H ASP 39 15.503 4.888 -0.073 884 HA ASP 39 HA ASP 39 17.614 3.057 -0.686 885 HB2 ASP 39 HB2 ASP 39 16.926 4.187 1.545 886 HB3 ASP 39 HB3 ASP 39 15.701 2.933 1.671 887 H VAL 40 H VAL 40 14.255 2.918 -1.287 888 HA VAL 40 HA VAL 40 14.360 -0.012 -1.720 889 HB VAL 40 HB VAL 40 12.163 -0.312 -0.747 890 HG11 VAL 40 HG11 VAL 40 13.890 1.275 1.197 891 HG12 VAL 40 HG12 VAL 40 12.657 0.061 1.608 892 HG13 VAL 40 HG13 VAL 40 14.138 -0.443 0.779 893 HG21 VAL 40 HG21 VAL 40 11.237 1.934 -1.283 894 HG22 VAL 40 HG22 VAL 40 10.939 1.416 0.387 895 HG23 VAL 40 HG23 VAL 40 12.215 2.608 0.049 896 H ALA 41 H ALA 41 12.383 -0.688 -3.088 897 HA ALA 41 HA ALA 41 12.080 1.382 -5.206 898 HB1 ALA 41 HB1 ALA 41 11.896 -1.658 -5.336 899 HB2 ALA 41 HB2 ALA 41 11.733 -0.553 -6.714 900 HB3 ALA 41 HB3 ALA 41 13.285 -0.679 -5.856 901 H VAL 42 H VAL 42 10.038 1.599 -6.285 902 HA VAL 42 HA VAL 42 7.743 0.059 -5.367 903 HB VAL 42 HB VAL 42 7.496 1.552 -3.604 904 HG11 VAL 42 HG11 VAL 42 8.510 3.750 -5.431 905 HG12 VAL 42 HG12 VAL 42 7.832 4.020 -3.804 906 HG13 VAL 42 HG13 VAL 42 9.303 3.061 -3.988 907 HG21 VAL 42 HG21 VAL 42 5.452 1.554 -5.022 908 HG22 VAL 42 HG22 VAL 42 5.693 3.094 -4.155 909 HG23 VAL 42 HG23 VAL 42 6.067 2.990 -5.878 910 H HIS 43 H HIS 43 6.464 -0.275 -7.066 911 HA HIS 43 HA HIS 43 6.069 1.807 -9.085 912 HB2 HIS 43 HB2 HIS 43 6.934 -0.900 -10.113 913 HB3 HIS 43 HB3 HIS 43 6.892 0.641 -10.940 914 HD2 HIS 43 HD2 HIS 43 9.045 -1.293 -8.371 915 HE1 HIS 43 HE1 HIS 43 11.487 1.775 -10.017 916 HE2 HIS 43 HE2 HIS 43 11.456 -0.261 -8.496 917 H ARG 44 H ARG 44 4.374 1.100 -10.692 918 HA ARG 44 HA ARG 44 2.194 -0.323 -9.498 919 HB2 ARG 44 HB2 ARG 44 2.870 0.313 -12.407 920 HB3 ARG 44 HB3 ARG 44 1.289 -0.242 -11.841 921 HG2 ARG 44 HG2 ARG 44 0.898 1.768 -10.611 922 HG3 ARG 44 HG3 ARG 44 2.602 2.268 -10.726 923 HD2 ARG 44 HD2 ARG 44 1.215 3.567 -12.273 924 HD3 ARG 44 HD3 ARG 44 2.412 2.580 -13.124 925 HE ARG 44 HE ARG 44 -0.483 1.845 -12.873 926 HH11 ARG 44 HH11 ARG 44 2.502 2.054 -14.773 927 HH12 ARG 44 HH12 ARG 44 1.812 1.215 -16.144 928 HH21 ARG 44 HH21 ARG 44 -1.371 0.859 -14.725 929 HH22 ARG 44 HH22 ARG 44 -0.363 0.542 -16.117 930 H GLU 45 H GLU 45 1.447 -2.532 -10.032 931 HA GLU 45 HA GLU 45 3.636 -4.355 -10.183 932 HB2 GLU 45 HB2 GLU 45 1.542 -4.853 -9.021 933 HB3 GLU 45 HB3 GLU 45 0.654 -4.883 -10.561 934 HG2 GLU 45 HG2 GLU 45 1.807 -6.803 -11.304 935 HG3 GLU 45 HG3 GLU 45 3.078 -6.637 -10.070 936 H GLU 46 H GLU 46 2.033 -2.584 -12.604 937 HA GLU 46 HA GLU 46 2.440 -4.336 -14.862 938 HB2 GLU 46 HB2 GLU 46 0.897 -2.352 -14.769 939 HB3 GLU 46 HB3 GLU 46 2.314 -1.301 -14.631 940 HG2 GLU 46 HG2 GLU 46 3.111 -2.117 -16.856 941 HG3 GLU 46 HG3 GLU 46 1.662 -3.129 -16.981 942 H ILE 47 H ILE 47 4.373 -1.734 -13.282 943 HA ILE 47 HA ILE 47 6.417 -1.879 -15.371 944 HB ILE 47 HB ILE 47 6.524 -0.403 -12.723 945 HG12 ILE 47 HG12 ILE 47 4.474 0.336 -13.693 946 HG13 ILE 47 HG13 ILE 47 5.679 1.591 -14.003 947 HG21 ILE 47 HG21 ILE 47 7.855 0.065 -15.428 948 HG22 ILE 47 HG22 ILE 47 7.998 1.144 -14.022 949 HG23 ILE 47 HG23 ILE 47 8.648 -0.503 -13.947 950 HD11 ILE 47 HD11 ILE 47 5.978 0.669 -16.316 951 HD12 ILE 47 HD12 ILE 47 4.682 -0.509 -15.967 952 HD13 ILE 47 HD13 ILE 47 4.322 1.231 -15.990 953 H TYR 48 H TYR 48 5.832 -3.237 -12.185 954 HA TYR 48 HA TYR 48 8.482 -3.846 -11.432 955 HB2 TYR 48 HB2 TYR 48 6.478 -4.004 -9.996 956 HB3 TYR 48 HB3 TYR 48 5.897 -5.367 -10.951 957 HD1 TYR 48 HD1 TYR 48 8.459 -4.241 -8.519 958 HD2 TYR 48 HD2 TYR 48 6.824 -7.585 -10.687 959 HE1 TYR 48 HE1 TYR 48 9.677 -5.799 -7.026 960 HE2 TYR 48 HE2 TYR 48 7.980 -9.143 -9.171 961 HH TYR 48 HH TYR 48 10.094 -8.017 -6.504 962 H GLN 49 H GLN 49 6.363 -5.319 -13.847 963 HA GLN 49 HA GLN 49 7.915 -7.759 -14.102 964 HB2 GLN 49 HB2 GLN 49 5.814 -6.444 -15.877 965 HB3 GLN 49 HB3 GLN 49 6.451 -8.086 -16.107 966 HG2 GLN 49 HG2 GLN 49 5.590 -8.774 -13.924 967 HG3 GLN 49 HG3 GLN 49 5.083 -7.129 -13.553 968 HE21 GLN 49 HE22 GLN 49 2.924 -6.894 -13.688 969 HE22 GLN 49 HE21 GLN 49 1.891 -7.659 -14.882 970 H ARG 50 H ARG 50 8.114 -4.508 -15.402 971 HA ARG 50 HA ARG 50 9.925 -5.213 -17.611 972 HB2 ARG 50 HB2 ARG 50 8.896 -2.633 -16.359 973 HB3 ARG 50 HB3 ARG 50 10.269 -2.629 -17.452 974 HG2 ARG 50 HG2 ARG 50 8.319 -2.145 -18.748 975 HG3 ARG 50 HG3 ARG 50 8.872 -3.771 -19.190 976 HD2 ARG 50 HD2 ARG 50 7.138 -4.759 -17.745 977 HD3 ARG 50 HD3 ARG 50 6.624 -3.130 -17.252 978 HE ARG 50 HE ARG 50 6.579 -3.278 -20.090 979 HH11 ARG 50 HH11 ARG 50 4.810 -4.578 -17.313 980 HH12 ARG 50 HH12 ARG 50 3.364 -4.894 -18.249 981 HH21 ARG 50 HH21 ARG 50 4.660 -3.637 -21.250 982 HH22 ARG 50 HH22 ARG 50 3.268 -4.329 -20.454 983 H ILE 51 H ILE 51 10.118 -4.805 -14.213 984 HA ILE 51 HA ILE 51 12.917 -3.840 -14.341 985 HB ILE 51 HB ILE 51 10.826 -4.023 -12.155 986 HG12 ILE 51 HG12 ILE 51 12.283 -1.637 -13.379 987 HG13 ILE 51 HG13 ILE 51 10.752 -2.245 -14.017 988 HG21 ILE 51 HG21 ILE 51 12.423 -2.922 -10.659 989 HG22 ILE 51 HG22 ILE 51 13.086 -4.467 -11.202 990 HG23 ILE 51 HG23 ILE 51 13.667 -2.953 -11.940 991 HD11 ILE 51 HD11 ILE 51 9.657 -1.860 -11.864 992 HD12 ILE 51 HD12 ILE 51 11.192 -1.229 -11.191 993 HD13 ILE 51 HD13 ILE 51 10.372 -0.373 -12.518 994 H GLN 52 H GLN 52 10.935 -6.497 -12.874 995 HA GLN 52 HA GLN 52 13.254 -7.850 -11.871 996 HB2 GLN 52 HB2 GLN 52 10.385 -8.771 -12.362 997 HB3 GLN 52 HB3 GLN 52 11.613 -9.744 -11.537 998 HG2 GLN 52 HG2 GLN 52 10.460 -7.089 -10.647 999 HG3 GLN 52 HG3 GLN 52 10.415 -8.650 -9.813 1000 HE21 GLN 52 HE22 GLN 52 11.843 -5.664 -9.777 1001 HE22 GLN 52 HE21 GLN 52 13.371 -6.051 -9.023 1002 H ALA 53 H ALA 53 12.538 -7.280 -15.010 1003 HA ALA 53 HA ALA 53 13.049 -9.851 -16.192 1004 HB1 ALA 53 HB1 ALA 53 13.452 -7.026 -17.262 1005 HB2 ALA 53 HB2 ALA 53 13.407 -8.511 -18.239 1006 HB3 ALA 53 HB3 ALA 53 11.952 -7.973 -17.372 1007 H GLY 54 H GLY 54 15.131 -7.597 -14.528 1008 HA2 GLY 54 HA2 GLY 54 17.315 -9.194 -14.344 1009 HA3 GLY 54 HA3 GLY 54 17.545 -8.477 -15.945 1010 H LEU 55 H LEU 55 15.989 -6.398 -13.565 1011 HA LEU 55 HA LEU 55 18.496 -5.128 -12.782 1012 HB2 LEU 55 HB2 LEU 55 17.895 -2.993 -14.054 1013 HB3 LEU 55 HB3 LEU 55 18.508 -4.359 -14.983 1014 HG LEU 55 HG LEU 55 16.076 -4.973 -15.516 1015 HD11 LEU 55 HD11 LEU 55 15.628 -2.130 -14.529 1016 HD12 LEU 55 HD12 LEU 55 14.466 -3.126 -15.441 1017 HD13 LEU 55 HD13 LEU 55 14.944 -3.609 -13.802 1018 HD21 LEU 55 HD21 LEU 55 17.621 -3.973 -17.098 1019 HD22 LEU 55 HD22 LEU 55 15.982 -3.330 -17.327 1020 HD23 LEU 55 HD23 LEU 55 17.215 -2.344 -16.494 1021 H THR 56 H THR 56 17.714 -2.634 -12.087 1022 HA THR 56 HA THR 56 15.211 -2.898 -10.520 1023 HB THR 56 HB THR 56 17.789 -2.019 -9.187 1024 HG1 THR 56 HG1 THR 56 17.992 -4.190 -9.790 1025 HG21 THR 56 HG21 THR 56 15.765 -1.299 -8.028 1026 HG22 THR 56 HG22 THR 56 15.054 -2.920 -8.195 1027 HG23 THR 56 HG23 THR 56 16.464 -2.662 -7.136 1028 H ALA 57 H ALA 57 17.054 -1.096 -12.635 1029 HA ALA 57 HA ALA 57 15.604 1.369 -11.985 1030 HB1 ALA 57 HB1 ALA 57 18.648 1.231 -11.938 1031 HB2 ALA 57 HB2 ALA 57 17.676 2.718 -11.855 1032 HB3 ALA 57 HB3 ALA 57 17.594 1.524 -10.540 1033 HA PRO 58 HA PRO 58 15.995 0.181 -16.483 1034 HB2 PRO 58 HB2 PRO 58 13.555 1.967 -16.276 1035 HB3 PRO 58 HB3 PRO 58 13.816 0.573 -17.366 1036 HG2 PRO 58 HG2 PRO 58 12.357 0.269 -15.110 1037 HG3 PRO 58 HG3 PRO 58 13.608 -0.960 -15.507 1038 HD2 PRO 58 HD2 PRO 58 13.785 1.334 -13.544 1039 HD3 PRO 58 HD3 PRO 58 14.358 -0.356 -13.366 1040 H ASP 59 H ASP 59 15.105 3.413 -15.137 1041 HA ASP 59 HA ASP 59 17.265 4.766 -16.477 1042 HB2 ASP 59 HB2 ASP 59 15.751 4.303 -18.431 1043 HB3 ASP 59 HB3 ASP 59 14.436 5.094 -17.573 1044 H5' U 36 H5' U 36 -13.008 2.761 7.355 1045 H5'' U 36 H5'' U 36 -13.908 1.660 6.288 1046 H4' U 36 H4' U 36 -14.690 2.205 9.184 1047 H3' U 36 H3' U 36 -12.364 0.908 8.434 1048 H2' U 36 H2' U 36 -13.437 -0.698 7.049 1049 HO2' U 36 HO2' U 36 -12.269 -1.845 8.703 1050 H1' U 36 H1' U 36 -15.533 -0.953 9.206 1051 H3 U 36 H3 U 36 -18.281 -3.796 7.112 1052 H5 U 36 H5 U 36 -16.163 -2.063 3.928 1053 H6 U 36 H6 U 36 -14.978 -0.687 5.534 1054 HO5' U 36 HO5' U 36 -15.787 2.970 6.809 1055 H5' C 37 H5' C 37 -11.215 -0.074 13.130 1056 H5'' C 37 H5'' C 37 -12.527 -0.985 12.367 1057 H4' C 37 H4' C 37 -12.090 -0.232 15.226 1058 H3' C 37 H3' C 37 -12.068 -2.592 13.910 1059 H2' C 37 H2' C 37 -14.110 -2.301 12.763 1060 HO2' C 37 HO2' C 37 -14.238 -4.310 13.894 1061 H1' C 37 H1' C 37 -15.538 -1.510 15.276 1062 H41 C 37 H41 C 37 -19.591 1.219 11.197 1063 H42 C 37 H42 C 37 -18.376 1.308 9.936 1064 H5 C 37 H5 C 37 -16.072 0.503 10.257 1065 H6 C 37 H6 C 37 -14.563 -0.538 11.832 1066 H5' A 38 H5' A 38 -11.912 -5.385 15.532 1067 H5'' A 38 H5'' A 38 -10.851 -5.567 16.935 1068 H4' A 38 H4' A 38 -10.106 -7.055 15.150 1069 H3' A 38 H3' A 38 -8.333 -5.492 16.517 1070 H2' A 38 H2' A 38 -8.626 -3.564 15.064 1071 HO2' A 38 HO2' A 38 -6.387 -5.101 14.225 1072 H1' A 38 H1' A 38 -8.231 -5.468 12.736 1073 H8 A 38 H8 A 38 -9.639 -2.099 13.964 1074 H61 A 38 H61 A 38 -10.389 -0.767 7.973 1075 H62 A 38 H62 A 38 -10.492 -0.160 9.623 1076 H2 A 38 H2 A 38 -9.203 -5.052 8.285 1077 H5' G 39 H5' G 39 -8.526 -8.707 13.254 1078 H5'' G 39 H5'' G 39 -8.473 -10.281 14.073 1079 H4' G 39 H4' G 39 -7.865 -10.893 11.946 1080 H3' G 39 H3' G 39 -5.800 -11.088 13.699 1081 H2' G 39 H2' G 39 -4.854 -8.944 13.300 1082 HO2' G 39 HO2' G 39 -3.259 -10.546 12.743 1083 H1' G 39 H1' G 39 -5.208 -9.127 10.325 1084 H8 G 39 H8 G 39 -7.489 -6.654 11.096 1085 H1 G 39 H1 G 39 -1.664 -4.182 12.183 1086 H21 G 39 H21 G 39 -0.177 -5.783 12.323 1087 H22 G 39 H22 G 39 -0.596 -7.472 12.152 1088 H5' G 40 H5' G 40 -4.413 -11.935 9.270 1089 H5'' G 40 H5'' G 40 -4.067 -13.671 9.313 1090 H4' G 40 H4' G 40 -2.681 -12.510 7.668 1091 H3' G 40 H3' G 40 -1.704 -14.345 9.585 1092 H2' G 40 H2' G 40 -0.668 -12.542 10.823 1093 HO2' G 40 HO2' G 40 0.936 -14.135 10.087 1094 H1' G 40 H1' G 40 0.006 -11.432 8.079 1095 H8 G 40 H8 G 40 -1.090 -9.933 11.498 1096 H1 G 40 H1 G 40 4.583 -7.914 9.261 1097 H21 G 40 H21 G 40 5.063 -8.975 7.361 1098 H22 G 40 H22 G 40 3.953 -10.109 6.637 1099 H5' A 41 H5' A 41 -2.881 -15.246 5.021 1100 H5'' A 41 H5'' A 41 -3.022 -13.780 5.997 1101 H4' A 41 H4' A 41 -4.944 -16.117 6.350 1102 H3' A 41 H3' A 41 -4.924 -13.941 4.269 1103 H2' A 41 H2' A 41 -7.178 -13.446 4.658 1104 HO2' A 41 HO2' A 41 -7.879 -15.640 4.367 1105 H1' A 41 H1' A 41 -7.314 -14.390 7.348 1106 H8 A 41 H8 A 41 -5.262 -11.554 5.622 1107 H61 A 41 H61 A 41 -8.892 -7.769 8.973 1108 H62 A 41 H62 A 41 -7.602 -7.823 7.788 1109 H2 A 41 H2 A 41 -10.045 -11.950 9.873 1110 H5' C 42 H5' C 42 -6.009 -13.742 0.371 1111 H5'' C 42 H5'' C 42 -5.568 -13.075 1.949 1112 H4' C 42 H4' C 42 -7.777 -12.233 2.334 1113 H3' C 42 H3' C 42 -8.875 -14.359 1.131 1114 H2' C 42 H2' C 42 -7.845 -13.906 -1.014 1115 HO2' C 42 HO2' C 42 -9.643 -13.166 -2.333 1116 H1' C 42 H1' C 42 -8.954 -11.114 -0.661 1117 H41 C 42 H41 C 42 -5.967 -10.750 -6.331 1118 H42 C 42 H42 C 42 -4.421 -11.040 -5.549 1119 H5 C 42 H5 C 42 -4.208 -11.504 -3.169 1120 H6 C 42 H6 C 42 -5.451 -11.838 -1.101 1121 H5' A 43 H5' A 43 -10.698 -15.753 2.345 1122 H5'' A 43 H5'' A 43 -10.630 -14.952 0.771 1123 H4' A 43 H4' A 43 -13.283 -15.293 0.911 1124 H3' A 43 H3' A 43 -12.958 -16.994 2.893 1125 H2' A 43 H2' A 43 -10.822 -17.829 2.088 1126 HO2' A 43 HO2' A 43 -11.219 -20.004 1.465 1127 H1' A 43 H1' A 43 -11.920 -18.533 -0.600 1128 H8 A 43 H8 A 43 -9.799 -15.655 -0.997 1129 H61 A 43 H61 A 43 -4.820 -19.378 -1.050 1130 H62 A 43 H62 A 43 -5.407 -17.762 -1.408 1131 H2 A 43 H2 A 43 -8.256 -21.689 0.536 1132 H5' U 44 H5' U 44 -14.876 -14.140 0.733 1133 H5'' U 44 H5'' U 44 -16.382 -14.329 -0.174 1134 H4' U 44 H4' U 44 -14.837 -12.843 -1.361 1135 H3' U 44 H3' U 44 -15.091 -15.552 -2.715 1136 HO3' U 44 HO3' U 44 -16.641 -14.352 -3.946 1137 H2' U 44 H2' U 44 -13.945 -14.497 -4.543 1138 HO2' U 44 HO2' U 44 -13.589 -12.230 -4.522 1139 H1' U 44 H1' U 44 -12.162 -13.164 -2.885 1140 H3 U 44 H3 U 44 -9.460 -16.161 -4.916 1141 H5 U 44 H5 U 44 -12.216 -18.592 -2.879 1142 H6 U 44 H6 U 44 -13.358 -16.599 -2.146 Start of MODEL 3 1 H1 MET 1 H1 MET 1 8.383 10.476 -1.230 2 H2 MET 1 H2 MET 1 8.330 11.063 -2.761 3 H3 MET 1 H3 MET 1 8.313 9.435 -2.504 4 HA MET 1 HA MET 1 6.188 9.560 -1.427 5 HB2 MET 1 HB2 MET 1 6.412 11.818 -0.508 6 HB3 MET 1 HB3 MET 1 6.433 12.510 -2.141 7 HG2 MET 1 HG2 MET 1 4.208 12.764 -1.144 8 HG3 MET 1 HG3 MET 1 4.140 11.691 -2.532 9 HE1 MET 1 HE1 MET 1 1.836 12.031 -0.538 10 HE2 MET 1 HE2 MET 1 1.832 10.929 -1.930 11 HE3 MET 1 HE3 MET 1 1.316 10.335 -0.325 12 H LEU 2 H LEU 2 5.390 8.204 -3.000 13 HA LEU 2 HA LEU 2 5.108 9.342 -5.735 14 HB2 LEU 2 HB2 LEU 2 5.412 6.615 -4.540 15 HB3 LEU 2 HB3 LEU 2 4.277 6.734 -5.897 16 HG LEU 2 HG LEU 2 7.161 7.646 -5.962 17 HD11 LEU 2 HD11 LEU 2 6.896 5.199 -5.814 18 HD12 LEU 2 HD12 LEU 2 5.808 5.226 -7.216 19 HD13 LEU 2 HD13 LEU 2 7.518 5.722 -7.401 20 HD21 LEU 2 HD21 LEU 2 5.742 8.924 -7.565 21 HD22 LEU 2 HD22 LEU 2 6.729 7.745 -8.436 22 HD23 LEU 2 HD23 LEU 2 5.010 7.406 -8.137 23 H ILE 3 H ILE 3 3.173 9.306 -6.830 24 HA ILE 3 HA ILE 3 0.745 8.416 -5.368 25 HB ILE 3 HB ILE 3 1.059 11.069 -6.855 26 HG12 ILE 3 HG12 ILE 3 0.007 11.811 -4.567 27 HG13 ILE 3 HG13 ILE 3 0.696 10.301 -3.946 28 HG21 ILE 3 HG21 ILE 3 -1.373 9.705 -5.638 29 HG22 ILE 3 HG22 ILE 3 -1.332 11.378 -6.226 30 HG23 ILE 3 HG23 ILE 3 -1.107 10.044 -7.372 31 HD11 ILE 3 HD11 ILE 3 2.208 12.524 -5.389 32 HD12 ILE 3 HD12 ILE 3 2.190 12.261 -3.623 33 HD13 ILE 3 HD13 ILE 3 2.962 11.073 -4.681 34 H LEU 4 H LEU 4 -0.568 7.220 -6.648 35 HA LEU 4 HA LEU 4 -0.616 7.489 -9.512 36 HB2 LEU 4 HB2 LEU 4 0.164 5.015 -9.828 37 HB3 LEU 4 HB3 LEU 4 1.342 6.314 -9.686 38 HG LEU 4 HG LEU 4 1.608 5.725 -7.223 39 HD11 LEU 4 HD11 LEU 4 0.159 3.220 -8.175 40 HD12 LEU 4 HD12 LEU 4 1.074 3.372 -6.660 41 HD13 LEU 4 HD13 LEU 4 -0.404 4.336 -6.904 42 HD21 LEU 4 HD21 LEU 4 3.235 5.160 -8.970 43 HD22 LEU 4 HD22 LEU 4 3.123 3.865 -7.769 44 HD23 LEU 4 HD23 LEU 4 2.328 3.676 -9.352 45 H THR 5 H THR 5 -2.057 5.703 -10.493 46 HA THR 5 HA THR 5 -4.231 5.236 -8.499 47 HB THR 5 HB THR 5 -4.811 6.052 -11.349 48 HG1 THR 5 HG1 THR 5 -4.878 8.174 -10.622 49 HG21 THR 5 HG21 THR 5 -6.852 6.934 -10.319 50 HG22 THR 5 HG22 THR 5 -6.660 5.197 -9.980 51 HG23 THR 5 HG23 THR 5 -6.291 6.410 -8.720 52 H ARG 6 H ARG 6 -5.572 3.550 -8.802 53 HA ARG 6 HA ARG 6 -4.996 1.487 -10.876 54 HB2 ARG 6 HB2 ARG 6 -5.052 1.202 -7.838 55 HB3 ARG 6 HB3 ARG 6 -5.172 -0.179 -8.928 56 HG2 ARG 6 HG2 ARG 6 -2.827 1.625 -9.370 57 HG3 ARG 6 HG3 ARG 6 -2.857 0.706 -7.852 58 HD2 ARG 6 HD2 ARG 6 -1.695 -0.541 -9.619 59 HD3 ARG 6 HD3 ARG 6 -3.148 -1.395 -9.045 60 HE ARG 6 HE ARG 6 -4.201 -0.170 -11.136 61 HH11 ARG 6 HH11 ARG 6 -1.072 -1.791 -10.881 62 HH12 ARG 6 HH12 ARG 6 -0.981 -2.137 -12.595 63 HH21 ARG 6 HH21 ARG 6 -4.073 -0.655 -13.342 64 HH22 ARG 6 HH22 ARG 6 -2.677 -1.481 -14.000 65 H LYS 7 H LYS 7 -6.831 -0.226 -10.707 66 HA LYS 7 HA LYS 7 -9.174 0.875 -9.245 67 HB2 LYS 7 HB2 LYS 7 -10.707 -0.030 -10.886 68 HB3 LYS 7 HB3 LYS 7 -9.757 1.304 -11.533 69 HG2 LYS 7 HG2 LYS 7 -8.493 -0.158 -12.927 70 HG3 LYS 7 HG3 LYS 7 -8.937 -1.592 -11.958 71 HD2 LYS 7 HD2 LYS 7 -11.262 -1.420 -12.643 72 HD3 LYS 7 HD3 LYS 7 -10.951 0.100 -13.500 73 HE2 LYS 7 HE2 LYS 7 -11.142 -1.882 -14.977 74 HE3 LYS 7 HE3 LYS 7 -9.596 -1.008 -15.139 75 HZ1 LYS 7 HZ1 LYS 7 -9.969 -3.454 -13.538 76 HZ2 LYS 7 HZ2 LYS 7 -9.336 -3.412 -15.054 77 HZ3 LYS 7 HZ3 LYS 7 -8.545 -2.670 -13.829 78 H VAL 8 H VAL 8 -10.916 -0.944 -9.037 79 HA VAL 8 HA VAL 8 -9.707 -2.748 -7.253 80 HB VAL 8 HB VAL 8 -11.861 -3.750 -6.973 81 HG11 VAL 8 HG11 VAL 8 -13.163 -1.720 -6.488 82 HG12 VAL 8 HG12 VAL 8 -11.443 -1.427 -6.127 83 HG13 VAL 8 HG13 VAL 8 -12.174 -0.775 -7.613 84 HG21 VAL 8 HG21 VAL 8 -13.796 -3.157 -8.318 85 HG22 VAL 8 HG22 VAL 8 -12.762 -2.287 -9.480 86 HG23 VAL 8 HG23 VAL 8 -12.608 -4.057 -9.285 87 H GLY 9 H GLY 9 -8.917 -4.715 -7.292 88 HA2 GLY 9 HA2 GLY 9 -8.641 -6.908 -8.105 89 HA3 GLY 9 HA3 GLY 9 -9.278 -6.416 -9.682 90 H GLU 10 H GLU 10 -7.069 -4.043 -8.742 91 HA GLU 10 HA GLU 10 -4.935 -5.341 -10.364 92 HB2 GLU 10 HB2 GLU 10 -5.492 -2.404 -9.851 93 HB3 GLU 10 HB3 GLU 10 -4.214 -3.071 -10.892 94 HG2 GLU 10 HG2 GLU 10 -5.899 -4.170 -12.309 95 HG3 GLU 10 HG3 GLU 10 -7.202 -3.538 -11.292 96 H SER 11 H SER 11 -2.678 -4.030 -9.793 97 HA SER 11 HA SER 11 -2.282 -4.268 -6.867 98 HB2 SER 11 HB2 SER 11 -0.924 -6.000 -8.960 99 HB3 SER 11 HB3 SER 11 -0.460 -5.933 -7.248 100 HG SER 11 HG SER 11 -2.473 -6.756 -6.709 101 H ILE 12 H ILE 12 -0.005 -3.979 -6.273 102 HA ILE 12 HA ILE 12 1.622 -2.108 -7.891 103 HB ILE 12 HB ILE 12 0.461 -1.534 -5.129 104 HG12 ILE 12 HG12 ILE 12 -1.138 -1.058 -6.966 105 HG13 ILE 12 HG13 ILE 12 -0.658 0.377 -6.082 106 HG21 ILE 12 HG21 ILE 12 2.713 -0.680 -5.120 107 HG22 ILE 12 HG22 ILE 12 2.515 0.049 -6.731 108 HG23 ILE 12 HG23 ILE 12 1.625 0.692 -5.344 109 HD11 ILE 12 HD11 ILE 12 0.990 0.928 -7.899 110 HD12 ILE 12 HD12 ILE 12 0.352 -0.466 -8.817 111 HD13 ILE 12 HD13 ILE 12 -0.698 0.908 -8.424 112 H ASN 13 H ASN 13 3.833 -1.833 -6.705 113 HA ASN 13 HA ASN 13 4.350 -4.140 -4.898 114 HB2 ASN 13 HB2 ASN 13 5.003 -4.365 -7.536 115 HB3 ASN 13 HB3 ASN 13 6.437 -3.538 -6.942 116 HD21 ASN 13 HD22 ASN 13 4.614 -6.457 -7.074 117 HD22 ASN 13 HD21 ASN 13 5.641 -7.465 -6.077 118 H ILE 14 H ILE 14 6.193 -3.968 -3.571 119 HA ILE 14 HA ILE 14 7.635 -1.386 -3.512 120 HB ILE 14 HB ILE 14 6.358 -2.650 -1.051 121 HG12 ILE 14 HG12 ILE 14 5.558 -0.135 -2.586 122 HG13 ILE 14 HG13 ILE 14 4.635 -1.643 -2.510 123 HG21 ILE 14 HG21 ILE 14 7.140 -0.601 0.081 124 HG22 ILE 14 HG22 ILE 14 8.498 -1.469 -0.639 125 HG23 ILE 14 HG23 ILE 14 7.856 -0.020 -1.442 126 HD11 ILE 14 HD11 ILE 14 3.660 -0.072 -0.962 127 HD12 ILE 14 HD12 ILE 14 4.434 -1.375 -0.038 128 HD13 ILE 14 HD13 ILE 14 5.225 0.220 -0.179 129 H GLY 15 H GLY 15 9.743 -1.588 -2.720 130 HA2 GLY 15 HA2 GLY 15 11.756 -2.703 -2.466 131 HA3 GLY 15 HA3 GLY 15 10.861 -3.807 -1.398 132 H ASP 16 H ASP 16 11.704 -5.736 -2.059 133 HA ASP 16 HA ASP 16 10.942 -6.606 -4.802 134 HB2 ASP 16 HB2 ASP 16 13.492 -7.307 -3.290 135 HB3 ASP 16 HB3 ASP 16 12.983 -8.010 -4.828 136 H ASP 17 H ASP 17 10.016 -6.758 -1.767 137 HA ASP 17 HA ASP 17 9.343 -9.637 -1.851 138 HB2 ASP 17 HB2 ASP 17 10.568 -8.243 0.562 139 HB3 ASP 17 HB3 ASP 17 9.973 -9.898 0.520 140 H ILE 18 H ILE 18 8.048 -6.646 -1.879 141 HA ILE 18 HA ILE 18 5.807 -7.529 -0.130 142 HB ILE 18 HB ILE 18 6.808 -4.672 -0.421 143 HG12 ILE 18 HG12 ILE 18 6.957 -5.119 2.221 144 HG13 ILE 18 HG13 ILE 18 7.285 -6.769 1.681 145 HG21 ILE 18 HG21 ILE 18 5.104 -4.218 1.340 146 HG22 ILE 18 HG22 ILE 18 4.397 -4.763 -0.180 147 HG23 ILE 18 HG23 ILE 18 4.528 -5.892 1.187 148 HD11 ILE 18 HD11 ILE 18 8.748 -4.257 0.729 149 HD12 ILE 18 HD12 ILE 18 9.358 -5.401 1.953 150 HD13 ILE 18 HD13 ILE 18 9.157 -5.920 0.269 151 H THR 19 H THR 19 3.772 -7.216 -0.953 152 HA THR 19 HA THR 19 3.522 -5.809 -3.560 153 HB THR 19 HB THR 19 2.415 -8.586 -2.965 154 HG1 THR 19 HG1 THR 19 4.652 -8.598 -3.308 155 HG21 THR 19 HG21 THR 19 2.424 -6.873 -5.480 156 HG22 THR 19 HG22 THR 19 1.924 -8.577 -5.403 157 HG23 THR 19 HG23 THR 19 0.993 -7.350 -4.524 158 H ILE 20 H ILE 20 1.333 -5.132 -4.000 159 HA ILE 20 HA ILE 20 -0.478 -5.071 -1.633 160 HB ILE 20 HB ILE 20 0.321 -2.729 -3.408 161 HG12 ILE 20 HG12 ILE 20 2.100 -3.320 -1.773 162 HG13 ILE 20 HG13 ILE 20 1.396 -1.723 -1.511 163 HG21 ILE 20 HG21 ILE 20 -1.615 -2.903 -1.066 164 HG22 ILE 20 HG22 ILE 20 -1.035 -1.384 -1.786 165 HG23 ILE 20 HG23 ILE 20 -2.000 -2.516 -2.754 166 HD11 ILE 20 HD11 ILE 20 0.081 -2.525 0.361 167 HD12 ILE 20 HD12 ILE 20 0.587 -4.204 0.046 168 HD13 ILE 20 HD13 ILE 20 1.777 -2.996 0.588 169 H THR 21 H THR 21 -2.676 -4.996 -2.191 170 HA THR 21 HA THR 21 -3.376 -4.974 -5.075 171 HB THR 21 HB THR 21 -4.178 -7.175 -3.125 172 HG1 THR 21 HG1 THR 21 -2.048 -7.392 -3.854 173 HG21 THR 21 HG21 THR 21 -5.938 -6.709 -4.795 174 HG22 THR 21 HG22 THR 21 -4.732 -6.821 -6.099 175 HG23 THR 21 HG23 THR 21 -5.134 -8.254 -5.122 176 H ILE 22 H ILE 22 -5.457 -4.248 -5.466 177 HA ILE 22 HA ILE 22 -6.902 -3.120 -3.122 178 HB ILE 22 HB ILE 22 -6.330 -1.391 -4.598 179 HG12 ILE 22 HG12 ILE 22 -8.404 -0.583 -5.592 180 HG13 ILE 22 HG13 ILE 22 -9.113 -2.214 -5.502 181 HG21 ILE 22 HG21 ILE 22 -5.542 -2.630 -6.512 182 HG22 ILE 22 HG22 ILE 22 -7.198 -3.147 -6.921 183 HG23 ILE 22 HG23 ILE 22 -6.733 -1.433 -7.040 184 HD11 ILE 22 HD11 ILE 22 -8.222 -0.565 -3.123 185 HD12 ILE 22 HD12 ILE 22 -9.907 -0.784 -3.674 186 HD13 ILE 22 HD13 ILE 22 -8.987 -2.180 -3.075 187 H LEU 23 H LEU 23 -8.259 -4.682 -2.370 188 HA LEU 23 HA LEU 23 -9.290 -6.739 -4.089 189 HB2 LEU 23 HB2 LEU 23 -10.303 -5.946 -1.335 190 HB3 LEU 23 HB3 LEU 23 -10.537 -7.482 -2.166 191 HG LEU 23 HG LEU 23 -8.027 -6.398 -0.883 192 HD11 LEU 23 HD11 LEU 23 -9.570 -9.021 -0.710 193 HD12 LEU 23 HD12 LEU 23 -8.121 -8.613 0.227 194 HD13 LEU 23 HD13 LEU 23 -9.639 -7.699 0.471 195 HD21 LEU 23 HD21 LEU 23 -6.857 -8.434 -1.733 196 HD22 LEU 23 HD22 LEU 23 -8.224 -8.724 -2.833 197 HD23 LEU 23 HD23 LEU 23 -7.220 -7.257 -3.011 198 H GLY 24 H GLY 24 -10.583 -3.597 -3.007 199 HA2 GLY 24 HA2 GLY 24 -12.263 -3.155 -5.089 200 HA3 GLY 24 HA3 GLY 24 -13.263 -4.188 -4.086 201 H VAL 25 H VAL 25 -14.545 -2.023 -4.286 202 HA VAL 25 HA VAL 25 -13.955 -0.437 -1.847 203 HB VAL 25 HB VAL 25 -14.223 1.642 -2.892 204 HG11 VAL 25 HG11 VAL 25 -12.015 0.581 -3.395 205 HG12 VAL 25 HG12 VAL 25 -12.679 0.031 -4.955 206 HG13 VAL 25 HG13 VAL 25 -12.524 1.765 -4.610 207 HG21 VAL 25 HG21 VAL 25 -16.155 1.235 -4.268 208 HG22 VAL 25 HG22 VAL 25 -14.877 1.942 -5.264 209 HG23 VAL 25 HG23 VAL 25 -15.213 0.201 -5.376 210 H SER 26 H SER 26 -15.801 0.803 -1.082 211 HA SER 26 HA SER 26 -18.418 0.329 -2.300 212 HB2 SER 26 HB2 SER 26 -18.146 -1.640 -0.804 213 HB3 SER 26 HB3 SER 26 -17.818 -0.542 0.558 214 HG SER 26 HG SER 26 -20.020 -1.174 0.448 215 H GLY 27 H GLY 27 -19.202 2.412 -2.366 216 HA2 GLY 27 HA2 GLY 27 -19.682 4.571 -1.696 217 HA3 GLY 27 HA3 GLY 27 -19.402 4.018 -0.024 218 H GLN 28 H GLN 28 -17.562 4.644 1.021 219 HA GLN 28 HA GLN 28 -15.418 5.931 -0.626 220 HB2 GLN 28 HB2 GLN 28 -16.135 6.443 2.287 221 HB3 GLN 28 HB3 GLN 28 -14.826 7.206 1.379 222 HG2 GLN 28 HG2 GLN 28 -17.804 7.554 0.994 223 HG3 GLN 28 HG3 GLN 28 -16.593 8.754 1.495 224 HE21 GLN 28 HE22 GLN 28 -14.601 8.703 -0.289 225 HE22 GLN 28 HE21 GLN 28 -15.160 8.915 -1.930 226 H GLN 29 H GLN 29 -16.244 3.284 1.453 227 HA GLN 29 HA GLN 29 -13.611 2.929 2.571 228 HB2 GLN 29 HB2 GLN 29 -15.931 0.977 2.221 229 HB3 GLN 29 HB3 GLN 29 -14.392 0.597 3.009 230 HG2 GLN 29 HG2 GLN 29 -16.053 1.125 4.685 231 HG3 GLN 29 HG3 GLN 29 -14.704 2.260 4.704 232 HE21 GLN 29 HE22 GLN 29 -15.379 4.247 5.170 233 HE22 GLN 29 HE21 GLN 29 -16.814 5.002 4.485 234 H VAL 30 H VAL 30 -12.039 1.456 1.951 235 HA VAL 30 HA VAL 30 -12.111 0.373 -0.812 236 HB VAL 30 HB VAL 30 -9.927 2.112 0.429 237 HG11 VAL 30 HG11 VAL 30 -9.084 0.267 -1.033 238 HG12 VAL 30 HG12 VAL 30 -10.108 0.889 -2.347 239 HG13 VAL 30 HG13 VAL 30 -8.785 1.891 -1.707 240 HG21 VAL 30 HG21 VAL 30 -10.430 3.650 -1.459 241 HG22 VAL 30 HG22 VAL 30 -11.818 2.630 -1.898 242 HG23 VAL 30 HG23 VAL 30 -11.801 3.493 -0.344 243 H ARG 31 H ARG 31 -11.899 -1.771 -0.414 244 HA ARG 31 HA ARG 31 -10.447 -2.677 1.978 245 HB2 ARG 31 HB2 ARG 31 -12.663 -3.637 1.129 246 HB3 ARG 31 HB3 ARG 31 -11.731 -4.385 -0.187 247 HG2 ARG 31 HG2 ARG 31 -10.304 -5.532 1.511 248 HG3 ARG 31 HG3 ARG 31 -11.208 -4.709 2.802 249 HD2 ARG 31 HD2 ARG 31 -13.310 -5.791 1.777 250 HD3 ARG 31 HD3 ARG 31 -12.195 -6.837 0.884 251 HE ARG 31 HE ARG 31 -12.243 -6.588 3.879 252 HH11 ARG 31 HH11 ARG 31 -12.049 -8.652 0.989 253 HH12 ARG 31 HH12 ARG 31 -11.811 -10.103 1.950 254 HH21 ARG 31 HH21 ARG 31 -11.982 -8.532 5.042 255 HH22 ARG 31 HH22 ARG 31 -11.781 -10.034 4.162 256 H ILE 32 H ILE 32 -8.405 -3.410 1.977 257 HA ILE 32 HA ILE 32 -7.025 -3.614 -0.662 258 HB ILE 32 HB ILE 32 -5.752 -2.341 1.770 259 HG12 ILE 32 HG12 ILE 32 -7.563 -0.970 -0.244 260 HG13 ILE 32 HG13 ILE 32 -7.725 -1.026 1.517 261 HG21 ILE 32 HG21 ILE 32 -4.345 -3.051 -0.153 262 HG22 ILE 32 HG22 ILE 32 -5.302 -1.997 -1.221 263 HG23 ILE 32 HG23 ILE 32 -4.314 -1.308 0.096 264 HD11 ILE 32 HD11 ILE 32 -6.881 1.149 0.887 265 HD12 ILE 32 HD12 ILE 32 -5.594 0.258 1.730 266 HD13 ILE 32 HD13 ILE 32 -5.563 0.425 -0.045 267 H GLY 33 H GLY 33 -5.082 -4.893 -0.635 268 HA2 GLY 33 HA2 GLY 33 -4.815 -6.692 1.723 269 HA3 GLY 33 HA3 GLY 33 -4.811 -7.311 0.061 270 H ILE 34 H ILE 34 -2.696 -7.585 1.977 271 HA ILE 34 HA ILE 34 -0.472 -6.155 0.626 272 HB ILE 34 HB ILE 34 -0.877 -6.367 3.645 273 HG12 ILE 34 HG12 ILE 34 -1.010 -3.869 1.896 274 HG13 ILE 34 HG13 ILE 34 -2.416 -4.704 2.577 275 HG21 ILE 34 HG21 ILE 34 1.149 -4.910 3.745 276 HG22 ILE 34 HG22 ILE 34 1.486 -6.461 2.973 277 HG23 ILE 34 HG23 ILE 34 1.288 -5.007 1.977 278 HD11 ILE 34 HD11 ILE 34 -0.206 -3.375 4.178 279 HD12 ILE 34 HD12 ILE 34 -1.900 -2.859 4.012 280 HD13 ILE 34 HD13 ILE 34 -1.516 -4.378 4.856 281 H ASN 35 H ASN 35 1.414 -7.366 0.568 282 HA ASN 35 HA ASN 35 1.312 -10.044 1.840 283 HB2 ASN 35 HB2 ASN 35 0.303 -10.076 -0.464 284 HB3 ASN 35 HB3 ASN 35 1.856 -9.565 -1.117 285 HD21 ASN 35 HD22 ASN 35 0.293 -12.047 -1.575 286 HD22 ASN 35 HD21 ASN 35 1.322 -13.379 -1.093 287 H ALA 36 H ALA 36 3.028 -9.895 3.136 288 HA ALA 36 HA ALA 36 5.691 -9.458 1.937 289 HB1 ALA 36 HB1 ALA 36 5.015 -7.222 2.747 290 HB2 ALA 36 HB2 ALA 36 4.630 -7.916 4.342 291 HB3 ALA 36 HB3 ALA 36 6.308 -7.906 3.756 292 HA PRO 37 HA PRO 37 6.751 -12.669 4.816 293 HB2 PRO 37 HB2 PRO 37 9.327 -11.915 5.481 294 HB3 PRO 37 HB3 PRO 37 8.882 -12.707 3.924 295 HG2 PRO 37 HG2 PRO 37 9.302 -9.763 4.497 296 HG3 PRO 37 HG3 PRO 37 9.907 -10.727 3.114 297 HD2 PRO 37 HD2 PRO 37 7.686 -9.189 2.905 298 HD3 PRO 37 HD3 PRO 37 7.780 -10.802 2.120 299 H LYS 38 H LYS 38 7.110 -13.021 7.116 300 HA LYS 38 HA LYS 38 6.310 -10.820 8.813 301 HB2 LYS 38 HB2 LYS 38 7.409 -13.610 9.430 302 HB3 LYS 38 HB3 LYS 38 6.779 -12.499 10.662 303 HG2 LYS 38 HG2 LYS 38 5.171 -13.445 8.247 304 HG3 LYS 38 HG3 LYS 38 5.112 -14.231 9.825 305 HD2 LYS 38 HD2 LYS 38 4.585 -11.248 9.554 306 HD3 LYS 38 HD3 LYS 38 3.334 -12.426 9.182 307 HE2 LYS 38 HE2 LYS 38 4.855 -12.310 11.833 308 HE3 LYS 38 HE3 LYS 38 3.292 -11.530 11.547 309 HZ1 LYS 38 HZ1 LYS 38 3.011 -13.674 12.555 310 HZ2 LYS 38 HZ2 LYS 38 2.358 -13.671 11.048 311 HZ3 LYS 38 HZ3 LYS 38 3.795 -14.422 11.323 312 H ASP 39 H ASP 39 9.053 -11.396 7.238 313 HA ASP 39 HA ASP 39 11.117 -10.603 9.055 314 HB2 ASP 39 HB2 ASP 39 11.236 -11.631 6.674 315 HB3 ASP 39 HB3 ASP 39 10.965 -9.991 6.085 316 H VAL 40 H VAL 40 8.414 -8.931 7.824 317 HA VAL 40 HA VAL 40 9.539 -6.309 8.625 318 HB VAL 40 HB VAL 40 8.589 -5.213 6.687 319 HG11 VAL 40 HG11 VAL 40 10.165 -7.651 5.753 320 HG12 VAL 40 HG12 VAL 40 10.009 -6.100 4.909 321 HG13 VAL 40 HG13 VAL 40 10.889 -6.183 6.454 322 HG21 VAL 40 HG21 VAL 40 6.648 -6.720 6.338 323 HG22 VAL 40 HG22 VAL 40 7.546 -6.368 4.851 324 HG23 VAL 40 HG23 VAL 40 7.759 -7.937 5.645 325 H ALA 41 H ALA 41 7.662 -4.665 8.808 326 HA ALA 41 HA ALA 41 5.433 -6.108 10.158 327 HB1 ALA 41 HB1 ALA 41 6.559 -3.321 10.639 328 HB2 ALA 41 HB2 ALA 41 5.267 -4.103 11.573 329 HB3 ALA 41 HB3 ALA 41 6.916 -4.771 11.611 330 H VAL 42 H VAL 42 3.304 -5.155 10.074 331 HA VAL 42 HA VAL 42 2.789 -2.925 8.279 332 HB VAL 42 HB VAL 42 2.809 -4.433 6.507 333 HG11 VAL 42 HG11 VAL 42 1.543 -6.483 8.353 334 HG12 VAL 42 HG12 VAL 42 1.756 -6.709 6.594 335 HG13 VAL 42 HG13 VAL 42 3.174 -6.509 7.633 336 HG21 VAL 42 HG21 VAL 42 0.493 -4.847 5.859 337 HG22 VAL 42 HG22 VAL 42 -0.061 -4.583 7.518 338 HG23 VAL 42 HG23 VAL 42 0.660 -3.235 6.598 339 H HIS 43 H HIS 43 1.136 -1.780 9.075 340 HA HIS 43 HA HIS 43 -1.134 -3.095 10.378 341 HB2 HIS 43 HB2 HIS 43 0.282 -0.942 11.969 342 HB3 HIS 43 HB3 HIS 43 -0.913 -2.112 12.499 343 HD2 HIS 43 HD2 HIS 43 2.862 -1.835 11.680 344 HE1 HIS 43 HE1 HIS 43 2.341 -5.304 14.087 345 HE2 HIS 43 HE2 HIS 43 4.052 -3.776 12.985 346 H ARG 44 H ARG 44 -2.757 -1.345 11.107 347 HA ARG 44 HA ARG 44 -3.087 0.600 9.010 348 HB2 ARG 44 HB2 ARG 44 -4.457 0.323 11.725 349 HB3 ARG 44 HB3 ARG 44 -5.011 1.343 10.380 350 HG2 ARG 44 HG2 ARG 44 -5.245 -0.660 8.947 351 HG3 ARG 44 HG3 ARG 44 -4.736 -1.688 10.306 352 HD2 ARG 44 HD2 ARG 44 -7.190 0.118 10.266 353 HD3 ARG 44 HD3 ARG 44 -7.199 -1.641 10.049 354 HE ARG 44 HE ARG 44 -6.311 -1.852 12.348 355 HH11 ARG 44 HH11 ARG 44 -7.868 1.200 11.471 356 HH12 ARG 44 HH12 ARG 44 -8.265 1.606 13.127 357 HH21 ARG 44 HH21 ARG 44 -6.840 -1.302 14.474 358 HH22 ARG 44 HH22 ARG 44 -7.687 0.194 14.825 359 H GLU 45 H GLU 45 -3.182 2.985 9.399 360 HA GLU 45 HA GLU 45 -0.755 3.836 10.590 361 HB2 GLU 45 HB2 GLU 45 -1.846 4.962 8.727 362 HB3 GLU 45 HB3 GLU 45 -3.229 5.414 9.722 363 HG2 GLU 45 HG2 GLU 45 -0.422 6.281 10.483 364 HG3 GLU 45 HG3 GLU 45 -1.312 7.131 9.220 365 H GLU 46 H GLU 46 -3.857 3.205 11.979 366 HA GLU 46 HA GLU 46 -3.659 4.883 14.301 367 HB2 GLU 46 HB2 GLU 46 -5.733 3.759 13.382 368 HB3 GLU 46 HB3 GLU 46 -5.051 2.205 13.877 369 HG2 GLU 46 HG2 GLU 46 -6.639 2.949 15.549 370 HG3 GLU 46 HG3 GLU 46 -5.019 3.011 16.249 371 H ILE 47 H ILE 47 -2.778 1.452 13.599 372 HA ILE 47 HA ILE 47 -2.002 0.970 16.354 373 HB ILE 47 HB ILE 47 -1.470 -0.692 13.876 374 HG12 ILE 47 HG12 ILE 47 -3.820 -0.323 13.807 375 HG13 ILE 47 HG13 ILE 47 -3.557 -1.938 14.482 376 HG21 ILE 47 HG21 ILE 47 -1.561 -2.583 15.512 377 HG22 ILE 47 HG22 ILE 47 -0.245 -1.451 15.840 378 HG23 ILE 47 HG23 ILE 47 -1.721 -1.404 16.833 379 HD11 ILE 47 HD11 ILE 47 -4.275 0.601 16.001 380 HD12 ILE 47 HD12 ILE 47 -5.307 -0.811 15.729 381 HD13 ILE 47 HD13 ILE 47 -3.879 -0.962 16.780 382 H TYR 48 H TYR 48 -0.427 2.020 13.395 383 HA TYR 48 HA TYR 48 2.222 1.188 13.947 384 HB2 TYR 48 HB2 TYR 48 1.339 1.951 11.772 385 HB3 TYR 48 HB3 TYR 48 1.137 3.580 12.416 386 HD1 TYR 48 HD2 TYR 48 3.714 0.981 11.621 387 HD2 TYR 48 HD1 TYR 48 2.919 5.134 12.430 388 HE1 TYR 48 HE2 TYR 48 6.013 1.570 10.880 389 HE2 TYR 48 HE1 TYR 48 5.161 5.733 11.655 390 HH TYR 48 HH TYR 48 7.161 4.965 10.792 391 H GLN 49 H GLN 49 0.291 3.854 15.231 392 HA GLN 49 HA GLN 49 2.551 5.416 16.118 393 HB2 GLN 49 HB2 GLN 49 -0.408 5.426 16.866 394 HB3 GLN 49 HB3 GLN 49 0.768 6.649 17.401 395 HG2 GLN 49 HG2 GLN 49 1.221 7.315 15.106 396 HG3 GLN 49 HG3 GLN 49 0.270 5.980 14.469 397 HE21 GLN 49 HE22 GLN 49 -1.673 6.605 13.709 398 HE22 GLN 49 HE21 GLN 49 -2.641 7.920 14.333 399 H ARG 50 H ARG 50 0.872 2.612 17.415 400 HA ARG 50 HA ARG 50 1.732 2.991 20.180 401 HB2 ARG 50 HB2 ARG 50 0.619 0.680 18.540 402 HB3 ARG 50 HB3 ARG 50 1.334 0.397 20.125 403 HG2 ARG 50 HG2 ARG 50 -1.039 0.625 20.384 404 HG3 ARG 50 HG3 ARG 50 -0.248 2.020 21.140 405 HD2 ARG 50 HD2 ARG 50 -0.783 3.400 19.158 406 HD3 ARG 50 HD3 ARG 50 -1.508 1.985 18.373 407 HE ARG 50 HE ARG 50 -2.753 2.338 20.898 408 HH11 ARG 50 HH11 ARG 50 -2.575 3.964 17.758 409 HH12 ARG 50 HH12 ARG 50 -4.131 4.728 17.948 410 HH21 ARG 50 HH21 ARG 50 -4.786 3.351 21.102 411 HH22 ARG 50 HH22 ARG 50 -5.374 4.380 19.813 412 H ILE 51 H ILE 51 3.227 2.144 17.230 413 HA ILE 51 HA ILE 51 5.329 0.512 18.539 414 HB ILE 51 HB ILE 51 4.540 1.028 15.645 415 HG12 ILE 51 HG12 ILE 51 4.405 -1.520 17.303 416 HG13 ILE 51 HG13 ILE 51 3.042 -0.390 17.186 417 HG21 ILE 51 HG21 ILE 51 6.975 0.648 15.846 418 HG22 ILE 51 HG22 ILE 51 6.657 -0.831 16.785 419 HG23 ILE 51 HG23 ILE 51 6.173 -0.729 15.070 420 HD11 ILE 51 HD11 ILE 51 2.729 -2.176 15.614 421 HD12 ILE 51 HD12 ILE 51 2.999 -0.658 14.743 422 HD13 ILE 51 HD13 ILE 51 4.312 -1.863 14.857 423 H GLN 52 H GLN 52 4.852 3.490 16.553 424 HA GLN 52 HA GLN 52 7.661 4.153 16.584 425 HB2 GLN 52 HB2 GLN 52 5.188 5.844 16.002 426 HB3 GLN 52 HB3 GLN 52 6.862 6.344 15.704 427 HG2 GLN 52 HG2 GLN 52 5.348 4.078 14.385 428 HG3 GLN 52 HG3 GLN 52 6.051 5.522 13.640 429 HE21 GLN 52 HE22 GLN 52 6.497 2.230 14.301 430 HE22 GLN 52 HE21 GLN 52 8.221 2.130 14.030 431 H ALA 53 H ALA 53 5.615 3.981 19.151 432 HA ALA 53 HA ALA 53 6.123 6.433 20.506 433 HB1 ALA 53 HB1 ALA 53 4.278 4.880 21.025 434 HB2 ALA 53 HB2 ALA 53 5.447 3.655 21.561 435 HB3 ALA 53 HB3 ALA 53 5.287 5.186 22.460 436 H GLY 54 H GLY 54 8.225 3.747 19.797 437 HA2 GLY 54 HA2 GLY 54 10.565 4.767 20.519 438 HA3 GLY 54 HA3 GLY 54 9.963 4.321 22.124 439 H LEU 55 H LEU 55 9.104 2.249 19.360 440 HA LEU 55 HA LEU 55 11.201 0.314 19.969 441 HB2 LEU 55 HB2 LEU 55 9.515 -1.338 20.906 442 HB3 LEU 55 HB3 LEU 55 9.930 0.021 21.947 443 HG LEU 55 HG LEU 55 7.818 1.207 21.114 444 HD11 LEU 55 HD11 LEU 55 7.184 -1.615 20.159 445 HD12 LEU 55 HD12 LEU 55 6.018 -0.279 20.320 446 HD13 LEU 55 HD13 LEU 55 7.319 -0.167 19.125 447 HD21 LEU 55 HD21 LEU 55 6.419 -0.053 22.681 448 HD22 LEU 55 HD22 LEU 55 7.591 -1.396 22.661 449 HD23 LEU 55 HD23 LEU 55 8.059 0.193 23.320 450 H THR 56 H THR 56 10.150 -2.001 19.130 451 HA THR 56 HA THR 56 8.672 -1.513 16.613 452 HB THR 56 HB THR 56 11.146 -3.260 16.595 453 HG1 THR 56 HG1 THR 56 11.806 -1.167 17.121 454 HG21 THR 56 HG21 THR 56 9.573 -3.547 14.712 455 HG22 THR 56 HG22 THR 56 9.529 -1.791 14.456 456 HG23 THR 56 HG23 THR 56 11.029 -2.701 14.151 457 H ALA 57 H ALA 57 8.699 -3.027 19.482 458 HA ALA 57 HA ALA 57 7.103 -5.280 18.495 459 HB1 ALA 57 HB1 ALA 57 9.608 -5.672 20.185 460 HB2 ALA 57 HB2 ALA 57 8.411 -6.931 19.795 461 HB3 ALA 57 HB3 ALA 57 9.391 -6.197 18.502 462 HA PRO 58 HA PRO 58 5.391 -2.931 22.142 463 HB2 PRO 58 HB2 PRO 58 3.043 -4.288 20.808 464 HB3 PRO 58 HB3 PRO 58 3.098 -2.690 21.617 465 HG2 PRO 58 HG2 PRO 58 3.209 -2.849 18.924 466 HG3 PRO 58 HG3 PRO 58 4.351 -1.756 19.784 467 HD2 PRO 58 HD2 PRO 58 4.864 -4.519 18.672 468 HD3 PRO 58 HD3 PRO 58 5.906 -3.064 18.610 469 H ASP 59 H ASP 59 4.700 -3.651 24.091 470 HA ASP 59 HA ASP 59 4.309 -4.993 25.848 471 HB2 ASP 59 HB2 ASP 59 2.245 -5.273 24.525 472 HB3 ASP 59 HB3 ASP 59 2.911 -6.721 23.780 473 H5' U 36 H5' U 36 -8.299 5.369 -15.259 474 H5'' U 36 H5'' U 36 -8.491 6.679 -14.085 475 H4' U 36 H4' U 36 -7.329 7.039 -16.885 476 H3' U 36 H3' U 36 -6.025 5.661 -14.916 477 H2' U 36 H2' U 36 -6.032 7.072 -13.126 478 HO2' U 36 HO2' U 36 -3.841 7.235 -13.838 479 H1' U 36 H1' U 36 -5.999 9.673 -14.442 480 H3 U 36 H3 U 36 -9.138 11.853 -12.126 481 H5 U 36 H5 U 36 -9.122 7.995 -10.471 482 H6 U 36 H6 U 36 -7.696 7.275 -12.268 483 HO5' U 36 HO5' U 36 -9.796 7.749 -15.666 484 H5' C 37 H5' C 37 -1.827 5.358 -17.748 485 H5'' C 37 H5'' C 37 -2.124 6.946 -17.030 486 H4' C 37 H4' C 37 -1.116 6.219 -19.793 487 H3' C 37 H3' C 37 0.266 7.107 -17.649 488 H2' C 37 H2' C 37 -1.244 8.825 -17.037 489 HO2' C 37 HO2' C 37 -0.199 10.796 -17.555 490 H1' C 37 H1' C 37 -1.281 9.895 -19.843 491 H41 C 37 H41 C 37 -6.693 12.558 -17.793 492 H42 C 37 H42 C 37 -6.867 11.384 -16.498 493 H5 C 37 H5 C 37 -5.247 9.532 -16.165 494 H6 C 37 H6 C 37 -3.240 8.542 -16.992 495 H5' A 38 H5' A 38 2.980 8.835 -18.223 496 H5'' A 38 H5'' A 38 4.430 8.053 -18.881 497 H4' A 38 H4' A 38 4.787 8.664 -16.550 498 H3' A 38 H3' A 38 5.488 6.217 -17.508 499 H2' A 38 H2' A 38 3.337 5.204 -17.118 500 HO2' A 38 HO2' A 38 5.041 3.968 -16.081 501 H1' A 38 H1' A 38 3.416 6.388 -14.337 502 H8 A 38 H8 A 38 1.236 4.985 -17.190 503 H61 A 38 H61 A 38 -3.193 4.790 -12.841 504 H62 A 38 H62 A 38 -2.797 4.353 -14.493 505 H2 A 38 H2 A 38 0.191 7.215 -11.283 506 H5' G 39 H5' G 39 5.204 9.249 -14.484 507 H5'' G 39 H5'' G 39 6.589 10.270 -14.913 508 H4' G 39 H4' G 39 5.821 11.217 -12.924 509 H3' G 39 H3' G 39 8.331 10.278 -12.807 510 H2' G 39 H2' G 39 7.844 8.056 -12.125 511 HO2' G 39 HO2' G 39 8.124 9.571 -9.747 512 H1' G 39 H1' G 39 5.789 8.802 -10.103 513 H8 G 39 H8 G 39 3.676 7.515 -12.469 514 H1 G 39 H1 G 39 7.433 2.643 -10.649 515 H21 G 39 H21 G 39 9.224 3.395 -9.662 516 H22 G 39 H22 G 39 9.528 5.103 -9.420 517 H5' G 40 H5' G 40 6.971 11.181 -8.301 518 H5'' G 40 H5'' G 40 8.026 12.535 -7.884 519 H4' G 40 H4' G 40 7.635 11.066 -5.947 520 H3' G 40 H3' G 40 10.129 12.073 -6.769 521 H2' G 40 H2' G 40 10.776 9.868 -7.589 522 HO2' G 40 HO2' G 40 12.245 10.677 -5.875 523 H1' G 40 H1' G 40 9.384 8.877 -5.084 524 H8 G 40 H8 G 40 9.840 7.630 -8.761 525 H1 G 40 H1 G 40 11.738 3.604 -4.127 526 H21 G 40 H21 G 40 11.494 4.566 -2.141 527 H22 G 40 H22 G 40 10.806 6.161 -1.977 528 H5' A 41 H5' A 41 7.503 13.942 -3.448 529 H5'' A 41 H5'' A 41 7.313 12.730 -4.736 530 H4' A 41 H4' A 41 7.318 15.693 -5.384 531 H3' A 41 H3' A 41 5.140 13.983 -4.203 532 H2' A 41 H2' A 41 3.571 14.734 -5.785 533 HO2' A 41 HO2' A 41 3.975 16.969 -5.435 534 H1' A 41 H1' A 41 5.388 15.294 -7.885 535 H8 A 41 H8 A 41 4.438 12.077 -5.870 536 H61 A 41 H61 A 41 2.410 10.066 -11.404 537 H62 A 41 H62 A 41 2.506 9.672 -9.698 538 H2 A 41 H2 A 41 4.190 14.077 -11.955 539 H5' C 42 H5' C 42 1.698 15.208 -1.873 540 H5'' C 42 H5'' C 42 2.702 14.004 -2.707 541 H4' C 42 H4' C 42 1.422 14.231 -4.734 542 H3' C 42 H3' C 42 0.827 16.773 -4.174 543 H2' C 42 H2' C 42 -0.222 16.274 -2.055 544 HO2' C 42 HO2' C 42 -2.450 16.635 -2.342 545 H1' C 42 H1' C 42 -1.874 14.131 -3.422 546 H41 C 42 H41 C 42 -3.274 13.451 2.785 547 H42 C 42 H42 C 42 -1.578 13.205 3.164 548 H5 C 42 H5 C 42 0.192 13.403 1.504 549 H6 C 42 H6 C 42 0.650 13.849 -0.867 550 H5' A 43 H5' A 43 -2.269 14.941 -6.862 551 H5'' A 43 H5'' A 43 -2.227 14.894 -8.629 552 H4' A 43 H4' A 43 -4.138 16.177 -7.589 553 H3' A 43 H3' A 43 -3.002 16.819 -9.938 554 H2' A 43 H2' A 43 -1.109 17.974 -8.968 555 HO2' A 43 HO2' A 43 -1.493 20.206 -9.386 556 H1' A 43 H1' A 43 -3.016 19.568 -7.254 557 H8 A 43 H8 A 43 -1.241 17.956 -4.761 558 H61 A 43 H61 A 43 3.702 21.634 -5.506 559 H62 A 43 H62 A 43 2.899 20.509 -4.421 560 H2 A 43 H2 A 43 1.175 21.991 -9.128 561 H5' U 44 H5' U 44 -5.908 15.521 -6.948 562 H5'' U 44 H5'' U 44 -7.552 16.180 -6.946 563 H4' U 44 H4' U 44 -6.826 15.834 -4.654 564 H3' U 44 H3' U 44 -6.741 18.782 -5.381 565 HO3' U 44 HO3' U 44 -8.831 18.708 -4.432 566 H2' U 44 H2' U 44 -6.461 19.118 -3.018 567 HO2' U 44 HO2' U 44 -8.001 17.482 -2.356 568 H1' U 44 H1' U 44 -4.685 17.028 -2.759 569 H3 U 44 H3 U 44 -2.144 20.682 -2.003 570 H5 U 44 H5 U 44 -3.403 21.214 -5.975 571 H6 U 44 H6 U 44 -4.699 19.172 -5.783 572 H1 MET 1 H1 MET 1 0.020 -13.114 5.213 573 H2 MET 1 H2 MET 1 0.899 -11.737 5.048 574 H3 MET 1 H3 MET 1 0.971 -12.898 3.883 575 HA MET 1 HA MET 1 -0.376 -11.071 3.143 576 HB2 MET 1 HB2 MET 1 -0.905 -13.401 2.412 577 HB3 MET 1 HB3 MET 1 -2.005 -13.560 3.793 578 HG2 MET 1 HG2 MET 1 -3.313 -13.007 1.831 579 HG3 MET 1 HG3 MET 1 -3.331 -11.629 2.922 580 HE1 MET 1 HE1 MET 1 -3.586 -9.784 -0.391 581 HE2 MET 1 HE2 MET 1 -4.428 -11.204 0.304 582 HE3 MET 1 HE3 MET 1 -4.044 -9.811 1.334 583 H LEU 2 H LEU 2 -1.827 -9.435 3.646 584 HA LEU 2 HA LEU 2 -3.559 -9.804 6.025 585 HB2 LEU 2 HB2 LEU 2 -1.316 -7.912 5.668 586 HB3 LEU 2 HB3 LEU 2 -2.845 -7.102 6.051 587 HG LEU 2 HG LEU 2 -1.537 -9.302 7.672 588 HD11 LEU 2 HD11 LEU 2 -0.391 -7.124 7.765 589 HD12 LEU 2 HD12 LEU 2 -1.918 -6.327 8.198 590 HD13 LEU 2 HD13 LEU 2 -1.175 -7.515 9.311 591 HD21 LEU 2 HD21 LEU 2 -4.057 -7.642 8.202 592 HD22 LEU 2 HD22 LEU 2 -4.000 -9.408 7.947 593 HD23 LEU 2 HD23 LEU 2 -3.256 -8.700 9.383 594 H ILE 3 H ILE 3 -5.465 -8.621 5.959 595 HA ILE 3 HA ILE 3 -6.024 -6.980 3.556 596 HB ILE 3 HB ILE 3 -7.808 -9.234 4.598 597 HG12 ILE 3 HG12 ILE 3 -7.632 -9.803 2.044 598 HG13 ILE 3 HG13 ILE 3 -6.114 -8.887 2.105 599 HG21 ILE 3 HG21 ILE 3 -8.203 -7.173 2.385 600 HG22 ILE 3 HG22 ILE 3 -9.277 -8.545 2.726 601 HG23 ILE 3 HG23 ILE 3 -9.104 -7.248 3.925 602 HD11 ILE 3 HD11 ILE 3 -5.291 -10.467 3.883 603 HD12 ILE 3 HD12 ILE 3 -6.850 -11.318 3.798 604 HD13 ILE 3 HD13 ILE 3 -5.752 -11.298 2.396 605 H LEU 4 H LEU 4 -7.144 -5.154 4.108 606 HA LEU 4 HA LEU 4 -8.849 -5.004 6.421 607 HB2 LEU 4 HB2 LEU 4 -7.379 -3.139 7.494 608 HB3 LEU 4 HB3 LEU 4 -7.077 -4.841 7.818 609 HG LEU 4 HG LEU 4 -5.236 -4.763 6.028 610 HD11 LEU 4 HD11 LEU 4 -5.600 -1.789 6.531 611 HD12 LEU 4 HD12 LEU 4 -4.208 -2.547 5.727 612 HD13 LEU 4 HD13 LEU 4 -5.810 -2.617 4.959 613 HD21 LEU 4 HD21 LEU 4 -4.851 -4.871 8.452 614 HD22 LEU 4 HD22 LEU 4 -3.656 -3.820 7.650 615 HD23 LEU 4 HD23 LEU 4 -5.007 -3.105 8.563 616 H THR 5 H THR 5 -9.628 -2.652 6.721 617 HA THR 5 HA THR 5 -9.880 -1.549 3.953 618 HB THR 5 HB THR 5 -12.156 -1.595 5.956 619 HG1 THR 5 HG1 THR 5 -11.546 -3.733 5.589 620 HG21 THR 5 HG21 THR 5 -12.402 -0.088 4.053 621 HG22 THR 5 HG22 THR 5 -12.052 -1.438 2.933 622 HG23 THR 5 HG23 THR 5 -13.519 -1.465 3.927 623 H ARG 6 H ARG 6 -10.215 0.583 3.703 624 HA ARG 6 HA ARG 6 -9.960 2.464 5.995 625 HB2 ARG 6 HB2 ARG 6 -8.247 2.263 3.477 626 HB3 ARG 6 HB3 ARG 6 -8.297 3.712 4.484 627 HG2 ARG 6 HG2 ARG 6 -7.672 1.150 5.904 628 HG3 ARG 6 HG3 ARG 6 -6.462 1.750 4.755 629 HD2 ARG 6 HD2 ARG 6 -6.044 2.606 7.028 630 HD3 ARG 6 HD3 ARG 6 -6.379 3.910 5.879 631 HE ARG 6 HE ARG 6 -8.822 3.600 6.866 632 HH11 ARG 6 HH11 ARG 6 -5.720 3.619 8.568 633 HH12 ARG 6 HH12 ARG 6 -6.423 4.142 10.082 634 HH21 ARG 6 HH21 ARG 6 -9.693 4.335 8.817 635 HH22 ARG 6 HH22 ARG 6 -8.676 4.560 10.224 636 H LYS 7 H LYS 7 -10.382 4.775 5.070 637 HA LYS 7 HA LYS 7 -11.775 4.634 2.454 638 HB2 LYS 7 HB2 LYS 7 -13.387 6.323 3.143 639 HB3 LYS 7 HB3 LYS 7 -13.631 4.800 3.994 640 HG2 LYS 7 HG2 LYS 7 -12.871 5.697 6.039 641 HG3 LYS 7 HG3 LYS 7 -11.970 7.013 5.233 642 HD2 LYS 7 HD2 LYS 7 -14.039 8.069 4.503 643 HD3 LYS 7 HD3 LYS 7 -15.001 6.738 5.166 644 HE2 LYS 7 HE2 LYS 7 -14.996 8.757 6.586 645 HE3 LYS 7 HE3 LYS 7 -14.392 7.303 7.421 646 HZ1 LYS 7 HZ1 LYS 7 -13.042 9.268 7.836 647 HZ2 LYS 7 HZ2 LYS 7 -12.178 8.082 7.105 648 HZ3 LYS 7 HZ3 LYS 7 -12.679 9.386 6.236 649 H VAL 8 H VAL 8 -12.154 6.980 1.607 650 HA VAL 8 HA VAL 8 -9.547 7.829 1.012 651 HB VAL 8 HB VAL 8 -10.515 9.586 -0.259 652 HG11 VAL 8 HG11 VAL 8 -12.387 7.164 -0.269 653 HG12 VAL 8 HG12 VAL 8 -12.085 8.278 -1.616 654 HG13 VAL 8 HG13 VAL 8 -10.785 7.216 -1.029 655 HG21 VAL 8 HG21 VAL 8 -12.154 10.543 1.273 656 HG22 VAL 8 HG22 VAL 8 -12.889 10.091 -0.274 657 HG23 VAL 8 HG23 VAL 8 -13.146 9.065 1.173 658 H GLY 9 H GLY 9 -8.120 9.109 1.834 659 HA2 GLY 9 HA2 GLY 9 -7.391 11.094 2.920 660 HA3 GLY 9 HA3 GLY 9 -8.915 11.168 3.824 661 H GLU 10 H GLU 10 -7.817 7.958 3.847 662 HA GLU 10 HA GLU 10 -6.565 8.367 6.527 663 HB2 GLU 10 HB2 GLU 10 -8.062 5.965 5.415 664 HB3 GLU 10 HB3 GLU 10 -7.380 6.124 7.050 665 HG2 GLU 10 HG2 GLU 10 -8.839 8.044 7.508 666 HG3 GLU 10 HG3 GLU 10 -9.517 7.945 5.876 667 H SER 11 H SER 11 -5.252 6.104 7.046 668 HA SER 11 HA SER 11 -3.386 5.654 4.789 669 HB2 SER 11 HB2 SER 11 -2.615 6.896 7.456 670 HB3 SER 11 HB3 SER 11 -1.462 6.331 6.234 671 HG SER 11 HG SER 11 -2.259 7.869 4.819 672 H ILE 12 H ILE 12 -1.615 4.220 5.370 673 HA ILE 12 HA ILE 12 -2.051 2.217 7.506 674 HB ILE 12 HB ILE 12 -1.775 1.634 4.520 675 HG12 ILE 12 HG12 ILE 12 -4.089 2.243 5.155 676 HG13 ILE 12 HG13 ILE 12 -3.938 0.577 4.611 677 HG21 ILE 12 HG21 ILE 12 -1.807 -0.282 6.886 678 HG22 ILE 12 HG22 ILE 12 -2.048 -0.770 5.196 679 HG23 ILE 12 HG23 ILE 12 -0.513 -0.056 5.689 680 HD11 ILE 12 HD11 ILE 12 -4.154 1.483 7.505 681 HD12 ILE 12 HD12 ILE 12 -5.400 0.664 6.553 682 HD13 ILE 12 HD13 ILE 12 -3.918 -0.206 6.975 683 H ASN 13 H ASN 13 0.052 0.828 7.624 684 HA ASN 13 HA ASN 13 2.388 2.291 6.515 685 HB2 ASN 13 HB2 ASN 13 1.870 1.706 9.454 686 HB3 ASN 13 HB3 ASN 13 3.476 2.040 8.792 687 HD21 ASN 13 HD22 ASN 13 4.014 4.098 8.004 688 HD22 ASN 13 HD21 ASN 13 3.041 5.500 8.390 689 H ILE 14 H ILE 14 4.344 1.149 6.516 690 HA ILE 14 HA ILE 14 4.216 -1.771 6.997 691 HB ILE 14 HB ILE 14 5.151 -0.493 4.391 692 HG12 ILE 14 HG12 ILE 14 2.693 -2.198 5.007 693 HG13 ILE 14 HG13 ILE 14 2.697 -0.468 4.602 694 HG21 ILE 14 HG21 ILE 14 5.403 -2.844 3.628 695 HG22 ILE 14 HG22 ILE 14 6.450 -2.503 5.005 696 HG23 ILE 14 HG23 ILE 14 4.938 -3.415 5.243 697 HD11 ILE 14 HD11 ILE 14 3.497 -2.752 2.763 698 HD12 ILE 14 HD12 ILE 14 2.072 -1.707 2.644 699 HD13 ILE 14 HD13 ILE 14 3.691 -1.016 2.383 700 H GLY 15 H GLY 15 6.333 -2.699 7.271 701 HA2 GLY 15 HA2 GLY 15 8.434 -2.690 8.226 702 HA3 GLY 15 HA3 GLY 15 8.788 -1.369 7.107 703 H ASP 16 H ASP 16 9.953 -0.051 8.406 704 HA ASP 16 HA ASP 16 8.482 1.260 10.633 705 HB2 ASP 16 HB2 ASP 16 10.237 -0.382 11.411 706 HB3 ASP 16 HB3 ASP 16 11.445 0.593 10.564 707 H ASP 17 H ASP 17 9.289 1.619 7.599 708 HA ASP 17 HA ASP 17 10.065 4.460 7.822 709 HB2 ASP 17 HB2 ASP 17 11.552 2.408 6.130 710 HB3 ASP 17 HB3 ASP 17 11.815 4.153 6.089 711 H ILE 18 H ILE 18 7.730 2.468 6.765 712 HA ILE 18 HA ILE 18 7.428 3.988 4.219 713 HB ILE 18 HB ILE 18 6.626 1.087 4.664 714 HG12 ILE 18 HG12 ILE 18 8.329 0.927 2.615 715 HG13 ILE 18 HG13 ILE 18 9.046 2.352 3.375 716 HG21 ILE 18 HG21 ILE 18 6.461 2.917 2.243 717 HG22 ILE 18 HG22 ILE 18 6.148 1.165 2.220 718 HG23 ILE 18 HG23 ILE 18 5.101 2.227 3.161 719 HD11 ILE 18 HD11 ILE 18 9.311 1.057 5.494 720 HD12 ILE 18 HD12 ILE 18 8.489 -0.330 4.740 721 HD13 ILE 18 HD13 ILE 18 10.073 0.203 4.140 722 H THR 19 H THR 19 5.392 4.675 3.678 723 HA THR 19 HA THR 19 3.144 4.118 5.537 724 HB THR 19 HB THR 19 3.963 6.891 4.569 725 HG1 THR 19 HG1 THR 19 5.351 6.126 6.186 726 HG21 THR 19 HG21 THR 19 1.568 6.736 4.876 727 HG22 THR 19 HG22 THR 19 1.770 5.941 6.459 728 HG23 THR 19 HG23 THR 19 2.262 7.633 6.241 729 H ILE 20 H ILE 20 1.092 4.441 4.541 730 HA ILE 20 HA ILE 20 1.068 4.792 1.584 731 HB ILE 20 HB ILE 20 -0.353 2.646 3.220 732 HG12 ILE 20 HG12 ILE 20 2.065 2.168 2.870 733 HG13 ILE 20 HG13 ILE 20 0.987 1.000 2.104 734 HG21 ILE 20 HG21 ILE 20 -0.452 3.271 0.244 735 HG22 ILE 20 HG22 ILE 20 -1.097 1.786 0.995 736 HG23 ILE 20 HG23 ILE 20 -1.786 3.361 1.410 737 HD11 ILE 20 HD11 ILE 20 2.325 3.314 0.647 738 HD12 ILE 20 HD12 ILE 20 2.915 1.639 0.668 739 HD13 ILE 20 HD13 ILE 20 1.346 2.017 -0.084 740 H THR 21 H THR 21 -0.827 5.820 0.839 741 HA THR 21 HA THR 21 -2.877 6.543 2.871 742 HB THR 21 HB THR 21 -1.478 8.542 1.046 743 HG1 THR 21 HG1 THR 21 -0.639 9.314 3.033 744 HG21 THR 21 HG21 THR 21 -3.841 9.104 1.588 745 HG22 THR 21 HG22 THR 21 -3.470 8.947 3.323 746 HG23 THR 21 HG23 THR 21 -2.707 10.228 2.355 747 H ILE 22 H ILE 22 -4.899 6.914 2.018 748 HA ILE 22 HA ILE 22 -5.266 6.174 -0.843 749 HB ILE 22 HB ILE 22 -6.340 4.593 0.500 750 HG12 ILE 22 HG12 ILE 22 -8.703 4.831 0.099 751 HG13 ILE 22 HG13 ILE 22 -8.566 6.587 -0.064 752 HG21 ILE 22 HG21 ILE 22 -7.926 5.160 2.330 753 HG22 ILE 22 HG22 ILE 22 -6.256 5.613 2.679 754 HG23 ILE 22 HG23 ILE 22 -7.444 6.860 2.191 755 HD11 ILE 22 HD11 ILE 22 -7.243 4.585 -1.912 756 HD12 ILE 22 HD12 ILE 22 -8.764 5.469 -2.241 757 HD13 ILE 22 HD13 ILE 22 -7.241 6.363 -2.077 758 H LEU 23 H LEU 23 -5.036 8.093 -1.893 759 HA LEU 23 HA LEU 23 -5.827 10.589 -0.749 760 HB2 LEU 23 HB2 LEU 23 -5.359 10.008 -3.690 761 HB3 LEU 23 HB3 LEU 23 -5.212 11.559 -2.855 762 HG LEU 23 HG LEU 23 -3.387 9.142 -2.648 763 HD11 LEU 23 HD11 LEU 23 -1.706 10.771 -3.406 764 HD12 LEU 23 HD12 LEU 23 -3.071 10.715 -4.549 765 HD13 LEU 23 HD13 LEU 23 -2.927 12.060 -3.399 766 HD21 LEU 23 HD21 LEU 23 -2.021 10.484 -1.074 767 HD22 LEU 23 HD22 LEU 23 -3.342 11.674 -0.970 768 HD23 LEU 23 HD23 LEU 23 -3.592 10.022 -0.371 769 H GLY 24 H GLY 24 -7.546 8.264 -2.811 770 HA2 GLY 24 HA2 GLY 24 -10.072 8.986 -2.095 771 HA3 GLY 24 HA3 GLY 24 -9.749 10.147 -3.360 772 H VAL 25 H VAL 25 -11.740 8.875 -4.178 773 HA VAL 25 HA VAL 25 -10.756 6.718 -5.973 774 HB VAL 25 HB VAL 25 -12.661 5.351 -5.593 775 HG11 VAL 25 HG11 VAL 25 -10.827 5.144 -3.918 776 HG12 VAL 25 HG12 VAL 25 -11.716 6.258 -2.850 777 HG13 VAL 25 HG13 VAL 25 -12.420 4.687 -3.275 778 HG21 VAL 25 HG21 VAL 25 -14.397 7.029 -5.330 779 HG22 VAL 25 HG22 VAL 25 -14.433 5.918 -3.957 780 HG23 VAL 25 HG23 VAL 25 -13.718 7.539 -3.769 781 H SER 26 H SER 26 -12.201 6.332 -7.820 782 HA SER 26 HA SER 26 -14.184 8.403 -8.451 783 HB2 SER 26 HB2 SER 26 -12.080 9.423 -9.200 784 HB3 SER 26 HB3 SER 26 -11.692 7.975 -10.148 785 HG SER 26 HG SER 26 -13.514 8.366 -11.410 786 H GLY 27 H GLY 27 -15.691 6.676 -8.418 787 HA2 GLY 27 HA2 GLY 27 -16.953 5.062 -9.508 788 HA3 GLY 27 HA3 GLY 27 -15.800 5.114 -10.861 789 H GLN 28 H GLN 28 -14.100 3.620 -10.952 790 HA GLN 28 HA GLN 28 -13.953 1.669 -8.688 791 HB2 GLN 28 HB2 GLN 28 -13.222 1.268 -11.620 792 HB3 GLN 28 HB3 GLN 28 -13.042 0.080 -10.326 793 HG2 GLN 28 HG2 GLN 28 -15.595 1.156 -11.528 794 HG3 GLN 28 HG3 GLN 28 -14.980 -0.510 -11.512 795 HE21 GLN 28 HE22 GLN 28 -14.352 -1.025 -8.901 796 HE22 GLN 28 HE21 GLN 28 -15.737 -0.785 -7.850 797 H GLN 29 H GLN 29 -12.310 4.152 -10.470 798 HA GLN 29 HA GLN 29 -9.648 3.167 -10.016 799 HB2 GLN 29 HB2 GLN 29 -10.661 6.018 -10.443 800 HB3 GLN 29 HB3 GLN 29 -8.975 5.546 -10.431 801 HG2 GLN 29 HG2 GLN 29 -10.987 4.294 -12.346 802 HG3 GLN 29 HG3 GLN 29 -10.063 5.747 -12.732 803 HE21 GLN 29 HE22 GLN 29 -10.082 2.784 -13.720 804 HE22 GLN 29 HE21 GLN 29 -8.380 2.377 -13.738 805 H VAL 30 H VAL 30 -8.181 3.814 -8.435 806 HA VAL 30 HA VAL 30 -9.225 5.096 -5.965 807 HB VAL 30 HB VAL 30 -7.761 2.421 -6.135 808 HG11 VAL 30 HG11 VAL 30 -7.922 2.383 -3.716 809 HG12 VAL 30 HG12 VAL 30 -7.094 3.881 -4.187 810 HG13 VAL 30 HG13 VAL 30 -8.808 3.929 -3.713 811 HG21 VAL 30 HG21 VAL 30 -9.818 1.553 -5.014 812 HG22 VAL 30 HG22 VAL 30 -10.578 3.150 -5.235 813 HG23 VAL 30 HG23 VAL 30 -10.139 2.164 -6.647 814 H ARG 31 H ARG 31 -7.942 6.833 -5.799 815 HA ARG 31 HA ARG 31 -5.239 6.788 -6.954 816 HB2 ARG 31 HB2 ARG 31 -7.015 8.670 -7.152 817 HB3 ARG 31 HB3 ARG 31 -6.580 9.090 -5.484 818 HG2 ARG 31 HG2 ARG 31 -4.222 9.425 -6.188 819 HG3 ARG 31 HG3 ARG 31 -4.629 8.847 -7.821 820 HD2 ARG 31 HD2 ARG 31 -6.390 10.723 -7.855 821 HD3 ARG 31 HD3 ARG 31 -5.521 11.404 -6.464 822 HE ARG 31 HE ARG 31 -3.638 10.821 -8.507 823 HH11 ARG 31 HH11 ARG 31 -6.354 13.003 -7.916 824 HH12 ARG 31 HH12 ARG 31 -5.733 14.255 -8.974 825 HH21 ARG 31 HH21 ARG 31 -2.860 12.480 -9.900 826 HH22 ARG 31 HH22 ARG 31 -3.787 13.949 -10.094 827 H ILE 32 H ILE 32 -3.404 6.602 -5.797 828 HA ILE 32 HA ILE 32 -3.689 6.378 -2.838 829 HB ILE 32 HB ILE 32 -2.047 4.450 -4.482 830 HG12 ILE 32 HG12 ILE 32 -5.019 4.250 -3.886 831 HG13 ILE 32 HG13 ILE 32 -4.199 4.193 -5.457 832 HG21 ILE 32 HG21 ILE 32 -3.398 4.205 -1.759 833 HG22 ILE 32 HG22 ILE 32 -2.300 3.019 -2.505 834 HG23 ILE 32 HG23 ILE 32 -1.678 4.592 -2.023 835 HD11 ILE 32 HD11 ILE 32 -4.062 2.083 -3.276 836 HD12 ILE 32 HD12 ILE 32 -4.864 1.958 -4.848 837 HD13 ILE 32 HD13 ILE 32 -3.089 2.064 -4.773 838 H GLY 33 H GLY 33 -1.701 6.640 -1.674 839 HA2 GLY 33 HA2 GLY 33 0.554 7.796 -3.245 840 HA3 GLY 33 HA3 GLY 33 -0.033 8.567 -1.760 841 H ILE 34 H ILE 34 2.611 7.552 -2.233 842 HA ILE 34 HA ILE 34 2.822 5.497 -0.094 843 HB ILE 34 HB ILE 34 4.222 5.356 -2.801 844 HG12 ILE 34 HG12 ILE 34 1.996 3.582 -1.689 845 HG13 ILE 34 HG13 ILE 34 1.799 4.793 -2.965 846 HG21 ILE 34 HG21 ILE 34 4.245 3.487 -0.396 847 HG22 ILE 34 HG22 ILE 34 5.016 3.144 -1.959 848 HG23 ILE 34 HG23 ILE 34 5.593 4.492 -0.980 849 HD11 ILE 34 HD11 ILE 34 3.437 3.589 -4.374 850 HD12 ILE 34 HD12 ILE 34 3.523 2.296 -3.149 851 HD13 ILE 34 HD13 ILE 34 1.999 2.621 -3.985 852 H ASN 35 H ASN 35 4.695 5.675 1.107 853 HA ASN 35 HA ASN 35 6.559 7.858 0.351 854 HB2 ASN 35 HB2 ASN 35 4.622 8.699 1.743 855 HB3 ASN 35 HB3 ASN 35 5.168 7.662 3.054 856 HD21 ASN 35 HD22 ASN 35 4.945 10.629 2.855 857 HD22 ASN 35 HD21 ASN 35 6.542 11.257 3.201 858 H ALA 36 H ALA 36 8.373 6.743 0.182 859 HA ALA 36 HA ALA 36 9.418 5.298 2.542 860 HB1 ALA 36 HB1 ALA 36 8.326 3.544 1.178 861 HB2 ALA 36 HB2 ALA 36 9.220 4.103 -0.259 862 HB3 ALA 36 HB3 ALA 36 10.103 3.397 1.103 863 HA PRO 37 HA PRO 37 13.176 7.227 1.203 864 HB2 PRO 37 HB2 PRO 37 15.018 5.265 1.877 865 HB3 PRO 37 HB3 PRO 37 14.243 6.391 3.054 866 HG2 PRO 37 HG2 PRO 37 13.532 3.531 2.389 867 HG3 PRO 37 HG3 PRO 37 13.609 4.317 3.999 868 HD2 PRO 37 HD2 PRO 37 11.260 3.941 2.688 869 HD3 PRO 37 HD3 PRO 37 11.552 5.405 3.676 870 H LYS 38 H LYS 38 14.824 7.099 -0.457 871 HA LYS 38 HA LYS 38 14.087 5.468 -2.730 872 HB2 LYS 38 HB2 LYS 38 16.492 7.262 -2.166 873 HB3 LYS 38 HB3 LYS 38 16.140 6.537 -3.749 874 HG2 LYS 38 HG2 LYS 38 14.163 8.304 -2.240 875 HG3 LYS 38 HG3 LYS 38 15.320 8.935 -3.422 876 HD2 LYS 38 HD2 LYS 38 13.477 6.648 -4.184 877 HD3 LYS 38 HD3 LYS 38 12.879 8.309 -4.123 878 HE2 LYS 38 HE2 LYS 38 14.718 9.018 -5.636 879 HE3 LYS 38 HE3 LYS 38 15.286 7.338 -5.730 880 HZ1 LYS 38 HZ1 LYS 38 13.901 7.924 -7.591 881 HZ2 LYS 38 HZ2 LYS 38 13.168 6.759 -6.702 882 HZ3 LYS 38 HZ3 LYS 38 12.654 8.323 -6.592 883 H ASP 39 H ASP 39 15.660 4.758 0.053 884 HA ASP 39 HA ASP 39 17.692 2.898 -0.804 885 HB2 ASP 39 HB2 ASP 39 16.059 3.223 1.738 886 HB3 ASP 39 HB3 ASP 39 17.328 2.015 1.561 887 H VAL 40 H VAL 40 14.323 2.844 -1.121 888 HA VAL 40 HA VAL 40 14.339 -0.078 -1.634 889 HB VAL 40 HB VAL 40 12.134 -0.310 -0.618 890 HG11 VAL 40 HG11 VAL 40 14.030 1.078 1.330 891 HG12 VAL 40 HG12 VAL 40 12.724 -0.045 1.748 892 HG13 VAL 40 HG13 VAL 40 14.145 -0.631 0.841 893 HG21 VAL 40 HG21 VAL 40 11.377 2.051 -0.996 894 HG22 VAL 40 HG22 VAL 40 11.065 1.435 0.646 895 HG23 VAL 40 HG23 VAL 40 12.425 2.540 0.365 896 H ALA 41 H ALA 41 12.263 -0.625 -2.973 897 HA ALA 41 HA ALA 41 12.029 1.568 -4.977 898 HB1 ALA 41 HB1 ALA 41 13.329 -0.394 -5.749 899 HB2 ALA 41 HB2 ALA 41 11.951 -1.455 -5.377 900 HB3 ALA 41 HB3 ALA 41 11.807 -0.228 -6.649 901 H VAL 42 H VAL 42 10.031 1.722 -6.169 902 HA VAL 42 HA VAL 42 7.746 0.116 -5.343 903 HB VAL 42 HB VAL 42 7.495 1.572 -3.540 904 HG11 VAL 42 HG11 VAL 42 8.429 3.817 -5.355 905 HG12 VAL 42 HG12 VAL 42 7.720 4.074 -3.737 906 HG13 VAL 42 HG13 VAL 42 9.233 3.162 -3.915 907 HG21 VAL 42 HG21 VAL 42 5.439 1.498 -4.923 908 HG22 VAL 42 HG22 VAL 42 5.618 3.049 -4.058 909 HG23 VAL 42 HG23 VAL 42 5.970 2.962 -5.784 910 H HIS 43 H HIS 43 6.422 -0.148 -7.018 911 HA HIS 43 HA HIS 43 5.992 1.952 -9.009 912 HB2 HIS 43 HB2 HIS 43 6.870 -0.749 -10.062 913 HB3 HIS 43 HB3 HIS 43 6.808 0.787 -10.896 914 HD2 HIS 43 HD2 HIS 43 8.982 -1.251 -8.453 915 HE1 HIS 43 HE1 HIS 43 11.445 1.873 -9.969 916 HE2 HIS 43 HE2 HIS 43 11.407 -0.253 -8.561 917 H ARG 44 H ARG 44 4.349 1.058 -10.722 918 HA ARG 44 HA ARG 44 2.273 -0.385 -9.322 919 HB2 ARG 44 HB2 ARG 44 2.584 0.123 -12.314 920 HB3 ARG 44 HB3 ARG 44 1.106 -0.405 -11.475 921 HG2 ARG 44 HG2 ARG 44 1.315 1.741 -10.078 922 HG3 ARG 44 HG3 ARG 44 2.524 2.268 -11.260 923 HD2 ARG 44 HD2 ARG 44 -0.397 1.567 -11.749 924 HD3 ARG 44 HD3 ARG 44 0.335 3.168 -11.876 925 HE ARG 44 HE ARG 44 0.253 1.139 -13.904 926 HH11 ARG 44 HH11 ARG 44 2.380 3.689 -12.638 927 HH12 ARG 44 HH12 ARG 44 3.175 3.913 -14.179 928 HH21 ARG 44 HH21 ARG 44 1.317 1.491 -15.873 929 HH22 ARG 44 HH22 ARG 44 2.553 2.727 -15.992 930 H GLU 45 H GLU 45 1.457 -2.541 -9.914 931 HA GLU 45 HA GLU 45 3.609 -4.403 -10.049 932 HB2 GLU 45 HB2 GLU 45 1.472 -4.760 -8.861 933 HB3 GLU 45 HB3 GLU 45 0.603 -4.802 -10.403 934 HG2 GLU 45 HG2 GLU 45 1.083 -7.048 -9.377 935 HG3 GLU 45 HG3 GLU 45 1.662 -6.851 -11.037 936 H GLU 46 H GLU 46 2.124 -2.574 -12.467 937 HA GLU 46 HA GLU 46 2.475 -4.426 -14.693 938 HB2 GLU 46 HB2 GLU 46 0.812 -2.581 -14.677 939 HB3 GLU 46 HB3 GLU 46 2.121 -1.400 -14.501 940 HG2 GLU 46 HG2 GLU 46 3.020 -2.050 -16.708 941 HG3 GLU 46 HG3 GLU 46 1.783 -3.309 -16.847 942 H ILE 47 H ILE 47 4.204 -1.555 -13.368 943 HA ILE 47 HA ILE 47 6.374 -1.716 -15.286 944 HB ILE 47 HB ILE 47 5.755 -0.128 -12.785 945 HG12 ILE 47 HG12 ILE 47 6.002 1.772 -14.303 946 HG13 ILE 47 HG13 ILE 47 6.582 0.702 -15.590 947 HG21 ILE 47 HG21 ILE 47 7.913 1.072 -13.066 948 HG22 ILE 47 HG22 ILE 47 8.149 -0.602 -12.559 949 HG23 ILE 47 HG23 ILE 47 8.426 -0.138 -14.259 950 HD11 ILE 47 HD11 ILE 47 3.791 0.599 -14.381 951 HD12 ILE 47 HD12 ILE 47 4.227 1.421 -15.896 952 HD13 ILE 47 HD13 ILE 47 4.386 -0.342 -15.778 953 H TYR 48 H TYR 48 5.671 -3.128 -12.135 954 HA TYR 48 HA TYR 48 8.300 -3.694 -11.282 955 HB2 TYR 48 HB2 TYR 48 6.221 -3.842 -9.945 956 HB3 TYR 48 HB3 TYR 48 5.714 -5.251 -10.882 957 HD1 TYR 48 HD1 TYR 48 8.289 -3.982 -8.503 958 HD2 TYR 48 HD2 TYR 48 6.558 -7.442 -10.396 959 HE1 TYR 48 HE1 TYR 48 9.433 -5.426 -6.880 960 HE2 TYR 48 HE2 TYR 48 7.672 -8.901 -8.759 961 HH TYR 48 HH TYR 48 9.795 -7.606 -6.169 962 H GLN 49 H GLN 49 6.241 -5.301 -13.693 963 HA GLN 49 HA GLN 49 7.801 -7.735 -13.758 964 HB2 GLN 49 HB2 GLN 49 5.766 -6.539 -15.674 965 HB3 GLN 49 HB3 GLN 49 6.443 -8.172 -15.821 966 HG2 GLN 49 HG2 GLN 49 5.539 -8.782 -13.616 967 HG3 GLN 49 HG3 GLN 49 4.982 -7.128 -13.354 968 HE21 GLN 49 HE22 GLN 49 2.823 -7.122 -13.404 969 HE22 GLN 49 HE21 GLN 49 1.826 -7.900 -14.618 970 H ARG 50 H ARG 50 8.120 -4.567 -15.232 971 HA ARG 50 HA ARG 50 9.946 -5.423 -17.373 972 HB2 ARG 50 HB2 ARG 50 9.081 -2.757 -16.173 973 HB3 ARG 50 HB3 ARG 50 10.445 -2.859 -17.273 974 HG2 ARG 50 HG2 ARG 50 8.518 -2.271 -18.562 975 HG3 ARG 50 HG3 ARG 50 8.966 -3.931 -18.984 976 HD2 ARG 50 HD2 ARG 50 7.177 -4.798 -17.528 977 HD3 ARG 50 HD3 ARG 50 6.768 -3.139 -17.031 978 HE ARG 50 HE ARG 50 6.670 -3.229 -19.851 979 HH11 ARG 50 HH11 ARG 50 4.904 -4.613 -17.117 980 HH12 ARG 50 HH12 ARG 50 3.457 -4.895 -18.056 981 HH21 ARG 50 HH21 ARG 50 4.739 -3.512 -21.006 982 HH22 ARG 50 HH22 ARG 50 3.343 -4.221 -20.228 983 H ILE 51 H ILE 51 10.125 -4.946 -13.987 984 HA ILE 51 HA ILE 51 12.985 -4.205 -14.108 985 HB ILE 51 HB ILE 51 10.875 -4.141 -11.930 986 HG12 ILE 51 HG12 ILE 51 12.438 -1.930 -13.336 987 HG13 ILE 51 HG13 ILE 51 10.830 -2.467 -13.848 988 HG21 ILE 51 HG21 ILE 51 13.772 -3.226 -11.792 989 HG22 ILE 51 HG22 ILE 51 12.545 -3.058 -10.515 990 HG23 ILE 51 HG23 ILE 51 13.122 -4.664 -10.963 991 HD11 ILE 51 HD11 ILE 51 9.925 -1.908 -11.622 992 HD12 ILE 51 HD12 ILE 51 11.524 -1.259 -11.149 993 HD13 ILE 51 HD13 ILE 51 10.596 -0.506 -12.473 994 H GLN 52 H GLN 52 10.774 -6.643 -12.619 995 HA GLN 52 HA GLN 52 12.960 -8.160 -11.522 996 HB2 GLN 52 HB2 GLN 52 10.057 -8.892 -12.080 997 HB3 GLN 52 HB3 GLN 52 11.182 -9.897 -11.156 998 HG2 GLN 52 HG2 GLN 52 10.167 -7.130 -10.448 999 HG3 GLN 52 HG3 GLN 52 9.951 -8.651 -9.558 1000 HE21 GLN 52 HE22 GLN 52 11.622 -5.785 -9.559 1001 HE22 GLN 52 HE21 GLN 52 13.051 -6.269 -8.669 1002 H ALA 53 H ALA 53 12.350 -7.630 -14.702 1003 HA ALA 53 HA ALA 53 12.579 -10.252 -15.817 1004 HB1 ALA 53 HB1 ALA 53 13.389 -7.536 -16.925 1005 HB2 ALA 53 HB2 ALA 53 13.159 -9.016 -17.879 1006 HB3 ALA 53 HB3 ALA 53 11.769 -8.271 -17.061 1007 H GLY 54 H GLY 54 14.887 -8.248 -14.150 1008 HA2 GLY 54 HA2 GLY 54 16.868 -10.068 -13.865 1009 HA3 GLY 54 HA3 GLY 54 17.208 -9.452 -15.490 1010 H LEU 55 H LEU 55 15.836 -7.147 -13.196 1011 HA LEU 55 HA LEU 55 18.440 -6.065 -12.442 1012 HB2 LEU 55 HB2 LEU 55 18.027 -3.936 -13.768 1013 HB3 LEU 55 HB3 LEU 55 18.484 -5.373 -14.672 1014 HG LEU 55 HG LEU 55 15.978 -5.741 -15.142 1015 HD11 LEU 55 HD11 LEU 55 15.890 -2.814 -14.284 1016 HD12 LEU 55 HD12 LEU 55 14.615 -3.696 -15.152 1017 HD13 LEU 55 HD13 LEU 55 15.039 -4.160 -13.490 1018 HD21 LEU 55 HD21 LEU 55 17.621 -5.002 -16.780 1019 HD22 LEU 55 HD22 LEU 55 16.062 -4.190 -17.022 1020 HD23 LEU 55 HD23 LEU 55 17.416 -3.312 -16.251 1021 H THR 56 H THR 56 17.814 -3.496 -11.852 1022 HA THR 56 HA THR 56 15.295 -3.565 -10.269 1023 HB THR 56 HB THR 56 17.951 -2.645 -9.113 1024 HG1 THR 56 HG1 THR 56 17.922 -4.892 -9.421 1025 HG21 THR 56 HG21 THR 56 16.053 -1.575 -8.017 1026 HG22 THR 56 HG22 THR 56 15.186 -3.124 -7.924 1027 HG23 THR 56 HG23 THR 56 16.654 -2.866 -6.960 1028 H ALA 57 H ALA 57 17.336 -1.983 -12.455 1029 HA ALA 57 HA ALA 57 15.641 0.406 -12.350 1030 HB1 ALA 57 HB1 ALA 57 18.661 0.554 -11.998 1031 HB2 ALA 57 HB2 ALA 57 17.584 1.940 -12.259 1032 HB3 ALA 57 HB3 ALA 57 17.443 0.968 -10.775 1033 HA PRO 58 HA PRO 58 16.112 -0.653 -16.737 1034 HB2 PRO 58 HB2 PRO 58 14.946 2.140 -16.740 1035 HB3 PRO 58 HB3 PRO 58 14.549 0.779 -17.824 1036 HG2 PRO 58 HG2 PRO 58 12.926 1.324 -15.734 1037 HG3 PRO 58 HG3 PRO 58 13.424 -0.379 -16.008 1038 HD2 PRO 58 HD2 PRO 58 14.555 1.618 -14.035 1039 HD3 PRO 58 HD3 PRO 58 14.170 -0.115 -13.787 1040 H ASP 59 H ASP 59 17.059 2.470 -15.273 1041 HA ASP 59 HA ASP 59 19.629 2.504 -16.584 1042 HB2 ASP 59 HB2 ASP 59 18.172 3.064 -18.522 1043 HB3 ASP 59 HB3 ASP 59 17.433 4.360 -17.595 1044 H5' U 36 H5' U 36 -18.100 -3.281 8.004 1045 H5'' U 36 H5'' U 36 -17.520 -3.625 6.357 1046 H4' U 36 H4' U 36 -16.390 -4.929 8.870 1047 H3' U 36 H3' U 36 -16.021 -2.242 7.893 1048 H2' U 36 H2' U 36 -14.041 -2.298 6.706 1049 HO2' U 36 HO2' U 36 -12.859 -3.041 8.558 1050 H1' U 36 H1' U 36 -13.804 -4.893 5.923 1051 H3 U 36 H3 U 36 -16.423 -5.043 2.161 1052 H5 U 36 H5 U 36 -16.755 -1.125 3.637 1053 H6 U 36 H6 U 36 -15.631 -1.832 5.647 1054 HO5' U 36 HO5' U 36 -19.307 -4.932 6.977 1055 H5' C 37 H5' C 37 -13.211 -1.633 12.513 1056 H5'' C 37 H5'' C 37 -13.402 -3.061 11.508 1057 H4' C 37 H4' C 37 -14.496 -2.659 14.338 1058 H3' C 37 H3' C 37 -11.903 -3.058 13.760 1059 H2' C 37 H2' C 37 -12.201 -4.759 12.151 1060 HO2' C 37 HO2' C 37 -10.772 -5.635 13.711 1061 H1' C 37 H1' C 37 -14.055 -6.233 13.989 1062 H41 C 37 H41 C 37 -15.755 -9.128 8.580 1063 H42 C 37 H42 C 37 -15.055 -7.849 7.605 1064 H5 C 37 H5 C 37 -13.998 -5.857 8.583 1065 H6 C 37 H6 C 37 -13.453 -4.749 10.650 1066 H5' A 38 H5' A 38 -10.723 -6.042 15.905 1067 H5'' A 38 H5'' A 38 -9.593 -5.513 17.160 1068 H4' A 38 H4' A 38 -8.531 -6.897 15.372 1069 H3' A 38 H3' A 38 -7.325 -4.804 16.599 1070 H2' A 38 H2' A 38 -8.276 -3.124 15.170 1071 HO2' A 38 HO2' A 38 -5.740 -3.861 14.117 1072 H1' A 38 H1' A 38 -7.464 -4.790 12.788 1073 H8 A 38 H8 A 38 -9.652 -2.011 14.212 1074 H61 A 38 H61 A 38 -11.151 -0.944 8.276 1075 H62 A 38 H62 A 38 -11.282 -0.330 9.913 1076 H2 A 38 H2 A 38 -9.159 -4.904 8.517 1077 H5' G 39 H5' G 39 -7.636 -8.011 13.804 1078 H5'' G 39 H5'' G 39 -7.310 -9.400 14.859 1079 H4' G 39 H4' G 39 -7.467 -10.358 12.738 1080 H3' G 39 H3' G 39 -5.079 -10.706 13.928 1081 H2' G 39 H2' G 39 -4.008 -8.743 13.162 1082 HO2' G 39 HO2' G 39 -3.543 -10.711 11.184 1083 H1' G 39 H1' G 39 -4.996 -8.842 10.362 1084 H8 G 39 H8 G 39 -7.018 -6.312 11.255 1085 H1 G 39 H1 G 39 -1.111 -4.121 12.443 1086 H21 G 39 H21 G 39 0.308 -5.772 12.537 1087 H22 G 39 H22 G 39 -0.172 -7.440 12.293 1088 H5' G 40 H5' G 40 -4.403 -11.910 9.408 1089 H5'' G 40 H5'' G 40 -4.040 -13.638 9.474 1090 H4' G 40 H4' G 40 -2.707 -12.479 7.772 1091 H3' G 40 H3' G 40 -1.683 -14.324 9.660 1092 H2' G 40 H2' G 40 -0.555 -12.511 10.838 1093 HO2' G 40 HO2' G 40 1.150 -13.536 8.796 1094 H1' G 40 H1' G 40 -0.028 -11.443 8.047 1095 H8 G 40 H8 G 40 -0.861 -9.947 11.552 1096 H1 G 40 H1 G 40 4.685 -7.994 8.977 1097 H21 G 40 H21 G 40 5.035 -9.038 7.046 1098 H22 G 40 H22 G 40 3.883 -10.171 6.392 1099 H5' A 41 H5' A 41 -2.882 -15.198 5.152 1100 H5'' A 41 H5'' A 41 -3.153 -13.810 6.219 1101 H4' A 41 H4' A 41 -4.869 -16.318 6.364 1102 H3' A 41 H3' A 41 -4.930 -14.055 4.402 1103 H2' A 41 H2' A 41 -7.193 -13.572 4.781 1104 HO2' A 41 HO2' A 41 -7.877 -15.739 4.368 1105 H1' A 41 H1' A 41 -7.427 -14.567 7.416 1106 H8 A 41 H8 A 41 -5.442 -11.756 5.577 1107 H61 A 41 H61 A 41 -8.404 -8.013 9.571 1108 H62 A 41 H62 A 41 -7.369 -8.050 8.149 1109 H2 A 41 H2 A 41 -9.411 -12.187 10.597 1110 H5' C 42 H5' C 42 -6.267 -13.938 0.336 1111 H5'' C 42 H5'' C 42 -5.605 -13.178 1.792 1112 H4' C 42 H4' C 42 -7.795 -12.326 2.414 1113 H3' C 42 H3' C 42 -9.035 -14.382 1.257 1114 H2' C 42 H2' C 42 -8.071 -13.952 -0.939 1115 HO2' C 42 HO2' C 42 -9.908 -13.104 -2.166 1116 H1' C 42 H1' C 42 -9.073 -11.131 -0.513 1117 H41 C 42 H41 C 42 -6.299 -10.761 -6.290 1118 H42 C 42 H42 C 42 -4.732 -11.100 -5.578 1119 H5 C 42 H5 C 42 -4.443 -11.645 -3.211 1120 H6 C 42 H6 C 42 -5.618 -11.980 -1.107 1121 H5' A 43 H5' A 43 -10.892 -15.711 2.520 1122 H5'' A 43 H5'' A 43 -10.824 -14.908 0.938 1123 H4' A 43 H4' A 43 -13.484 -15.134 1.152 1124 H3' A 43 H3' A 43 -13.155 -16.860 3.123 1125 H2' A 43 H2' A 43 -11.094 -17.779 2.256 1126 HO2' A 43 HO2' A 43 -11.607 -19.934 1.600 1127 H1' A 43 H1' A 43 -12.277 -18.421 -0.410 1128 H8 A 43 H8 A 43 -10.063 -15.621 -0.859 1129 H61 A 43 H61 A 43 -5.224 -19.525 -0.974 1130 H62 A 43 H62 A 43 -5.752 -17.889 -1.327 1131 H2 A 43 H2 A 43 -8.706 -21.695 0.690 1132 H5' U 44 H5' U 44 -15.028 -13.933 1.004 1133 H5'' U 44 H5'' U 44 -16.582 -14.071 0.170 1134 H4' U 44 H4' U 44 -15.080 -12.660 -1.121 1135 H3' U 44 H3' U 44 -15.398 -15.399 -2.410 1136 HO3' U 44 HO3' U 44 -17.361 -14.256 -2.168 1137 H2' U 44 H2' U 44 -14.304 -14.375 -4.294 1138 HO2' U 44 HO2' U 44 -15.470 -12.339 -4.114 1139 H1' U 44 H1' U 44 -12.466 -13.021 -2.726 1140 H3 U 44 H3 U 44 -9.828 -16.036 -4.780 1141 H5 U 44 H5 U 44 -12.556 -18.451 -2.678 1142 H6 U 44 H6 U 44 -13.666 -16.444 -1.920 Start of MODEL 4 1 H1 MET 1 H1 MET 1 8.539 8.931 -2.248 2 H2 MET 1 H2 MET 1 8.463 10.079 -1.070 3 H3 MET 1 H3 MET 1 8.607 10.528 -2.646 4 HA MET 1 HA MET 1 6.295 9.159 -1.465 5 HB2 MET 1 HB2 MET 1 6.585 11.567 -0.807 6 HB3 MET 1 HB3 MET 1 6.559 11.992 -2.533 7 HG2 MET 1 HG2 MET 1 4.382 12.346 -1.475 8 HG3 MET 1 HG3 MET 1 4.297 11.146 -2.763 9 HE1 MET 1 HE1 MET 1 1.484 10.103 -0.332 10 HE2 MET 1 HE2 MET 1 2.051 11.766 -0.653 11 HE3 MET 1 HE3 MET 1 1.936 10.597 -1.982 12 H LEU 2 H LEU 2 4.754 8.397 -2.926 13 HA LEU 2 HA LEU 2 4.971 9.264 -5.741 14 HB2 LEU 2 HB2 LEU 2 5.498 6.563 -4.625 15 HB3 LEU 2 HB3 LEU 2 4.293 6.569 -5.925 16 HG LEU 2 HG LEU 2 7.098 7.704 -6.108 17 HD11 LEU 2 HD11 LEU 2 6.973 5.237 -5.970 18 HD12 LEU 2 HD12 LEU 2 5.842 5.210 -7.336 19 HD13 LEU 2 HD13 LEU 2 7.515 5.791 -7.569 20 HD21 LEU 2 HD21 LEU 2 4.885 7.360 -8.196 21 HD22 LEU 2 HD22 LEU 2 5.558 8.907 -7.627 22 HD23 LEU 2 HD23 LEU 2 6.575 7.793 -8.558 23 H ILE 3 H ILE 3 3.014 8.962 -6.910 24 HA ILE 3 HA ILE 3 0.616 8.222 -5.333 25 HB ILE 3 HB ILE 3 0.926 10.767 -6.991 26 HG12 ILE 3 HG12 ILE 3 -0.089 11.628 -4.680 27 HG13 ILE 3 HG13 ILE 3 0.694 10.177 -4.039 28 HG21 ILE 3 HG21 ILE 3 -1.510 9.574 -5.609 29 HG22 ILE 3 HG22 ILE 3 -1.423 11.180 -6.378 30 HG23 ILE 3 HG23 ILE 3 -1.276 9.721 -7.371 31 HD11 ILE 3 HD11 ILE 3 2.197 12.087 -3.845 32 HD12 ILE 3 HD12 ILE 3 2.855 10.996 -5.063 33 HD13 ILE 3 HD13 ILE 3 1.978 12.479 -5.564 34 H LEU 4 H LEU 4 -0.991 7.299 -6.581 35 HA LEU 4 HA LEU 4 -0.517 6.854 -9.473 36 HB2 LEU 4 HB2 LEU 4 -0.846 4.697 -7.342 37 HB3 LEU 4 HB3 LEU 4 -0.949 4.403 -9.076 38 HG LEU 4 HG LEU 4 1.536 5.418 -7.632 39 HD11 LEU 4 HD11 LEU 4 0.909 3.129 -7.003 40 HD12 LEU 4 HD12 LEU 4 0.709 2.687 -8.709 41 HD13 LEU 4 HD13 LEU 4 2.329 3.093 -8.074 42 HD21 LEU 4 HD21 LEU 4 1.471 6.115 -9.992 43 HD22 LEU 4 HD22 LEU 4 2.658 4.814 -9.776 44 HD23 LEU 4 HD23 LEU 4 1.071 4.450 -10.491 45 H THR 5 H THR 5 -2.438 5.778 -10.479 46 HA THR 5 HA THR 5 -4.863 5.870 -8.769 47 HB THR 5 HB THR 5 -5.334 6.670 -11.579 48 HG1 THR 5 HG1 THR 5 -3.558 7.968 -11.157 49 HG21 THR 5 HG21 THR 5 -6.236 7.871 -8.926 50 HG22 THR 5 HG22 THR 5 -7.017 8.012 -10.514 51 HG23 THR 5 HG23 THR 5 -7.011 6.451 -9.671 52 H ARG 6 H ARG 6 -5.044 3.785 -8.520 53 HA ARG 6 HA ARG 6 -4.904 1.920 -10.828 54 HB2 ARG 6 HB2 ARG 6 -3.507 1.785 -8.610 55 HB3 ARG 6 HB3 ARG 6 -5.030 1.394 -7.824 56 HG2 ARG 6 HG2 ARG 6 -3.944 -0.657 -8.184 57 HG3 ARG 6 HG3 ARG 6 -5.210 -0.596 -9.419 58 HD2 ARG 6 HD2 ARG 6 -2.334 0.296 -9.917 59 HD3 ARG 6 HD3 ARG 6 -2.853 -1.375 -10.139 60 HE ARG 6 HE ARG 6 -4.539 -0.510 -11.780 61 HH11 ARG 6 HH11 ARG 6 -1.623 1.386 -11.156 62 HH12 ARG 6 HH12 ARG 6 -1.640 2.134 -12.741 63 HH21 ARG 6 HH21 ARG 6 -4.527 0.439 -13.802 64 HH22 ARG 6 HH22 ARG 6 -3.289 1.590 -14.249 65 H LYS 7 H LYS 7 -6.696 0.164 -10.889 66 HA LYS 7 HA LYS 7 -9.081 1.087 -9.346 67 HB2 LYS 7 HB2 LYS 7 -10.574 0.264 -10.997 68 HB3 LYS 7 HB3 LYS 7 -9.549 1.488 -11.720 69 HG2 LYS 7 HG2 LYS 7 -8.278 -0.209 -12.907 70 HG3 LYS 7 HG3 LYS 7 -9.019 -1.509 -11.934 71 HD2 LYS 7 HD2 LYS 7 -11.269 -0.848 -12.840 72 HD3 LYS 7 HD3 LYS 7 -10.466 0.332 -13.890 73 HE2 LYS 7 HE2 LYS 7 -10.938 -1.719 -15.119 74 HE3 LYS 7 HE3 LYS 7 -9.185 -1.492 -14.951 75 HZ1 LYS 7 HZ1 LYS 7 -10.858 -3.264 -13.291 76 HZ2 LYS 7 HZ2 LYS 7 -9.850 -3.748 -14.497 77 HZ3 LYS 7 HZ3 LYS 7 -9.230 -3.064 -13.137 78 H VAL 8 H VAL 8 -10.775 -0.724 -9.170 79 HA VAL 8 HA VAL 8 -9.581 -2.535 -7.365 80 HB VAL 8 HB VAL 8 -11.723 -3.487 -7.057 81 HG11 VAL 8 HG11 VAL 8 -11.306 -1.172 -6.212 82 HG12 VAL 8 HG12 VAL 8 -12.009 -0.512 -7.704 83 HG13 VAL 8 HG13 VAL 8 -13.024 -1.445 -6.589 84 HG21 VAL 8 HG21 VAL 8 -12.511 -3.812 -9.348 85 HG22 VAL 8 HG22 VAL 8 -13.680 -2.893 -8.378 86 HG23 VAL 8 HG23 VAL 8 -12.648 -2.045 -9.563 87 H GLY 9 H GLY 9 -8.842 -4.524 -7.438 88 HA2 GLY 9 HA2 GLY 9 -8.754 -6.747 -8.262 89 HA3 GLY 9 HA3 GLY 9 -9.317 -6.196 -9.847 90 H GLU 10 H GLU 10 -7.033 -3.923 -9.033 91 HA GLU 10 HA GLU 10 -4.912 -5.451 -10.467 92 HB2 GLU 10 HB2 GLU 10 -5.374 -2.469 -10.181 93 HB3 GLU 10 HB3 GLU 10 -4.030 -3.230 -11.067 94 HG2 GLU 10 HG2 GLU 10 -5.675 -4.376 -12.532 95 HG3 GLU 10 HG3 GLU 10 -6.999 -3.558 -11.683 96 H SER 11 H SER 11 -2.626 -4.182 -9.880 97 HA SER 11 HA SER 11 -2.350 -4.276 -6.934 98 HB2 SER 11 HB2 SER 11 -1.012 -6.177 -8.873 99 HB3 SER 11 HB3 SER 11 -0.539 -5.981 -7.169 100 HG SER 11 HG SER 11 -2.034 -7.703 -7.542 101 H ILE 12 H ILE 12 0.067 -4.168 -6.398 102 HA ILE 12 HA ILE 12 1.642 -2.254 -7.938 103 HB ILE 12 HB ILE 12 0.469 -1.480 -5.222 104 HG12 ILE 12 HG12 ILE 12 -0.284 -0.437 -7.985 105 HG13 ILE 12 HG13 ILE 12 -1.302 -1.399 -6.898 106 HG21 ILE 12 HG21 ILE 12 2.096 0.192 -7.196 107 HG22 ILE 12 HG22 ILE 12 1.476 0.733 -5.627 108 HG23 ILE 12 HG23 ILE 12 2.724 -0.497 -5.681 109 HD11 ILE 12 HD11 ILE 12 -1.979 0.899 -6.744 110 HD12 ILE 12 HD12 ILE 12 -1.209 0.428 -5.211 111 HD13 ILE 12 HD13 ILE 12 -0.324 1.427 -6.390 112 H ASN 13 H ASN 13 3.765 -1.810 -6.561 113 HA ASN 13 HA ASN 13 4.278 -4.048 -4.685 114 HB2 ASN 13 HB2 ASN 13 5.972 -3.445 -7.138 115 HB3 ASN 13 HB3 ASN 13 6.304 -4.683 -5.931 116 HD21 ASN 13 HD22 ASN 13 4.988 -6.628 -5.890 117 HD22 ASN 13 HD21 ASN 13 3.934 -6.999 -7.248 118 H ILE 14 H ILE 14 6.158 -3.832 -3.419 119 HA ILE 14 HA ILE 14 7.556 -1.220 -3.446 120 HB ILE 14 HB ILE 14 6.323 -2.483 -0.957 121 HG12 ILE 14 HG12 ILE 14 5.517 0.017 -2.509 122 HG13 ILE 14 HG13 ILE 14 4.594 -1.490 -2.423 123 HG21 ILE 14 HG21 ILE 14 8.439 -1.286 -0.515 124 HG22 ILE 14 HG22 ILE 14 7.822 0.143 -1.377 125 HG23 ILE 14 HG23 ILE 14 7.071 -0.392 0.146 126 HD11 ILE 14 HD11 ILE 14 3.607 0.076 -0.898 127 HD12 ILE 14 HD12 ILE 14 4.393 -1.198 0.053 128 HD13 ILE 14 HD13 ILE 14 5.161 0.404 -0.109 129 H GLY 15 H GLY 15 9.663 -1.357 -2.444 130 HA2 GLY 15 HA2 GLY 15 11.689 -2.409 -2.149 131 HA3 GLY 15 HA3 GLY 15 10.786 -3.602 -1.208 132 H ASP 16 H ASP 16 11.789 -5.436 -1.906 133 HA ASP 16 HA ASP 16 11.201 -6.219 -4.716 134 HB2 ASP 16 HB2 ASP 16 13.625 -5.666 -4.374 135 HB3 ASP 16 HB3 ASP 16 13.698 -6.924 -3.133 136 H ASP 17 H ASP 17 10.154 -6.537 -1.757 137 HA ASP 17 HA ASP 17 9.589 -9.431 -1.960 138 HB2 ASP 17 HB2 ASP 17 10.692 -8.052 0.521 139 HB3 ASP 17 HB3 ASP 17 10.102 -9.717 0.447 140 H ILE 18 H ILE 18 8.194 -6.502 -1.999 141 HA ILE 18 HA ILE 18 5.949 -7.425 -0.272 142 HB ILE 18 HB ILE 18 6.871 -4.545 -0.605 143 HG12 ILE 18 HG12 ILE 18 7.034 -4.917 2.030 144 HG13 ILE 18 HG13 ILE 18 7.363 -6.589 1.556 145 HG21 ILE 18 HG21 ILE 18 4.630 -5.813 1.019 146 HG22 ILE 18 HG22 ILE 18 5.152 -4.120 1.161 147 HG23 ILE 18 HG23 ILE 18 4.453 -4.695 -0.351 148 HD11 ILE 18 HD11 ILE 18 9.257 -5.769 0.136 149 HD12 ILE 18 HD12 ILE 18 8.835 -4.098 0.576 150 HD13 ILE 18 HD13 ILE 18 9.432 -5.221 1.818 151 H THR 19 H THR 19 3.889 -7.037 -1.041 152 HA THR 19 HA THR 19 3.562 -5.752 -3.695 153 HB THR 19 HB THR 19 2.629 -8.553 -2.947 154 HG1 THR 19 HG1 THR 19 4.776 -8.446 -3.590 155 HG21 THR 19 HG21 THR 19 0.913 -7.466 -4.311 156 HG22 THR 19 HG22 THR 19 2.145 -6.890 -5.455 157 HG23 THR 19 HG23 THR 19 1.807 -8.631 -5.304 158 H ILE 20 H ILE 20 1.359 -5.109 -4.075 159 HA ILE 20 HA ILE 20 -0.400 -5.003 -1.677 160 HB ILE 20 HB ILE 20 0.422 -2.704 -3.500 161 HG12 ILE 20 HG12 ILE 20 2.166 -3.272 -1.852 162 HG13 ILE 20 HG13 ILE 20 1.477 -1.663 -1.618 163 HG21 ILE 20 HG21 ILE 20 -1.545 -2.788 -1.177 164 HG22 ILE 20 HG22 ILE 20 -0.941 -1.294 -1.933 165 HG23 ILE 20 HG23 ILE 20 -1.902 -2.438 -2.881 166 HD11 ILE 20 HD11 ILE 20 0.670 -4.119 -0.008 167 HD12 ILE 20 HD12 ILE 20 1.820 -2.873 0.523 168 HD13 ILE 20 HD13 ILE 20 0.114 -2.452 0.254 169 H THR 21 H THR 21 -2.623 -4.887 -2.224 170 HA THR 21 HA THR 21 -3.322 -4.916 -5.112 171 HB THR 21 HB THR 21 -4.263 -7.001 -3.106 172 HG1 THR 21 HG1 THR 21 -2.455 -7.217 -5.281 173 HG21 THR 21 HG21 THR 21 -5.182 -8.134 -5.102 174 HG22 THR 21 HG22 THR 21 -5.902 -6.526 -4.900 175 HG23 THR 21 HG23 THR 21 -4.644 -6.782 -6.124 176 H ILE 22 H ILE 22 -5.382 -4.156 -5.554 177 HA ILE 22 HA ILE 22 -6.832 -2.926 -3.264 178 HB ILE 22 HB ILE 22 -6.115 -1.247 -4.720 179 HG12 ILE 22 HG12 ILE 22 -8.097 -0.263 -5.659 180 HG13 ILE 22 HG13 ILE 22 -8.924 -1.829 -5.715 181 HG21 ILE 22 HG21 ILE 22 -7.079 -2.916 -7.069 182 HG22 ILE 22 HG22 ILE 22 -6.512 -1.236 -7.161 183 HG23 ILE 22 HG23 ILE 22 -5.391 -2.503 -6.644 184 HD11 ILE 22 HD11 ILE 22 -8.013 -0.440 -3.174 185 HD12 ILE 22 HD12 ILE 22 -9.682 -0.476 -3.813 186 HD13 ILE 22 HD13 ILE 22 -8.905 -1.984 -3.287 187 H LEU 23 H LEU 23 -8.151 -4.570 -2.554 188 HA LEU 23 HA LEU 23 -9.217 -6.538 -4.336 189 HB2 LEU 23 HB2 LEU 23 -10.285 -5.835 -1.584 190 HB3 LEU 23 HB3 LEU 23 -10.464 -7.349 -2.465 191 HG LEU 23 HG LEU 23 -8.032 -6.256 -1.043 192 HD11 LEU 23 HD11 LEU 23 -9.633 -8.848 -1.018 193 HD12 LEU 23 HD12 LEU 23 -8.168 -8.575 -0.044 194 HD13 LEU 23 HD13 LEU 23 -9.632 -7.597 0.235 195 HD21 LEU 23 HD21 LEU 23 -7.122 -7.036 -3.163 196 HD22 LEU 23 HD22 LEU 23 -6.775 -8.235 -1.903 197 HD23 LEU 23 HD23 LEU 23 -8.093 -8.528 -3.069 198 H GLY 24 H GLY 24 -10.481 -3.410 -3.180 199 HA2 GLY 24 HA2 GLY 24 -12.237 -2.946 -5.216 200 HA3 GLY 24 HA3 GLY 24 -13.188 -3.984 -4.178 201 H VAL 25 H VAL 25 -14.495 -1.849 -4.310 202 HA VAL 25 HA VAL 25 -13.749 -0.221 -1.927 203 HB VAL 25 HB VAL 25 -14.400 1.809 -2.952 204 HG11 VAL 25 HG11 VAL 25 -12.116 0.994 -3.541 205 HG12 VAL 25 HG12 VAL 25 -12.780 0.314 -5.045 206 HG13 VAL 25 HG13 VAL 25 -12.817 2.063 -4.777 207 HG21 VAL 25 HG21 VAL 25 -15.318 0.186 -5.350 208 HG22 VAL 25 HG22 VAL 25 -16.337 1.117 -4.219 209 HG23 VAL 25 HG23 VAL 25 -15.213 1.964 -5.285 210 H SER 26 H SER 26 -15.575 0.925 -0.960 211 HA SER 26 HA SER 26 -18.283 0.019 -1.615 212 HB2 SER 26 HB2 SER 26 -17.439 -1.769 -0.135 213 HB3 SER 26 HB3 SER 26 -16.992 -0.560 1.088 214 HG SER 26 HG SER 26 -19.169 -0.002 1.259 215 H GLY 27 H GLY 27 -18.683 2.232 -2.072 216 HA2 GLY 27 HA2 GLY 27 -19.504 4.315 -1.418 217 HA3 GLY 27 HA3 GLY 27 -19.233 3.859 0.278 218 H GLN 28 H GLN 28 -17.424 4.631 1.327 219 HA GLN 28 HA GLN 28 -15.321 5.933 -0.368 220 HB2 GLN 28 HB2 GLN 28 -16.018 6.457 2.558 221 HB3 GLN 28 HB3 GLN 28 -14.719 7.224 1.644 222 HG2 GLN 28 HG2 GLN 28 -17.664 7.462 0.951 223 HG3 GLN 28 HG3 GLN 28 -16.710 8.636 1.887 224 HE21 GLN 28 HE22 GLN 28 -16.921 7.074 -1.357 225 HE22 GLN 28 HE21 GLN 28 -16.128 8.383 -2.205 226 H GLN 29 H GLN 29 -16.090 3.346 1.845 227 HA GLN 29 HA GLN 29 -13.402 2.933 2.795 228 HB2 GLN 29 HB2 GLN 29 -15.786 1.029 2.557 229 HB3 GLN 29 HB3 GLN 29 -14.214 0.602 3.229 230 HG2 GLN 29 HG2 GLN 29 -15.706 1.115 5.021 231 HG3 GLN 29 HG3 GLN 29 -14.361 2.259 4.955 232 HE21 GLN 29 HE22 GLN 29 -15.151 4.113 5.772 233 HE22 GLN 29 HE21 GLN 29 -16.576 4.925 5.135 234 H VAL 30 H VAL 30 -11.889 1.445 2.073 235 HA VAL 30 HA VAL 30 -12.154 0.431 -0.706 236 HB VAL 30 HB VAL 30 -9.818 2.017 0.476 237 HG11 VAL 30 HG11 VAL 30 -10.247 0.948 -2.329 238 HG12 VAL 30 HG12 VAL 30 -8.836 1.851 -1.730 239 HG13 VAL 30 HG13 VAL 30 -9.163 0.209 -1.126 240 HG21 VAL 30 HG21 VAL 30 -10.387 3.660 -1.317 241 HG22 VAL 30 HG22 VAL 30 -11.844 2.712 -1.699 242 HG23 VAL 30 HG23 VAL 30 -11.689 3.506 -0.120 243 H ARG 31 H ARG 31 -11.875 -1.713 -0.550 244 HA ARG 31 HA ARG 31 -10.496 -2.910 1.749 245 HB2 ARG 31 HB2 ARG 31 -12.117 -3.827 -0.625 246 HB3 ARG 31 HB3 ARG 31 -11.036 -5.001 0.163 247 HG2 ARG 31 HG2 ARG 31 -12.862 -3.345 1.893 248 HG3 ARG 31 HG3 ARG 31 -13.523 -4.723 0.998 249 HD2 ARG 31 HD2 ARG 31 -11.731 -6.183 1.934 250 HD3 ARG 31 HD3 ARG 31 -11.158 -4.825 2.920 251 HE ARG 31 HE ARG 31 -13.907 -5.091 3.446 252 HH11 ARG 31 HH11 ARG 31 -10.987 -7.037 3.833 253 HH12 ARG 31 HH12 ARG 31 -11.596 -7.891 5.237 254 HH21 ARG 31 HH21 ARG 31 -14.678 -6.211 5.272 255 HH22 ARG 31 HH22 ARG 31 -13.691 -7.426 6.045 256 H ILE 32 H ILE 32 -8.419 -3.278 1.794 257 HA ILE 32 HA ILE 32 -6.905 -3.375 -0.784 258 HB ILE 32 HB ILE 32 -5.842 -2.132 1.773 259 HG12 ILE 32 HG12 ILE 32 -7.458 -0.822 -0.441 260 HG13 ILE 32 HG13 ILE 32 -7.764 -0.822 1.303 261 HG21 ILE 32 HG21 ILE 32 -5.072 -1.811 -1.155 262 HG22 ILE 32 HG22 ILE 32 -4.241 -1.084 0.242 263 HG23 ILE 32 HG23 ILE 32 -4.215 -2.832 0.028 264 HD11 ILE 32 HD11 ILE 32 -5.510 0.621 -0.128 265 HD12 ILE 32 HD12 ILE 32 -6.915 1.333 0.682 266 HD13 ILE 32 HD13 ILE 32 -5.673 0.499 1.645 267 H GLY 33 H GLY 33 -4.940 -4.620 -0.717 268 HA2 GLY 33 HA2 GLY 33 -4.738 -6.519 1.578 269 HA3 GLY 33 HA3 GLY 33 -4.685 -7.083 -0.096 270 H ILE 34 H ILE 34 -2.640 -7.405 1.883 271 HA ILE 34 HA ILE 34 -0.379 -5.955 0.616 272 HB ILE 34 HB ILE 34 -0.840 -6.221 3.620 273 HG12 ILE 34 HG12 ILE 34 -0.927 -3.694 1.916 274 HG13 ILE 34 HG13 ILE 34 -2.357 -4.519 2.567 275 HG21 ILE 34 HG21 ILE 34 1.186 -4.795 3.799 276 HG22 ILE 34 HG22 ILE 34 1.530 -6.320 2.971 277 HG23 ILE 34 HG23 ILE 34 1.354 -4.820 2.034 278 HD11 ILE 34 HD11 ILE 34 -1.482 -4.230 4.860 279 HD12 ILE 34 HD12 ILE 34 -0.154 -3.233 4.199 280 HD13 ILE 34 HD13 ILE 34 -1.843 -2.702 4.028 281 H ASN 35 H ASN 35 1.500 -7.171 0.569 282 HA ASN 35 HA ASN 35 1.401 -9.856 1.831 283 HB2 ASN 35 HB2 ASN 35 0.406 -9.876 -0.486 284 HB3 ASN 35 HB3 ASN 35 1.962 -9.369 -1.120 285 HD21 ASN 35 HD22 ASN 35 0.296 -11.879 -1.433 286 HD22 ASN 35 HD21 ASN 35 1.357 -13.201 -1.003 287 H ALA 36 H ALA 36 3.106 -9.711 3.128 288 HA ALA 36 HA ALA 36 5.770 -9.241 1.936 289 HB1 ALA 36 HB1 ALA 36 4.693 -7.733 4.358 290 HB2 ALA 36 HB2 ALA 36 6.366 -7.688 3.783 291 HB3 ALA 36 HB3 ALA 36 5.073 -7.006 2.776 292 HA PRO 37 HA PRO 37 6.890 -12.466 4.765 293 HB2 PRO 37 HB2 PRO 37 9.470 -11.675 5.408 294 HB3 PRO 37 HB3 PRO 37 9.007 -12.487 3.865 295 HG2 PRO 37 HG2 PRO 37 9.444 -9.554 4.445 296 HG3 PRO 37 HG3 PRO 37 9.991 -10.503 3.022 297 HD2 PRO 37 HD2 PRO 37 7.778 -8.921 2.942 298 HD3 PRO 37 HD3 PRO 37 7.828 -10.489 2.079 299 H LYS 38 H LYS 38 7.327 -12.877 7.025 300 HA LYS 38 HA LYS 38 6.445 -10.767 8.807 301 HB2 LYS 38 HB2 LYS 38 7.557 -13.575 9.287 302 HB3 LYS 38 HB3 LYS 38 6.940 -12.524 10.580 303 HG2 LYS 38 HG2 LYS 38 5.303 -13.296 8.128 304 HG3 LYS 38 HG3 LYS 38 5.261 -14.204 9.649 305 HD2 LYS 38 HD2 LYS 38 4.782 -11.204 9.654 306 HD3 LYS 38 HD3 LYS 38 3.513 -12.302 9.132 307 HE2 LYS 38 HE2 LYS 38 4.991 -12.527 11.796 308 HE3 LYS 38 HE3 LYS 38 3.452 -11.677 11.588 309 HZ1 LYS 38 HZ1 LYS 38 3.095 -13.902 12.344 310 HZ2 LYS 38 HZ2 LYS 38 2.474 -13.721 10.839 311 HZ3 LYS 38 HZ3 LYS 38 3.889 -14.538 11.052 312 H ASP 39 H ASP 39 9.282 -11.252 7.287 313 HA ASP 39 HA ASP 39 11.198 -10.421 9.287 314 HB2 ASP 39 HB2 ASP 39 11.133 -10.308 6.249 315 HB3 ASP 39 HB3 ASP 39 12.526 -9.788 7.211 316 H VAL 40 H VAL 40 8.565 -8.821 7.886 317 HA VAL 40 HA VAL 40 9.637 -6.192 8.722 318 HB VAL 40 HB VAL 40 8.688 -5.102 6.766 319 HG11 VAL 40 HG11 VAL 40 10.407 -7.461 5.879 320 HG12 VAL 40 HG12 VAL 40 10.208 -5.919 5.027 321 HG13 VAL 40 HG13 VAL 40 11.033 -5.960 6.602 322 HG21 VAL 40 HG21 VAL 40 6.846 -6.751 6.361 323 HG22 VAL 40 HG22 VAL 40 7.752 -6.312 4.897 324 HG23 VAL 40 HG23 VAL 40 8.070 -7.870 5.693 325 H ALA 41 H ALA 41 7.704 -4.584 8.850 326 HA ALA 41 HA ALA 41 5.513 -6.107 10.161 327 HB1 ALA 41 HB1 ALA 41 6.955 -4.749 11.653 328 HB2 ALA 41 HB2 ALA 41 6.561 -3.297 10.707 329 HB3 ALA 41 HB3 ALA 41 5.285 -4.135 11.617 330 H VAL 42 H VAL 42 3.367 -5.185 10.128 331 HA VAL 42 HA VAL 42 2.770 -2.921 8.421 332 HB VAL 42 HB VAL 42 2.835 -4.406 6.599 333 HG11 VAL 42 HG11 VAL 42 1.502 -6.480 8.377 334 HG12 VAL 42 HG12 VAL 42 1.733 -6.658 6.616 335 HG13 VAL 42 HG13 VAL 42 3.141 -6.516 7.677 336 HG21 VAL 42 HG21 VAL 42 0.707 -3.158 6.713 337 HG22 VAL 42 HG22 VAL 42 0.508 -4.744 5.926 338 HG23 VAL 42 HG23 VAL 42 -0.046 -4.513 7.589 339 H HIS 43 H HIS 43 1.089 -1.868 9.274 340 HA HIS 43 HA HIS 43 -1.071 -3.300 10.643 341 HB2 HIS 43 HB2 HIS 43 0.358 -1.124 12.193 342 HB3 HIS 43 HB3 HIS 43 -0.829 -2.290 12.752 343 HD2 HIS 43 HD2 HIS 43 2.920 -2.027 11.837 344 HE1 HIS 43 HE1 HIS 43 2.438 -5.593 14.103 345 HE2 HIS 43 HE2 HIS 43 4.126 -4.027 13.032 346 H ARG 44 H ARG 44 -2.713 -1.580 11.506 347 HA ARG 44 HA ARG 44 -3.283 0.289 9.390 348 HB2 ARG 44 HB2 ARG 44 -4.791 -1.018 11.196 349 HB3 ARG 44 HB3 ARG 44 -4.545 0.475 12.120 350 HG2 ARG 44 HG2 ARG 44 -5.454 1.772 10.179 351 HG3 ARG 44 HG3 ARG 44 -5.660 0.237 9.295 352 HD2 ARG 44 HD2 ARG 44 -7.092 -0.559 11.249 353 HD3 ARG 44 HD3 ARG 44 -7.063 1.115 11.836 354 HE ARG 44 HE ARG 44 -7.873 0.967 9.062 355 HH11 ARG 44 HH11 ARG 44 -9.034 0.551 12.384 356 HH12 ARG 44 HH12 ARG 44 -10.716 0.738 11.932 357 HH21 ARG 44 HH21 ARG 44 -10.086 1.212 8.527 358 HH22 ARG 44 HH22 ARG 44 -11.298 1.132 9.791 359 H GLU 45 H GLU 45 -3.432 2.718 9.787 360 HA GLU 45 HA GLU 45 -1.008 3.682 10.875 361 HB2 GLU 45 HB2 GLU 45 -2.464 4.751 9.133 362 HB3 GLU 45 HB3 GLU 45 -3.584 5.255 10.401 363 HG2 GLU 45 HG2 GLU 45 -0.633 6.015 10.287 364 HG3 GLU 45 HG3 GLU 45 -1.934 6.990 9.586 365 H GLU 46 H GLU 46 -4.063 2.920 12.370 366 HA GLU 46 HA GLU 46 -3.747 4.471 14.775 367 HB2 GLU 46 HB2 GLU 46 -5.896 3.565 13.923 368 HB3 GLU 46 HB3 GLU 46 -5.296 1.914 14.161 369 HG2 GLU 46 HG2 GLU 46 -5.116 2.301 16.584 370 HG3 GLU 46 HG3 GLU 46 -5.576 3.999 16.367 371 H ILE 47 H ILE 47 -3.092 1.012 13.945 372 HA ILE 47 HA ILE 47 -2.144 0.364 16.603 373 HB ILE 47 HB ILE 47 -2.106 -1.000 13.890 374 HG12 ILE 47 HG12 ILE 47 -3.500 -2.675 15.025 375 HG13 ILE 47 HG13 ILE 47 -3.369 -1.778 16.543 376 HG21 ILE 47 HG21 ILE 47 -0.032 -1.701 14.996 377 HG22 ILE 47 HG22 ILE 47 -0.927 -2.031 16.504 378 HG23 ILE 47 HG23 ILE 47 -1.207 -3.020 15.051 379 HD11 ILE 47 HD11 ILE 47 -4.666 -0.699 14.000 380 HD12 ILE 47 HD12 ILE 47 -5.552 -1.454 15.339 381 HD13 ILE 47 HD13 ILE 47 -4.684 0.060 15.620 382 H TYR 48 H TYR 48 -0.706 1.683 13.675 383 HA TYR 48 HA TYR 48 1.991 0.954 14.104 384 HB2 TYR 48 HB2 TYR 48 0.979 1.867 12.023 385 HB3 TYR 48 HB3 TYR 48 0.787 3.431 12.814 386 HD1 TYR 48 HD2 TYR 48 3.349 0.909 11.801 387 HD2 TYR 48 HD1 TYR 48 2.544 5.013 12.805 388 HE1 TYR 48 HE2 TYR 48 5.619 1.536 11.023 389 HE2 TYR 48 HE1 TYR 48 4.767 5.666 12.010 390 HH TYR 48 HH TYR 48 6.744 4.948 11.039 391 H GLN 49 H GLN 49 0.018 3.543 15.533 392 HA GLN 49 HA GLN 49 2.247 5.094 16.480 393 HB2 GLN 49 HB2 GLN 49 -0.692 4.977 17.261 394 HB3 GLN 49 HB3 GLN 49 0.446 6.184 17.894 395 HG2 GLN 49 HG2 GLN 49 0.847 7.083 15.678 396 HG3 GLN 49 HG3 GLN 49 -0.057 5.769 14.925 397 HE21 GLN 49 HE22 GLN 49 -1.474 7.294 13.901 398 HE22 GLN 49 HE21 GLN 49 -2.740 8.096 14.782 399 H ARG 50 H ARG 50 0.634 2.205 17.663 400 HA ARG 50 HA ARG 50 1.440 2.514 20.457 401 HB2 ARG 50 HB2 ARG 50 0.305 0.264 18.741 402 HB3 ARG 50 HB3 ARG 50 0.943 -0.048 20.351 403 HG2 ARG 50 HG2 ARG 50 -1.423 0.258 20.533 404 HG3 ARG 50 HG3 ARG 50 -0.620 1.647 21.294 405 HD2 ARG 50 HD2 ARG 50 -1.056 3.000 19.264 406 HD3 ARG 50 HD3 ARG 50 -1.828 1.595 18.499 407 HE ARG 50 HE ARG 50 -3.153 1.955 20.933 408 HH11 ARG 50 HH11 ARG 50 -2.677 3.852 17.985 409 HH12 ARG 50 HH12 ARG 50 -4.121 4.807 18.239 410 HH21 ARG 50 HH21 ARG 50 -5.039 3.171 21.203 411 HH22 ARG 50 HH22 ARG 50 -5.485 4.379 20.023 412 H ILE 51 H ILE 51 2.957 1.656 17.509 413 HA ILE 51 HA ILE 51 4.974 -0.058 18.841 414 HB ILE 51 HB ILE 51 4.276 0.475 15.930 415 HG12 ILE 51 HG12 ILE 51 3.863 -1.999 17.664 416 HG13 ILE 51 HG13 ILE 51 2.610 -0.786 17.375 417 HG21 ILE 51 HG21 ILE 51 6.201 -1.554 17.142 418 HG22 ILE 51 HG22 ILE 51 5.801 -1.366 15.411 419 HG23 ILE 51 HG23 ILE 51 6.686 -0.087 16.260 420 HD11 ILE 51 HD11 ILE 51 3.939 -2.495 15.253 421 HD12 ILE 51 HD12 ILE 51 2.277 -2.631 15.877 422 HD13 ILE 51 HD13 ILE 51 2.748 -1.196 14.946 423 H GLN 52 H GLN 52 4.672 2.892 16.770 424 HA GLN 52 HA GLN 52 7.518 3.371 16.853 425 HB2 GLN 52 HB2 GLN 52 5.190 5.177 16.054 426 HB3 GLN 52 HB3 GLN 52 6.899 5.550 15.784 427 HG2 GLN 52 HG2 GLN 52 5.288 3.281 14.574 428 HG3 GLN 52 HG3 GLN 52 6.086 4.628 13.751 429 HE21 GLN 52 HE22 GLN 52 6.335 1.370 14.389 430 HE22 GLN 52 HE21 GLN 52 8.066 1.173 14.213 431 H ALA 53 H ALA 53 5.398 3.504 19.350 432 HA ALA 53 HA ALA 53 5.984 5.991 20.594 433 HB1 ALA 53 HB1 ALA 53 4.156 4.476 21.269 434 HB2 ALA 53 HB2 ALA 53 5.353 3.269 21.801 435 HB3 ALA 53 HB3 ALA 53 5.233 4.835 22.639 436 H GLY 54 H GLY 54 8.027 3.231 19.984 437 HA2 GLY 54 HA2 GLY 54 10.411 4.267 20.557 438 HA3 GLY 54 HA3 GLY 54 9.863 3.892 22.201 439 H LEU 55 H LEU 55 8.842 1.738 19.568 440 HA LEU 55 HA LEU 55 10.913 -0.225 20.225 441 HB2 LEU 55 HB2 LEU 55 9.201 -1.807 21.209 442 HB3 LEU 55 HB3 LEU 55 9.619 -0.402 22.188 443 HG LEU 55 HG LEU 55 7.519 0.747 21.245 444 HD11 LEU 55 HD11 LEU 55 5.704 -0.799 20.585 445 HD12 LEU 55 HD12 LEU 55 7.003 -0.797 19.379 446 HD13 LEU 55 HD13 LEU 55 6.856 -2.147 20.540 447 HD21 LEU 55 HD21 LEU 55 7.767 -0.089 23.521 448 HD22 LEU 55 HD22 LEU 55 6.116 -0.368 22.924 449 HD23 LEU 55 HD23 LEU 55 7.271 -1.717 22.993 450 H THR 56 H THR 56 9.894 -2.521 19.436 451 HA THR 56 HA THR 56 8.303 -2.167 16.973 452 HB THR 56 HB THR 56 10.881 -3.778 16.896 453 HG1 THR 56 HG1 THR 56 10.465 -1.087 16.129 454 HG21 THR 56 HG21 THR 56 9.059 -2.568 14.767 455 HG22 THR 56 HG22 THR 56 10.612 -3.370 14.436 456 HG23 THR 56 HG23 THR 56 9.273 -4.299 15.123 457 H ALA 57 H ALA 57 8.643 -3.570 19.868 458 HA ALA 57 HA ALA 57 6.904 -5.808 19.105 459 HB1 ALA 57 HB1 ALA 57 9.494 -6.156 20.678 460 HB2 ALA 57 HB2 ALA 57 8.242 -7.401 20.455 461 HB3 ALA 57 HB3 ALA 57 9.156 -6.796 19.055 462 HA PRO 58 HA PRO 58 4.864 -3.976 22.673 463 HB2 PRO 58 HB2 PRO 58 3.601 -6.711 22.599 464 HB3 PRO 58 HB3 PRO 58 2.825 -5.112 22.853 465 HG2 PRO 58 HG2 PRO 58 2.715 -6.300 20.404 466 HG3 PRO 58 HG3 PRO 58 3.090 -4.550 20.529 467 HD2 PRO 58 HD2 PRO 58 5.003 -6.862 20.146 468 HD3 PRO 58 HD3 PRO 58 4.980 -5.267 19.324 469 H ASP 59 H ASP 59 4.232 -4.756 24.921 470 HA ASP 59 HA ASP 59 6.559 -5.276 26.391 471 HB2 ASP 59 HB2 ASP 59 4.415 -4.131 27.094 472 HB3 ASP 59 HB3 ASP 59 3.674 -5.724 27.240 473 H5' U 36 H5' U 36 -4.726 10.574 -17.603 474 H5'' U 36 H5'' U 36 -5.709 10.445 -16.128 475 H4' U 36 H4' U 36 -3.289 12.288 -16.413 476 H3' U 36 H3' U 36 -2.999 9.583 -16.418 477 H2' U 36 H2' U 36 -4.532 9.196 -14.614 478 HO2' U 36 HO2' U 36 -1.899 9.386 -13.543 479 H1' U 36 H1' U 36 -3.101 11.373 -13.081 480 H3 U 36 H3 U 36 -5.867 11.374 -9.552 481 H5 U 36 H5 U 36 -8.287 9.772 -12.591 482 H6 U 36 H6 U 36 -6.441 10.039 -14.131 483 HO5' U 36 HO5' U 36 -6.553 11.963 -17.633 484 H5' C 37 H5' C 37 -0.415 9.372 -18.941 485 H5'' C 37 H5'' C 37 -1.794 8.924 -17.911 486 H4' C 37 H4' C 37 0.826 7.410 -17.769 487 H3' C 37 H3' C 37 -0.491 7.545 -20.173 488 H2' C 37 H2' C 37 -2.617 6.960 -19.408 489 HO2' C 37 HO2' C 37 -2.031 5.349 -20.942 490 H1' C 37 H1' C 37 -1.542 4.800 -17.615 491 H41 C 37 H41 C 37 -7.268 5.463 -14.942 492 H42 C 37 H42 C 37 -7.476 7.071 -15.609 493 H5 C 37 H5 C 37 -5.748 8.177 -16.955 494 H6 C 37 H6 C 37 -3.528 7.928 -17.899 495 H5' A 38 H5' A 38 2.545 8.382 -18.361 496 H5'' A 38 H5'' A 38 4.090 7.866 -19.060 497 H4' A 38 H4' A 38 4.491 8.486 -16.768 498 H3' A 38 H3' A 38 5.337 6.057 -17.705 499 H2' A 38 H2' A 38 3.308 4.897 -17.097 500 HO2' A 38 HO2' A 38 5.279 4.672 -15.084 501 H1' A 38 H1' A 38 3.502 6.278 -14.402 502 H8 A 38 H8 A 38 1.420 4.240 -16.813 503 H61 A 38 H61 A 38 -3.180 4.692 -12.677 504 H62 A 38 H62 A 38 -2.658 3.967 -14.190 505 H2 A 38 H2 A 38 0.102 7.427 -11.409 506 H5' G 39 H5' G 39 5.167 9.155 -14.718 507 H5'' G 39 H5'' G 39 6.468 10.267 -15.157 508 H4' G 39 H4' G 39 5.798 11.072 -13.094 509 H3' G 39 H3' G 39 8.329 10.124 -13.109 510 H2' G 39 H2' G 39 7.864 7.898 -12.422 511 HO2' G 39 HO2' G 39 8.188 9.397 -10.035 512 H1' G 39 H1' G 39 5.877 8.692 -10.342 513 H8 G 39 H8 G 39 3.679 7.331 -12.550 514 H1 G 39 H1 G 39 7.441 2.471 -10.704 515 H21 G 39 H21 G 39 9.287 3.236 -9.836 516 H22 G 39 H22 G 39 9.617 4.952 -9.674 517 H5' G 40 H5' G 40 7.071 11.177 -8.601 518 H5'' G 40 H5'' G 40 8.176 12.502 -8.206 519 H4' G 40 H4' G 40 7.707 11.042 -6.274 520 H3' G 40 H3' G 40 10.266 11.987 -7.093 521 H2' G 40 H2' G 40 10.936 9.763 -7.726 522 HO2' G 40 HO2' G 40 11.455 10.083 -4.941 523 H1' G 40 H1' G 40 9.334 8.847 -5.316 524 H8 G 40 H8 G 40 9.853 7.568 -8.962 525 H1 G 40 H1 G 40 11.795 3.566 -4.337 526 H21 G 40 H21 G 40 11.542 4.537 -2.340 527 H22 G 40 H22 G 40 10.857 6.132 -2.176 528 H5' A 41 H5' A 41 7.364 13.930 -3.714 529 H5'' A 41 H5'' A 41 7.050 12.621 -4.874 530 H4' A 41 H4' A 41 6.813 15.595 -5.528 531 H3' A 41 H3' A 41 4.761 13.604 -4.541 532 H2' A 41 H2' A 41 3.232 14.242 -6.143 533 HO2' A 41 HO2' A 41 3.476 16.523 -5.678 534 H1' A 41 H1' A 41 4.997 14.975 -8.197 535 H8 A 41 H8 A 41 4.383 11.810 -6.011 536 H61 A 41 H61 A 41 2.540 9.274 -11.388 537 H62 A 41 H62 A 41 2.623 9.027 -9.655 538 H2 A 41 H2 A 41 4.076 13.339 -12.228 539 H5' C 42 H5' C 42 1.850 14.180 -1.400 540 H5'' C 42 H5'' C 42 3.059 13.421 -2.457 541 H4' C 42 H4' C 42 2.317 14.658 -4.351 542 H3' C 42 H3' C 42 1.434 16.602 -2.405 543 H2' C 42 H2' C 42 -0.847 16.485 -2.538 544 HO2' C 42 HO2' C 42 -0.777 17.275 -4.696 545 H1' C 42 H1' C 42 -1.436 14.115 -3.869 546 H41 C 42 H41 C 42 -2.548 13.663 2.489 547 H42 C 42 H42 C 42 -1.276 12.456 2.503 548 H5 C 42 H5 C 42 0.072 11.940 0.542 549 H6 C 42 H6 C 42 0.492 12.546 -1.800 550 H5' A 43 H5' A 43 -0.546 17.847 -6.938 551 H5'' A 43 H5'' A 43 0.539 16.501 -6.586 552 H4' A 43 H4' A 43 1.401 18.353 -8.768 553 H3' A 43 H3' A 43 -0.917 16.422 -8.989 554 H2' A 43 H2' A 43 -0.158 16.006 -11.269 555 HO2' A 43 HO2' A 43 0.623 18.137 -11.753 556 H1' A 43 H1' A 43 2.323 15.423 -10.456 557 H8 A 43 H8 A 43 0.197 14.505 -7.401 558 H61 A 43 H61 A 43 -1.444 9.440 -10.575 559 H62 A 43 H62 A 43 -1.498 10.238 -9.010 560 H2 A 43 H2 A 43 0.757 12.104 -13.334 561 H5' U 44 H5' U 44 -5.036 18.237 -9.338 562 H5'' U 44 H5'' U 44 -3.643 18.629 -8.310 563 H4' U 44 H4' U 44 -5.116 17.285 -7.021 564 H3' U 44 H3' U 44 -2.447 16.403 -7.687 565 HO3' U 44 HO3' U 44 -2.449 16.122 -5.475 566 H2' U 44 H2' U 44 -2.707 14.066 -7.724 567 HO2' U 44 HO2' U 44 -3.611 14.139 -5.547 568 H1' U 44 H1' U 44 -5.295 13.706 -8.414 569 H3 U 44 H3 U 44 -5.407 14.758 -12.972 570 H5 U 44 H5 U 44 -1.389 14.532 -11.768 571 H6 U 44 H6 U 44 -2.116 14.468 -9.481 572 H1 MET 1 H1 MET 1 0.050 -13.003 5.082 573 H2 MET 1 H2 MET 1 0.989 -11.665 4.915 574 H3 MET 1 H3 MET 1 0.983 -12.820 3.739 575 HA MET 1 HA MET 1 -0.294 -10.920 3.042 576 HB2 MET 1 HB2 MET 1 -0.947 -13.212 2.274 577 HB3 MET 1 HB3 MET 1 -2.014 -13.355 3.683 578 HG2 MET 1 HG2 MET 1 -3.351 -12.745 1.794 579 HG3 MET 1 HG3 MET 1 -3.287 -11.373 2.889 580 HE1 MET 1 HE1 MET 1 -4.173 -9.675 1.148 581 HE2 MET 1 HE2 MET 1 -3.687 -9.705 -0.563 582 HE3 MET 1 HE3 MET 1 -4.462 -11.135 0.192 583 H LEU 2 H LEU 2 -1.757 -9.280 3.558 584 HA LEU 2 HA LEU 2 -3.517 -9.705 5.893 585 HB2 LEU 2 HB2 LEU 2 -1.298 -7.755 5.661 586 HB3 LEU 2 HB3 LEU 2 -2.860 -7.015 6.062 587 HG LEU 2 HG LEU 2 -1.458 -9.216 7.604 588 HD11 LEU 2 HD11 LEU 2 -2.111 -6.323 8.320 589 HD12 LEU 2 HD12 LEU 2 -1.243 -7.510 9.329 590 HD13 LEU 2 HD13 LEU 2 -0.514 -6.919 7.818 591 HD21 LEU 2 HD21 LEU 2 -3.251 -8.806 9.293 592 HD22 LEU 2 HD22 LEU 2 -4.115 -7.793 8.112 593 HD23 LEU 2 HD23 LEU 2 -3.896 -9.539 7.818 594 H ILE 3 H ILE 3 -5.391 -8.348 5.862 595 HA ILE 3 HA ILE 3 -5.871 -6.838 3.358 596 HB ILE 3 HB ILE 3 -7.714 -8.951 4.565 597 HG12 ILE 3 HG12 ILE 3 -7.741 -9.518 1.991 598 HG13 ILE 3 HG13 ILE 3 -6.214 -8.630 1.942 599 HG21 ILE 3 HG21 ILE 3 -8.235 -6.921 2.354 600 HG22 ILE 3 HG22 ILE 3 -9.326 -8.235 2.842 601 HG23 ILE 3 HG23 ILE 3 -8.989 -6.907 3.973 602 HD11 ILE 3 HD11 ILE 3 -5.768 -10.985 2.187 603 HD12 ILE 3 HD12 ILE 3 -5.351 -10.229 3.735 604 HD13 ILE 3 HD13 ILE 3 -6.883 -11.114 3.570 605 H LEU 4 H LEU 4 -6.978 -5.001 3.658 606 HA LEU 4 HA LEU 4 -7.694 -4.211 6.450 607 HB2 LEU 4 HB2 LEU 4 -5.667 -3.149 4.512 608 HB3 LEU 4 HB3 LEU 4 -6.666 -1.948 5.310 609 HG LEU 4 HG LEU 4 -4.518 -2.302 6.435 610 HD11 LEU 4 HD11 LEU 4 -5.405 -2.371 8.683 611 HD12 LEU 4 HD12 LEU 4 -6.548 -1.495 7.627 612 HD13 LEU 4 HD13 LEU 4 -6.890 -3.169 8.128 613 HD21 LEU 4 HD21 LEU 4 -4.024 -4.278 7.705 614 HD22 LEU 4 HD22 LEU 4 -5.573 -5.020 7.266 615 HD23 LEU 4 HD23 LEU 4 -4.316 -4.763 6.024 616 H THR 5 H THR 5 -9.105 -2.337 6.523 617 HA THR 5 HA THR 5 -10.228 -1.523 3.895 618 HB THR 5 HB THR 5 -12.066 -1.656 6.273 619 HG1 THR 5 HG1 THR 5 -11.265 -3.768 5.970 620 HG21 THR 5 HG21 THR 5 -12.718 -0.374 4.336 621 HG22 THR 5 HG22 THR 5 -12.316 -1.730 3.253 622 HG23 THR 5 HG23 THR 5 -13.696 -1.861 4.384 623 H ARG 6 H ARG 6 -10.001 0.537 3.623 624 HA ARG 6 HA ARG 6 -9.732 2.447 5.909 625 HB2 ARG 6 HB2 ARG 6 -7.529 1.517 4.961 626 HB3 ARG 6 HB3 ARG 6 -8.014 2.175 3.403 627 HG2 ARG 6 HG2 ARG 6 -6.569 3.764 4.160 628 HG3 ARG 6 HG3 ARG 6 -8.126 4.466 4.638 629 HD2 ARG 6 HD2 ARG 6 -6.368 2.774 6.478 630 HD3 ARG 6 HD3 ARG 6 -6.233 4.534 6.350 631 HE ARG 6 HE ARG 6 -8.943 3.894 6.918 632 HH11 ARG 6 HH11 ARG 6 -5.751 3.866 8.427 633 HH12 ARG 6 HH12 ARG 6 -6.397 4.073 10.041 634 HH21 ARG 6 HH21 ARG 6 -9.745 4.168 9.006 635 HH22 ARG 6 HH22 ARG 6 -8.660 4.204 10.377 636 H LYS 7 H LYS 7 -10.470 4.674 5.252 637 HA LYS 7 HA LYS 7 -11.673 4.661 2.521 638 HB2 LYS 7 HB2 LYS 7 -13.300 6.268 3.231 639 HB3 LYS 7 HB3 LYS 7 -13.487 4.777 4.153 640 HG2 LYS 7 HG2 LYS 7 -12.605 5.780 6.126 641 HG3 LYS 7 HG3 LYS 7 -11.898 7.145 5.229 642 HD2 LYS 7 HD2 LYS 7 -14.892 6.614 5.372 643 HD3 LYS 7 HD3 LYS 7 -14.024 7.700 6.475 644 HE2 LYS 7 HE2 LYS 7 -13.206 9.021 4.547 645 HE3 LYS 7 HE3 LYS 7 -14.161 8.006 3.455 646 HZ1 LYS 7 HZ1 LYS 7 -16.133 8.712 4.647 647 HZ2 LYS 7 HZ2 LYS 7 -15.240 9.663 5.641 648 HZ3 LYS 7 HZ3 LYS 7 -15.327 10.009 4.036 649 H VAL 8 H VAL 8 -12.117 7.006 1.792 650 HA VAL 8 HA VAL 8 -9.497 7.824 1.099 651 HB VAL 8 HB VAL 8 -10.491 9.564 -0.192 652 HG11 VAL 8 HG11 VAL 8 -12.306 7.099 -0.171 653 HG12 VAL 8 HG12 VAL 8 -12.053 8.203 -1.532 654 HG13 VAL 8 HG13 VAL 8 -10.707 7.196 -0.940 655 HG21 VAL 8 HG21 VAL 8 -12.159 10.505 1.328 656 HG22 VAL 8 HG22 VAL 8 -12.874 10.032 -0.225 657 HG23 VAL 8 HG23 VAL 8 -13.125 9.006 1.213 658 H GLY 9 H GLY 9 -8.074 9.155 1.892 659 HA2 GLY 9 HA2 GLY 9 -7.415 11.221 2.889 660 HA3 GLY 9 HA3 GLY 9 -8.928 11.266 3.802 661 H GLU 10 H GLU 10 -7.805 8.099 3.989 662 HA GLU 10 HA GLU 10 -6.450 8.662 6.590 663 HB2 GLU 10 HB2 GLU 10 -7.975 6.209 5.671 664 HB3 GLU 10 HB3 GLU 10 -7.255 6.464 7.285 665 HG2 GLU 10 HG2 GLU 10 -8.778 8.389 7.634 666 HG3 GLU 10 HG3 GLU 10 -9.505 8.098 6.045 667 H SER 11 H SER 11 -5.158 6.380 7.167 668 HA SER 11 HA SER 11 -3.381 5.819 4.858 669 HB2 SER 11 HB2 SER 11 -2.455 6.949 7.528 670 HB3 SER 11 HB3 SER 11 -1.407 6.437 6.192 671 HG SER 11 HG SER 11 -1.795 8.689 6.178 672 H ILE 12 H ILE 12 -1.663 4.280 5.416 673 HA ILE 12 HA ILE 12 -2.159 2.354 7.606 674 HB ILE 12 HB ILE 12 -1.952 1.691 4.638 675 HG12 ILE 12 HG12 ILE 12 -4.224 2.357 5.360 676 HG13 ILE 12 HG13 ILE 12 -4.135 0.670 4.843 677 HG21 ILE 12 HG21 ILE 12 -2.239 -0.701 5.376 678 HG22 ILE 12 HG22 ILE 12 -0.678 -0.003 5.797 679 HG23 ILE 12 HG23 ILE 12 -1.932 -0.182 7.045 680 HD11 ILE 12 HD11 ILE 12 -4.155 1.604 7.743 681 HD12 ILE 12 HD12 ILE 12 -5.513 0.874 6.855 682 HD13 ILE 12 HD13 ILE 12 -4.068 -0.084 7.190 683 H ASN 13 H ASN 13 -0.090 0.836 7.703 684 HA ASN 13 HA ASN 13 2.295 2.327 6.727 685 HB2 ASN 13 HB2 ASN 13 1.601 1.658 9.601 686 HB3 ASN 13 HB3 ASN 13 3.249 2.010 9.066 687 HD21 ASN 13 HD22 ASN 13 3.801 4.111 8.305 688 HD22 ASN 13 HD21 ASN 13 2.786 5.490 8.661 689 H ILE 14 H ILE 14 4.248 1.199 6.763 690 HA ILE 14 HA ILE 14 4.180 -1.724 7.210 691 HB ILE 14 HB ILE 14 5.101 -0.384 4.633 692 HG12 ILE 14 HG12 ILE 14 2.717 -2.200 5.188 693 HG13 ILE 14 HG13 ILE 14 2.641 -0.476 4.773 694 HG21 ILE 14 HG21 ILE 14 4.988 -3.337 5.393 695 HG22 ILE 14 HG22 ILE 14 5.509 -2.678 3.827 696 HG23 ILE 14 HG23 ILE 14 6.469 -2.364 5.263 697 HD11 ILE 14 HD11 ILE 14 3.603 -2.722 2.967 698 HD12 ILE 14 HD12 ILE 14 2.130 -1.758 2.802 699 HD13 ILE 14 HD13 ILE 14 3.711 -0.982 2.573 700 H GLY 15 H GLY 15 6.263 -2.581 7.649 701 HA2 GLY 15 HA2 GLY 15 8.326 -2.513 8.680 702 HA3 GLY 15 HA3 GLY 15 8.732 -1.311 7.443 703 H ASP 16 H ASP 16 9.916 0.076 8.692 704 HA ASP 16 HA ASP 16 8.409 1.617 10.742 705 HB2 ASP 16 HB2 ASP 16 11.332 0.778 10.813 706 HB3 ASP 16 HB3 ASP 16 10.567 1.891 11.957 707 H ASP 17 H ASP 17 9.317 1.714 7.708 708 HA ASP 17 HA ASP 17 10.087 4.568 7.767 709 HB2 ASP 17 HB2 ASP 17 11.564 2.445 6.153 710 HB3 ASP 17 HB3 ASP 17 11.855 4.188 6.106 711 H ILE 18 H ILE 18 7.742 2.527 6.831 712 HA ILE 18 HA ILE 18 7.421 3.938 4.229 713 HB ILE 18 HB ILE 18 6.640 1.049 4.769 714 HG12 ILE 18 HG12 ILE 18 8.363 0.831 2.740 715 HG13 ILE 18 HG13 ILE 18 9.078 2.267 3.490 716 HG21 ILE 18 HG21 ILE 18 6.500 2.806 2.286 717 HG22 ILE 18 HG22 ILE 18 6.202 1.051 2.319 718 HG23 ILE 18 HG23 ILE 18 5.129 2.140 3.207 719 HD11 ILE 18 HD11 ILE 18 8.460 -0.378 4.897 720 HD12 ILE 18 HD12 ILE 18 10.067 0.134 4.329 721 HD13 ILE 18 HD13 ILE 18 9.268 1.022 5.641 722 H THR 19 H THR 19 5.357 4.571 3.695 723 HA THR 19 HA THR 19 3.129 3.997 5.564 724 HB THR 19 HB THR 19 3.950 6.786 4.641 725 HG1 THR 19 HG1 THR 19 5.286 5.945 6.269 726 HG21 THR 19 HG21 THR 19 2.220 7.511 6.296 727 HG22 THR 19 HG22 THR 19 1.535 6.653 4.910 728 HG23 THR 19 HG23 THR 19 1.718 5.811 6.466 729 H ILE 20 H ILE 20 1.050 4.388 4.566 730 HA ILE 20 HA ILE 20 1.048 4.674 1.599 731 HB ILE 20 HB ILE 20 -0.413 2.595 3.272 732 HG12 ILE 20 HG12 ILE 20 1.994 2.058 2.941 733 HG13 ILE 20 HG13 ILE 20 0.896 0.902 2.177 734 HG21 ILE 20 HG21 ILE 20 -0.479 3.168 0.284 735 HG22 ILE 20 HG22 ILE 20 -1.151 1.708 1.044 736 HG23 ILE 20 HG23 ILE 20 -1.822 3.299 1.440 737 HD11 ILE 20 HD11 ILE 20 2.280 3.173 0.693 738 HD12 ILE 20 HD12 ILE 20 2.847 1.493 0.738 739 HD13 ILE 20 HD13 ILE 20 1.289 1.873 -0.019 740 H THR 21 H THR 21 -0.835 5.689 0.818 741 HA THR 21 HA THR 21 -2.814 6.608 2.841 742 HB THR 21 HB THR 21 -1.520 8.468 0.812 743 HG1 THR 21 HG1 THR 21 0.031 7.824 2.330 744 HG21 THR 21 HG21 THR 21 -3.751 9.152 1.669 745 HG22 THR 21 HG22 THR 21 -3.166 8.963 3.336 746 HG23 THR 21 HG23 THR 21 -2.479 10.222 2.288 747 H ILE 22 H ILE 22 -4.827 7.173 1.953 748 HA ILE 22 HA ILE 22 -5.268 6.258 -0.850 749 HB ILE 22 HB ILE 22 -6.228 4.650 0.547 750 HG12 ILE 22 HG12 ILE 22 -8.591 4.733 0.204 751 HG13 ILE 22 HG13 ILE 22 -8.587 6.496 0.060 752 HG21 ILE 22 HG21 ILE 22 -6.115 5.718 2.698 753 HG22 ILE 22 HG22 ILE 22 -7.374 6.893 2.246 754 HG23 ILE 22 HG23 ILE 22 -7.778 5.169 2.422 755 HD11 ILE 22 HD11 ILE 22 -7.305 6.388 -2.002 756 HD12 ILE 22 HD12 ILE 22 -7.186 4.612 -1.869 757 HD13 ILE 22 HD13 ILE 22 -8.771 5.399 -2.129 758 H LEU 23 H LEU 23 -5.016 8.223 -1.841 759 HA LEU 23 HA LEU 23 -5.891 10.666 -0.680 760 HB2 LEU 23 HB2 LEU 23 -5.396 10.236 -3.634 761 HB3 LEU 23 HB3 LEU 23 -5.200 11.711 -2.689 762 HG LEU 23 HG LEU 23 -3.461 9.213 -2.620 763 HD11 LEU 23 HD11 LEU 23 -3.099 10.805 -4.491 764 HD12 LEU 23 HD12 LEU 23 -2.894 12.123 -3.323 765 HD13 LEU 23 HD13 LEU 23 -1.718 10.792 -3.364 766 HD21 LEU 23 HD21 LEU 23 -3.645 10.096 -0.319 767 HD22 LEU 23 HD22 LEU 23 -2.037 10.421 -1.009 768 HD23 LEU 23 HD23 LEU 23 -3.240 11.728 -0.919 769 H GLY 24 H GLY 24 -7.594 8.322 -2.716 770 HA2 GLY 24 HA2 GLY 24 -10.127 9.080 -2.040 771 HA3 GLY 24 HA3 GLY 24 -9.785 10.205 -3.324 772 H VAL 25 H VAL 25 -11.775 8.915 -4.141 773 HA VAL 25 HA VAL 25 -10.776 6.785 -5.947 774 HB VAL 25 HB VAL 25 -12.647 5.356 -5.541 775 HG11 VAL 25 HG11 VAL 25 -11.650 6.256 -2.814 776 HG12 VAL 25 HG12 VAL 25 -12.341 4.675 -3.226 777 HG13 VAL 25 HG13 VAL 25 -10.770 5.161 -3.910 778 HG21 VAL 25 HG21 VAL 25 -14.383 5.848 -3.857 779 HG22 VAL 25 HG22 VAL 25 -13.707 7.486 -3.654 780 HG23 VAL 25 HG23 VAL 25 -14.416 6.978 -5.213 781 H SER 26 H SER 26 -12.261 6.374 -7.760 782 HA SER 26 HA SER 26 -14.351 8.354 -8.282 783 HB2 SER 26 HB2 SER 26 -12.278 9.483 -9.064 784 HB3 SER 26 HB3 SER 26 -11.937 8.098 -10.128 785 HG SER 26 HG SER 26 -13.048 9.787 -11.202 786 H GLY 27 H GLY 27 -15.756 6.537 -8.239 787 HA2 GLY 27 HA2 GLY 27 -16.997 4.920 -9.348 788 HA3 GLY 27 HA3 GLY 27 -15.893 5.060 -10.736 789 H GLN 28 H GLN 28 -14.139 3.646 -10.911 790 HA GLN 28 HA GLN 28 -13.829 1.603 -8.737 791 HB2 GLN 28 HB2 GLN 28 -13.134 1.433 -11.699 792 HB3 GLN 28 HB3 GLN 28 -12.828 0.174 -10.488 793 HG2 GLN 28 HG2 GLN 28 -15.567 1.196 -11.308 794 HG3 GLN 28 HG3 GLN 28 -14.761 -0.282 -11.885 795 HE21 GLN 28 HE22 GLN 28 -15.837 1.310 -8.792 796 HE22 GLN 28 HE21 GLN 28 -16.233 -0.188 -7.987 797 H GLN 29 H GLN 29 -12.364 4.244 -10.474 798 HA GLN 29 HA GLN 29 -9.630 3.473 -10.040 799 HB2 GLN 29 HB2 GLN 29 -10.996 6.166 -10.411 800 HB3 GLN 29 HB3 GLN 29 -9.243 5.987 -10.243 801 HG2 GLN 29 HG2 GLN 29 -10.909 4.577 -12.373 802 HG3 GLN 29 HG3 GLN 29 -10.014 6.081 -12.635 803 HE21 GLN 29 HE22 GLN 29 -9.669 3.421 -13.917 804 HE22 GLN 29 HE21 GLN 29 -7.998 2.975 -13.624 805 H VAL 30 H VAL 30 -8.229 4.089 -8.425 806 HA VAL 30 HA VAL 30 -9.311 5.204 -5.909 807 HB VAL 30 HB VAL 30 -7.805 2.561 -6.186 808 HG11 VAL 30 HG11 VAL 30 -8.906 3.942 -3.706 809 HG12 VAL 30 HG12 VAL 30 -7.973 2.426 -3.772 810 HG13 VAL 30 HG13 VAL 30 -7.194 3.966 -4.183 811 HG21 VAL 30 HG21 VAL 30 -10.643 3.200 -5.273 812 HG22 VAL 30 HG22 VAL 30 -10.184 2.263 -6.717 813 HG23 VAL 30 HG23 VAL 30 -9.863 1.616 -5.101 814 H ARG 31 H ARG 31 -8.049 6.959 -5.735 815 HA ARG 31 HA ARG 31 -5.370 7.000 -6.911 816 HB2 ARG 31 HB2 ARG 31 -7.172 8.861 -6.907 817 HB3 ARG 31 HB3 ARG 31 -6.686 9.154 -5.224 818 HG2 ARG 31 HG2 ARG 31 -4.313 9.422 -6.039 819 HG3 ARG 31 HG3 ARG 31 -4.905 9.249 -7.708 820 HD2 ARG 31 HD2 ARG 31 -5.701 11.374 -5.701 821 HD3 ARG 31 HD3 ARG 31 -4.698 11.613 -7.157 822 HE ARG 31 HE ARG 31 -7.078 10.573 -8.118 823 HH11 ARG 31 HH11 ARG 31 -6.208 13.368 -6.125 824 HH12 ARG 31 HH12 ARG 31 -7.618 14.284 -6.597 825 HH21 ARG 31 HH21 ARG 31 -8.863 11.812 -8.756 826 HH22 ARG 31 HH22 ARG 31 -9.118 13.412 -8.094 827 H ILE 32 H ILE 32 -3.575 6.457 -5.791 828 HA ILE 32 HA ILE 32 -3.806 6.244 -2.821 829 HB ILE 32 HB ILE 32 -2.291 4.289 -4.581 830 HG12 ILE 32 HG12 ILE 32 -5.206 4.218 -3.736 831 HG13 ILE 32 HG13 ILE 32 -4.512 4.076 -5.358 832 HG21 ILE 32 HG21 ILE 32 -3.401 4.055 -1.754 833 HG22 ILE 32 HG22 ILE 32 -2.396 2.854 -2.597 834 HG23 ILE 32 HG23 ILE 32 -1.699 4.408 -2.151 835 HD11 ILE 32 HD11 ILE 32 -4.324 2.019 -3.130 836 HD12 ILE 32 HD12 ILE 32 -5.243 1.894 -4.640 837 HD13 ILE 32 HD13 ILE 32 -3.469 1.903 -4.689 838 H GLY 33 H GLY 33 -1.800 6.427 -1.676 839 HA2 GLY 33 HA2 GLY 33 0.434 7.611 -3.242 840 HA3 GLY 33 HA3 GLY 33 -0.133 8.360 -1.738 841 H ILE 34 H ILE 34 2.495 7.345 -2.273 842 HA ILE 34 HA ILE 34 2.746 5.241 -0.184 843 HB ILE 34 HB ILE 34 4.119 5.191 -2.903 844 HG12 ILE 34 HG12 ILE 34 1.962 3.287 -1.893 845 HG13 ILE 34 HG13 ILE 34 1.670 4.620 -3.031 846 HG21 ILE 34 HG21 ILE 34 4.133 3.218 -0.577 847 HG22 ILE 34 HG22 ILE 34 4.924 2.955 -2.144 848 HG23 ILE 34 HG23 ILE 34 5.481 4.258 -1.085 849 HD11 ILE 34 HD11 ILE 34 1.959 2.599 -4.304 850 HD12 ILE 34 HD12 ILE 34 3.361 3.664 -4.577 851 HD13 ILE 34 HD13 ILE 34 3.500 2.245 -3.506 852 H ASN 35 H ASN 35 4.589 5.481 1.060 853 HA ASN 35 HA ASN 35 6.428 7.678 0.289 854 HB2 ASN 35 HB2 ASN 35 4.503 8.525 1.663 855 HB3 ASN 35 HB3 ASN 35 5.011 7.458 2.970 856 HD21 ASN 35 HD22 ASN 35 4.819 10.252 3.263 857 HD22 ASN 35 HD21 ASN 35 6.426 10.923 3.465 858 H ALA 36 H ALA 36 8.255 6.558 0.102 859 HA ALA 36 HA ALA 36 9.338 5.224 2.500 860 HB1 ALA 36 HB1 ALA 36 8.301 3.391 1.190 861 HB2 ALA 36 HB2 ALA 36 9.180 3.937 -0.263 862 HB3 ALA 36 HB3 ALA 36 10.076 3.290 1.122 863 HA PRO 37 HA PRO 37 13.029 7.235 1.153 864 HB2 PRO 37 HB2 PRO 37 14.931 5.311 1.807 865 HB3 PRO 37 HB3 PRO 37 14.170 6.437 2.985 866 HG2 PRO 37 HG2 PRO 37 13.473 3.558 2.357 867 HG3 PRO 37 HG3 PRO 37 13.578 4.360 3.962 868 HD2 PRO 37 HD2 PRO 37 11.203 3.947 2.727 869 HD3 PRO 37 HD3 PRO 37 11.528 5.450 3.647 870 H LYS 38 H LYS 38 14.672 7.166 -0.515 871 HA LYS 38 HA LYS 38 14.069 5.446 -2.751 872 HB2 LYS 38 HB2 LYS 38 16.400 7.315 -2.142 873 HB3 LYS 38 HB3 LYS 38 16.192 6.479 -3.697 874 HG2 LYS 38 HG2 LYS 38 14.078 8.293 -2.467 875 HG3 LYS 38 HG3 LYS 38 15.291 8.869 -3.618 876 HD2 LYS 38 HD2 LYS 38 13.656 6.462 -4.417 877 HD3 LYS 38 HD3 LYS 38 12.847 8.022 -4.326 878 HE2 LYS 38 HE2 LYS 38 13.642 7.672 -6.574 879 HE3 LYS 38 HE3 LYS 38 14.541 9.009 -5.833 880 HZ1 LYS 38 HZ1 LYS 38 15.502 6.233 -6.116 881 HZ2 LYS 38 HZ2 LYS 38 15.979 7.509 -7.033 882 HZ3 LYS 38 HZ3 LYS 38 16.351 7.467 -5.433 883 H ASP 39 H ASP 39 15.440 4.787 0.118 884 HA ASP 39 HA ASP 39 17.557 2.969 -0.499 885 HB2 ASP 39 HB2 ASP 39 16.810 4.058 1.733 886 HB3 ASP 39 HB3 ASP 39 15.587 2.790 1.805 887 H VAL 40 H VAL 40 14.201 2.858 -1.142 888 HA VAL 40 HA VAL 40 14.308 -0.054 -1.710 889 HB VAL 40 HB VAL 40 12.115 -0.403 -0.771 890 HG11 VAL 40 HG11 VAL 40 13.784 1.152 1.260 891 HG12 VAL 40 HG12 VAL 40 12.553 -0.068 1.615 892 HG13 VAL 40 HG13 VAL 40 14.057 -0.549 0.791 893 HG21 VAL 40 HG21 VAL 40 11.166 1.843 -1.247 894 HG22 VAL 40 HG22 VAL 40 10.866 1.300 0.417 895 HG23 VAL 40 HG23 VAL 40 12.130 2.503 0.107 896 H ALA 41 H ALA 41 12.403 -0.663 -3.165 897 HA ALA 41 HA ALA 41 12.104 1.515 -5.172 898 HB1 ALA 41 HB1 ALA 41 11.820 -0.325 -6.787 899 HB2 ALA 41 HB2 ALA 41 13.344 -0.507 -5.892 900 HB3 ALA 41 HB3 ALA 41 11.935 -1.512 -5.477 901 H VAL 42 H VAL 42 10.061 1.622 -6.372 902 HA VAL 42 HA VAL 42 7.797 0.073 -5.414 903 HB VAL 42 HB VAL 42 7.570 1.609 -3.678 904 HG11 VAL 42 HG11 VAL 42 8.441 3.775 -5.611 905 HG12 VAL 42 HG12 VAL 42 7.774 4.092 -3.986 906 HG13 VAL 42 HG13 VAL 42 9.284 3.183 -4.160 907 HG21 VAL 42 HG21 VAL 42 5.485 1.456 -5.002 908 HG22 VAL 42 HG22 VAL 42 5.674 3.042 -4.205 909 HG23 VAL 42 HG23 VAL 42 5.988 2.881 -5.945 910 H HIS 43 H HIS 43 6.435 -0.282 -7.021 911 HA HIS 43 HA HIS 43 5.953 1.701 -9.114 912 HB2 HIS 43 HB2 HIS 43 6.752 -1.063 -10.040 913 HB3 HIS 43 HB3 HIS 43 6.671 0.441 -10.943 914 HD2 HIS 43 HD2 HIS 43 8.981 -1.503 -8.539 915 HE1 HIS 43 HE1 HIS 43 11.327 1.571 -10.309 916 HE2 HIS 43 HE2 HIS 43 11.386 -0.497 -8.824 917 H ARG 44 H ARG 44 4.205 0.647 -10.710 918 HA ARG 44 HA ARG 44 2.309 -0.811 -9.012 919 HB2 ARG 44 HB2 ARG 44 0.757 -0.609 -10.871 920 HB3 ARG 44 HB3 ARG 44 1.474 0.960 -10.464 921 HG2 ARG 44 HG2 ARG 44 3.029 0.770 -12.354 922 HG3 ARG 44 HG3 ARG 44 2.378 -0.845 -12.740 923 HD2 ARG 44 HD2 ARG 44 0.156 0.116 -13.128 924 HD3 ARG 44 HD3 ARG 44 0.751 1.730 -12.696 925 HE ARG 44 HE ARG 44 1.067 0.372 -15.239 926 HH11 ARG 44 HH11 ARG 44 2.575 2.714 -13.055 927 HH12 ARG 44 HH12 ARG 44 3.484 3.475 -14.342 928 HH21 ARG 44 HH21 ARG 44 2.235 1.381 -16.855 929 HH22 ARG 44 HH22 ARG 44 3.286 2.747 -16.496 930 H GLU 45 H GLU 45 1.197 -2.792 -10.017 931 HA GLU 45 HA GLU 45 3.198 -4.797 -10.229 932 HB2 GLU 45 HB2 GLU 45 1.004 -5.051 -9.157 933 HB3 GLU 45 HB3 GLU 45 0.195 -4.869 -10.719 934 HG2 GLU 45 HG2 GLU 45 0.278 -7.215 -10.012 935 HG3 GLU 45 HG3 GLU 45 1.171 -6.960 -11.497 936 H GLU 46 H GLU 46 2.014 -2.728 -12.690 937 HA GLU 46 HA GLU 46 2.459 -4.634 -14.859 938 HB2 GLU 46 HB2 GLU 46 0.971 -2.607 -15.024 939 HB3 GLU 46 HB3 GLU 46 2.403 -1.579 -14.850 940 HG2 GLU 46 HG2 GLU 46 3.344 -2.495 -16.926 941 HG3 GLU 46 HG3 GLU 46 1.991 -3.634 -17.057 942 H ILE 47 H ILE 47 4.332 -2.003 -13.257 943 HA ILE 47 HA ILE 47 6.503 -2.245 -15.200 944 HB ILE 47 HB ILE 47 6.355 -0.694 -12.590 945 HG12 ILE 47 HG12 ILE 47 4.498 0.089 -13.857 946 HG13 ILE 47 HG13 ILE 47 5.796 1.265 -14.097 947 HG21 ILE 47 HG21 ILE 47 8.039 0.764 -13.707 948 HG22 ILE 47 HG22 ILE 47 8.626 -0.887 -13.449 949 HG23 ILE 47 HG23 ILE 47 8.096 -0.378 -15.069 950 HD11 ILE 47 HD11 ILE 47 4.747 0.865 -16.228 951 HD12 ILE 47 HD12 ILE 47 6.338 0.078 -16.277 952 HD13 ILE 47 HD13 ILE 47 4.857 -0.894 -16.019 953 H TYR 48 H TYR 48 5.754 -3.442 -11.948 954 HA TYR 48 HA TYR 48 8.403 -4.074 -11.146 955 HB2 TYR 48 HB2 TYR 48 6.424 -3.956 -9.677 956 HB3 TYR 48 HB3 TYR 48 5.736 -5.366 -10.478 957 HD1 TYR 48 HD1 TYR 48 8.558 -4.218 -8.322 958 HD2 TYR 48 HD2 TYR 48 6.367 -7.576 -9.889 959 HE1 TYR 48 HE1 TYR 48 9.663 -5.707 -6.669 960 HE2 TYR 48 HE2 TYR 48 7.438 -9.059 -8.243 961 HH TYR 48 HH TYR 48 9.841 -7.849 -5.853 962 H GLN 49 H GLN 49 6.169 -5.648 -13.384 963 HA GLN 49 HA GLN 49 7.523 -8.211 -13.317 964 HB2 GLN 49 HB2 GLN 49 5.476 -7.007 -15.222 965 HB3 GLN 49 HB3 GLN 49 6.043 -8.693 -15.273 966 HG2 GLN 49 HG2 GLN 49 5.274 -9.035 -12.952 967 HG3 GLN 49 HG3 GLN 49 4.740 -7.362 -12.861 968 HE21 GLN 49 HE22 GLN 49 2.690 -8.503 -12.248 969 HE22 GLN 49 HE21 GLN 49 1.603 -8.998 -13.540 970 H ARG 50 H ARG 50 8.025 -5.186 -15.028 971 HA ARG 50 HA ARG 50 9.620 -6.305 -17.207 972 HB2 ARG 50 HB2 ARG 50 9.200 -3.539 -16.011 973 HB3 ARG 50 HB3 ARG 50 10.513 -3.843 -17.145 974 HG2 ARG 50 HG2 ARG 50 8.647 -2.995 -18.395 975 HG3 ARG 50 HG3 ARG 50 8.883 -4.696 -18.819 976 HD2 ARG 50 HD2 ARG 50 7.020 -5.345 -17.355 977 HD3 ARG 50 HD3 ARG 50 6.840 -3.659 -16.812 978 HE ARG 50 HE ARG 50 6.622 -3.477 -19.549 979 HH11 ARG 50 HH11 ARG 50 4.904 -5.358 -17.090 980 HH12 ARG 50 HH12 ARG 50 3.476 -5.550 -18.084 981 HH21 ARG 50 HH21 ARG 50 4.726 -3.684 -20.775 982 HH22 ARG 50 HH22 ARG 50 3.350 -4.540 -20.122 983 H ILE 51 H ILE 51 10.041 -5.785 -13.857 984 HA ILE 51 HA ILE 51 12.979 -5.498 -14.086 985 HB ILE 51 HB ILE 51 11.001 -5.145 -11.804 986 HG12 ILE 51 HG12 ILE 51 12.660 -3.105 -13.352 987 HG13 ILE 51 HG13 ILE 51 10.968 -3.479 -13.723 988 HG21 ILE 51 HG21 ILE 51 13.979 -4.550 -11.917 989 HG22 ILE 51 HG22 ILE 51 12.893 -4.189 -10.553 990 HG23 ILE 51 HG23 ILE 51 13.228 -5.877 -10.987 991 HD11 ILE 51 HD11 ILE 51 10.290 -2.820 -11.464 992 HD12 ILE 51 HD12 ILE 51 11.977 -2.359 -11.093 993 HD13 ILE 51 HD13 ILE 51 11.071 -1.496 -12.364 994 H GLN 52 H GLN 52 10.459 -7.523 -12.445 995 HA GLN 52 HA GLN 52 12.407 -9.351 -11.387 996 HB2 GLN 52 HB2 GLN 52 9.404 -9.635 -11.825 997 HB3 GLN 52 HB3 GLN 52 10.417 -10.773 -10.914 998 HG2 GLN 52 HG2 GLN 52 9.795 -7.885 -10.243 999 HG3 GLN 52 HG3 GLN 52 9.473 -9.352 -9.296 1000 HE21 GLN 52 HE22 GLN 52 11.533 -6.708 -9.674 1001 HE22 GLN 52 HE21 GLN 52 12.919 -7.315 -8.788 1002 H ALA 53 H ALA 53 11.738 -8.812 -14.569 1003 HA ALA 53 HA ALA 53 11.595 -11.460 -15.619 1004 HB1 ALA 53 HB1 ALA 53 12.380 -10.381 -17.699 1005 HB2 ALA 53 HB2 ALA 53 11.115 -9.413 -16.909 1006 HB3 ALA 53 HB3 ALA 53 12.820 -8.924 -16.781 1007 H GLY 54 H GLY 54 14.187 -9.757 -14.009 1008 HA2 GLY 54 HA2 GLY 54 15.823 -11.796 -13.488 1009 HA3 GLY 54 HA3 GLY 54 16.258 -11.512 -15.180 1010 H LEU 55 H LEU 55 15.378 -8.705 -13.175 1011 HA LEU 55 HA LEU 55 18.187 -8.027 -12.697 1012 HB2 LEU 55 HB2 LEU 55 18.056 -6.048 -14.285 1013 HB3 LEU 55 HB3 LEU 55 18.147 -7.640 -15.025 1014 HG LEU 55 HG LEU 55 15.581 -7.568 -15.248 1015 HD11 LEU 55 HD11 LEU 55 15.068 -5.698 -13.729 1016 HD12 LEU 55 HD12 LEU 55 16.107 -4.616 -14.692 1017 HD13 LEU 55 HD13 LEU 55 14.615 -5.290 -15.390 1018 HD21 LEU 55 HD21 LEU 55 17.309 -5.580 -16.744 1019 HD22 LEU 55 HD22 LEU 55 17.140 -7.320 -17.095 1020 HD23 LEU 55 HD23 LEU 55 15.746 -6.233 -17.295 1021 H THR 56 H THR 56 18.351 -5.595 -12.131 1022 HA THR 56 HA THR 56 15.909 -4.377 -11.047 1023 HB THR 56 HB THR 56 17.136 -3.900 -8.865 1024 HG1 THR 56 HG1 THR 56 18.746 -5.413 -8.338 1025 HG21 THR 56 HG21 THR 56 15.272 -5.538 -9.085 1026 HG22 THR 56 HG22 THR 56 16.478 -6.828 -9.345 1027 HG23 THR 56 HG23 THR 56 16.435 -5.942 -7.803 1028 H ALA 57 H ALA 57 18.437 -4.113 -12.999 1029 HA ALA 57 HA ALA 57 18.546 -1.188 -12.682 1030 HB1 ALA 57 HB1 ALA 57 21.031 -2.954 -12.686 1031 HB2 ALA 57 HB2 ALA 57 21.012 -1.181 -12.777 1032 HB3 ALA 57 HB3 ALA 57 20.427 -1.998 -11.311 1033 HA PRO 58 HA PRO 58 18.020 -1.764 -17.122 1034 HB2 PRO 58 HB2 PRO 58 19.022 1.074 -16.957 1035 HB3 PRO 58 HB3 PRO 58 17.697 0.404 -17.959 1036 HG2 PRO 58 HG2 PRO 58 17.119 1.729 -15.659 1037 HG3 PRO 58 HG3 PRO 58 16.278 0.182 -16.021 1038 HD2 PRO 58 HD2 PRO 58 18.642 0.652 -14.197 1039 HD3 PRO 58 HD3 PRO 58 17.181 -0.355 -13.925 1040 H ASP 59 H ASP 59 19.305 -1.171 -19.114 1041 HA ASP 59 HA ASP 59 21.808 -2.459 -19.077 1042 HB2 ASP 59 HB2 ASP 59 20.127 -2.139 -20.968 1043 HB3 ASP 59 HB3 ASP 59 20.753 -0.504 -21.146 1044 H5' U 36 H5' U 36 -14.090 -1.448 6.524 1045 H5'' U 36 H5'' U 36 -13.658 -2.316 8.010 1046 H4' U 36 H4' U 36 -13.615 -0.031 8.602 1047 H3' U 36 H3' U 36 -15.386 -1.718 9.899 1048 H2' U 36 H2' U 36 -17.280 -1.154 8.594 1049 HO2' U 36 HO2' U 36 -17.175 0.738 10.718 1050 H1' U 36 H1' U 36 -16.493 1.761 8.658 1051 H3 U 36 H3 U 36 -19.897 2.865 5.899 1052 H5 U 36 H5 U 36 -18.763 -0.935 4.505 1053 H6 U 36 H6 U 36 -17.101 -1.024 6.261 1054 HO5' U 36 HO5' U 36 -15.458 -3.249 6.953 1055 H5' C 37 H5' C 37 -15.816 -1.652 12.982 1056 H5'' C 37 H5'' C 37 -14.792 -0.596 13.924 1057 H4' C 37 H4' C 37 -14.298 -2.281 15.320 1058 H3' C 37 H3' C 37 -12.461 -2.969 13.491 1059 H2' C 37 H2' C 37 -13.977 -3.901 11.892 1060 HO2' C 37 HO2' C 37 -12.352 -5.477 12.395 1061 H1' C 37 H1' C 37 -15.334 -5.588 13.964 1062 H41 C 37 H41 C 37 -20.068 -5.444 9.734 1063 H42 C 37 H42 C 37 -19.398 -4.039 8.926 1064 H5 C 37 H5 C 37 -17.353 -2.888 9.730 1065 H6 C 37 H6 C 37 -15.625 -2.942 11.388 1066 H5' A 38 H5' A 38 -11.087 -6.413 15.065 1067 H5'' A 38 H5'' A 38 -10.178 -6.209 16.568 1068 H4' A 38 H4' A 38 -8.828 -7.429 14.986 1069 H3' A 38 H3' A 38 -7.778 -5.325 16.324 1070 H2' A 38 H2' A 38 -8.474 -3.648 14.769 1071 HO2' A 38 HO2' A 38 -6.600 -3.023 13.599 1072 H1' A 38 H1' A 38 -7.459 -5.300 12.472 1073 H8 A 38 H8 A 38 -9.997 -2.717 13.769 1074 H61 A 38 H61 A 38 -11.120 -1.593 7.779 1075 H62 A 38 H62 A 38 -11.509 -1.130 9.425 1076 H2 A 38 H2 A 38 -8.491 -5.171 8.040 1077 H5' G 39 H5' G 39 -7.754 -8.574 13.641 1078 H5'' G 39 H5'' G 39 -7.501 -10.005 14.654 1079 H4' G 39 H4' G 39 -7.397 -10.858 12.481 1080 H3' G 39 H3' G 39 -5.133 -11.175 13.897 1081 H2' G 39 H2' G 39 -4.091 -9.128 13.300 1082 HO2' G 39 HO2' G 39 -3.290 -11.013 11.341 1083 H1' G 39 H1' G 39 -4.795 -9.293 10.404 1084 H8 G 39 H8 G 39 -6.824 -6.738 10.911 1085 H1 G 39 H1 G 39 -1.154 -4.466 12.866 1086 H21 G 39 H21 G 39 0.241 -6.117 13.232 1087 H22 G 39 H22 G 39 -0.205 -7.794 12.983 1088 H5' G 40 H5' G 40 -4.227 -11.897 9.403 1089 H5'' G 40 H5'' G 40 -3.904 -13.630 9.275 1090 H4' G 40 H4' G 40 -2.551 -12.409 7.668 1091 H3' G 40 H3' G 40 -1.491 -14.280 9.533 1092 H2' G 40 H2' G 40 -0.347 -12.498 10.707 1093 HO2' G 40 HO2' G 40 1.327 -13.376 8.568 1094 H1' G 40 H1' G 40 0.080 -11.327 7.943 1095 H8 G 40 H8 G 40 -0.809 -9.870 11.435 1096 H1 G 40 H1 G 40 4.843 -7.966 9.059 1097 H21 G 40 H21 G 40 5.233 -8.998 7.116 1098 H22 G 40 H22 G 40 4.080 -10.112 6.427 1099 H5' A 41 H5' A 41 -2.918 -15.098 5.015 1100 H5'' A 41 H5'' A 41 -3.026 -13.637 6.009 1101 H4' A 41 H4' A 41 -4.955 -15.959 6.384 1102 H3' A 41 H3' A 41 -4.964 -13.757 4.330 1103 H2' A 41 H2' A 41 -7.210 -13.266 4.756 1104 HO2' A 41 HO2' A 41 -7.816 -15.527 4.460 1105 H1' A 41 H1' A 41 -7.300 -14.203 7.443 1106 H8 A 41 H8 A 41 -5.362 -11.394 5.554 1107 H61 A 41 H61 A 41 -8.562 -7.570 9.267 1108 H62 A 41 H62 A 41 -7.416 -7.650 7.944 1109 H2 A 41 H2 A 41 -9.666 -11.743 10.290 1110 H5' C 42 H5' C 42 -5.639 -13.294 0.737 1111 H5'' C 42 H5'' C 42 -5.943 -12.950 2.457 1112 H4' C 42 H4' C 42 -8.210 -12.687 2.190 1113 H3' C 42 H3' C 42 -7.899 -14.274 -0.375 1114 H2' C 42 H2' C 42 -9.670 -13.048 -1.362 1115 HO2' C 42 HO2' C 42 -11.018 -13.056 0.605 1116 H1' C 42 H1' C 42 -9.104 -10.629 -0.210 1117 H41 C 42 H41 C 42 -6.696 -11.022 -6.195 1118 H42 C 42 H42 C 42 -5.141 -11.482 -5.525 1119 H5 C 42 H5 C 42 -4.811 -11.904 -3.127 1120 H6 C 42 H6 C 42 -5.926 -11.951 -0.966 1121 H5' A 43 H5' A 43 -10.538 -13.056 2.555 1122 H5'' A 43 H5'' A 43 -11.148 -14.501 3.315 1123 H4' A 43 H4' A 43 -12.946 -13.348 4.090 1124 H3' A 43 H3' A 43 -13.391 -12.358 1.250 1125 H2' A 43 H2' A 43 -15.171 -11.054 2.277 1126 HO2' A 43 HO2' A 43 -15.839 -12.574 3.878 1127 H1' A 43 H1' A 43 -13.488 -10.125 4.199 1128 H8 A 43 H8 A 43 -11.116 -10.369 1.330 1129 H61 A 43 H61 A 43 -14.181 -5.741 -1.416 1130 H62 A 43 H62 A 43 -12.735 -6.737 -1.459 1131 H2 A 43 H2 A 43 -16.562 -7.057 2.092 1132 H5' U 44 H5' U 44 -15.555 -14.444 -1.770 1133 H5'' U 44 H5'' U 44 -14.053 -14.586 -0.848 1134 H4' U 44 H4' U 44 -13.627 -13.674 -3.058 1135 H3' U 44 H3' U 44 -12.600 -12.626 -0.728 1136 HO3' U 44 HO3' U 44 -11.151 -11.685 -2.458 1137 H2' U 44 H2' U 44 -13.535 -10.534 -0.595 1138 HO2' U 44 HO2' U 44 -11.632 -9.856 -1.606 1139 H1' U 44 H1' U 44 -14.365 -10.109 -3.317 1140 H3 U 44 H3 U 44 -18.510 -8.524 -2.374 1141 H5 U 44 H5 U 44 -17.124 -10.101 1.279 1142 H6 U 44 H6 U 44 -15.209 -10.919 0.153 Start of MODEL 5 1 H1 MET 1 H1 MET 1 8.612 9.305 -2.413 2 H2 MET 1 H2 MET 1 8.552 10.480 -1.257 3 H3 MET 1 H3 MET 1 8.611 10.893 -2.849 4 HA MET 1 HA MET 1 6.406 9.471 -1.536 5 HB2 MET 1 HB2 MET 1 6.554 11.868 -0.884 6 HB3 MET 1 HB3 MET 1 6.587 12.325 -2.595 7 HG2 MET 1 HG2 MET 1 4.341 12.628 -1.765 8 HG3 MET 1 HG3 MET 1 4.343 11.293 -2.903 9 HE1 MET 1 HE1 MET 1 1.519 10.252 -0.518 10 HE2 MET 1 HE2 MET 1 1.953 11.887 -1.091 11 HE3 MET 1 HE3 MET 1 2.060 10.495 -2.196 12 H LEU 2 H LEU 2 4.899 8.533 -2.907 13 HA LEU 2 HA LEU 2 5.020 9.282 -5.777 14 HB2 LEU 2 HB2 LEU 2 5.618 6.674 -4.515 15 HB3 LEU 2 HB3 LEU 2 4.373 6.578 -5.771 16 HG LEU 2 HG LEU 2 7.147 7.754 -6.110 17 HD11 LEU 2 HD11 LEU 2 5.910 5.171 -7.151 18 HD12 LEU 2 HD12 LEU 2 7.556 5.771 -7.485 19 HD13 LEU 2 HD13 LEU 2 7.089 5.308 -5.829 20 HD21 LEU 2 HD21 LEU 2 5.573 8.844 -7.660 21 HD22 LEU 2 HD22 LEU 2 6.558 7.667 -8.549 22 HD23 LEU 2 HD23 LEU 2 4.882 7.265 -8.107 23 H ILE 3 H ILE 3 3.051 8.978 -6.886 24 HA ILE 3 HA ILE 3 0.674 8.261 -5.249 25 HB ILE 3 HB ILE 3 0.988 10.759 -6.969 26 HG12 ILE 3 HG12 ILE 3 0.011 11.706 -4.716 27 HG13 ILE 3 HG13 ILE 3 0.680 10.237 -3.999 28 HG21 ILE 3 HG21 ILE 3 -1.474 9.661 -5.557 29 HG22 ILE 3 HG22 ILE 3 -1.342 11.240 -6.347 30 HG23 ILE 3 HG23 ILE 3 -1.235 9.764 -7.326 31 HD11 ILE 3 HD11 ILE 3 2.198 12.324 -5.618 32 HD12 ILE 3 HD12 ILE 3 2.227 12.161 -3.840 33 HD13 ILE 3 HD13 ILE 3 2.953 10.905 -4.854 34 H LEU 4 H LEU 4 -1.005 7.366 -6.464 35 HA LEU 4 HA LEU 4 -0.562 6.811 -9.338 36 HB2 LEU 4 HB2 LEU 4 -0.871 4.702 -7.153 37 HB3 LEU 4 HB3 LEU 4 -0.979 4.375 -8.887 38 HG LEU 4 HG LEU 4 1.509 5.460 -7.493 39 HD11 LEU 4 HD11 LEU 4 2.375 3.161 -7.863 40 HD12 LEU 4 HD12 LEU 4 0.990 3.201 -6.755 41 HD13 LEU 4 HD13 LEU 4 0.752 2.670 -8.435 42 HD21 LEU 4 HD21 LEU 4 1.040 4.356 -10.306 43 HD22 LEU 4 HD22 LEU 4 1.403 6.052 -9.904 44 HD23 LEU 4 HD23 LEU 4 2.620 4.792 -9.625 45 H THR 5 H THR 5 -2.525 5.746 -10.280 46 HA THR 5 HA THR 5 -4.934 6.007 -8.579 47 HB THR 5 HB THR 5 -5.103 6.972 -11.426 48 HG1 THR 5 HG1 THR 5 -3.510 8.278 -10.541 49 HG21 THR 5 HG21 THR 5 -6.515 7.736 -8.841 50 HG22 THR 5 HG22 THR 5 -6.983 8.219 -10.488 51 HG23 THR 5 HG23 THR 5 -7.118 6.515 -9.989 52 H ARG 6 H ARG 6 -4.937 3.804 -8.400 53 HA ARG 6 HA ARG 6 -4.961 2.101 -10.832 54 HB2 ARG 6 HB2 ARG 6 -3.492 1.928 -8.598 55 HB3 ARG 6 HB3 ARG 6 -4.956 1.234 -7.926 56 HG2 ARG 6 HG2 ARG 6 -3.549 -0.559 -8.587 57 HG3 ARG 6 HG3 ARG 6 -4.864 -0.503 -9.775 58 HD2 ARG 6 HD2 ARG 6 -2.208 0.898 -10.254 59 HD3 ARG 6 HD3 ARG 6 -2.426 -0.828 -10.613 60 HE ARG 6 HE ARG 6 -4.508 0.108 -11.931 61 HH11 ARG 6 HH11 ARG 6 -1.225 1.405 -11.860 62 HH12 ARG 6 HH12 ARG 6 -1.330 2.073 -13.480 63 HH21 ARG 6 HH21 ARG 6 -4.629 0.988 -14.007 64 HH22 ARG 6 HH22 ARG 6 -3.276 1.859 -14.684 65 H LYS 7 H LYS 7 -6.715 0.279 -10.856 66 HA LYS 7 HA LYS 7 -9.064 1.145 -9.233 67 HB2 LYS 7 HB2 LYS 7 -10.576 0.316 -10.911 68 HB3 LYS 7 HB3 LYS 7 -9.645 1.672 -11.495 69 HG2 LYS 7 HG2 LYS 7 -8.339 0.278 -12.937 70 HG3 LYS 7 HG3 LYS 7 -8.819 -1.202 -12.060 71 HD2 LYS 7 HD2 LYS 7 -11.125 -0.969 -12.792 72 HD3 LYS 7 HD3 LYS 7 -10.787 0.604 -13.527 73 HE2 LYS 7 HE2 LYS 7 -10.954 -1.218 -15.170 74 HE3 LYS 7 HE3 LYS 7 -9.379 -0.388 -15.203 75 HZ1 LYS 7 HZ1 LYS 7 -9.889 -2.941 -13.831 76 HZ2 LYS 7 HZ2 LYS 7 -9.203 -2.806 -15.321 77 HZ3 LYS 7 HZ3 LYS 7 -8.429 -2.190 -14.024 78 H VAL 8 H VAL 8 -10.778 -0.678 -9.186 79 HA VAL 8 HA VAL 8 -9.630 -2.571 -7.431 80 HB VAL 8 HB VAL 8 -11.815 -3.478 -7.201 81 HG11 VAL 8 HG11 VAL 8 -12.014 -0.478 -7.754 82 HG12 VAL 8 HG12 VAL 8 -13.068 -1.423 -6.691 83 HG13 VAL 8 HG13 VAL 8 -11.348 -1.197 -6.273 84 HG21 VAL 8 HG21 VAL 8 -12.554 -3.699 -9.520 85 HG22 VAL 8 HG22 VAL 8 -13.712 -2.762 -8.550 86 HG23 VAL 8 HG23 VAL 8 -12.621 -1.933 -9.697 87 H GLY 9 H GLY 9 -8.916 -4.545 -7.551 88 HA2 GLY 9 HA2 GLY 9 -8.805 -6.744 -8.417 89 HA3 GLY 9 HA3 GLY 9 -9.388 -6.164 -9.989 90 H GLU 10 H GLU 10 -7.104 -3.929 -9.035 91 HA GLU 10 HA GLU 10 -4.985 -5.302 -10.622 92 HB2 GLU 10 HB2 GLU 10 -5.530 -2.374 -10.064 93 HB3 GLU 10 HB3 GLU 10 -4.193 -3.004 -11.068 94 HG2 GLU 10 HG2 GLU 10 -5.805 -4.032 -12.606 95 HG3 GLU 10 HG3 GLU 10 -7.161 -3.490 -11.600 96 H SER 11 H SER 11 -2.706 -4.072 -9.947 97 HA SER 11 HA SER 11 -2.446 -4.275 -6.997 98 HB2 SER 11 HB2 SER 11 -0.968 -6.021 -8.992 99 HB3 SER 11 HB3 SER 11 -0.633 -5.943 -7.247 100 HG SER 11 HG SER 11 -2.026 -7.680 -7.799 101 H ILE 12 H ILE 12 -0.202 -3.913 -6.294 102 HA ILE 12 HA ILE 12 1.495 -2.187 -7.987 103 HB ILE 12 HB ILE 12 0.441 -1.343 -5.249 104 HG12 ILE 12 HG12 ILE 12 -0.373 -0.293 -7.994 105 HG13 ILE 12 HG13 ILE 12 -1.374 -1.256 -6.899 106 HG21 ILE 12 HG21 ILE 12 1.519 0.828 -5.770 107 HG22 ILE 12 HG22 ILE 12 2.699 -0.464 -5.760 108 HG23 ILE 12 HG23 ILE 12 2.108 0.169 -7.312 109 HD11 ILE 12 HD11 ILE 12 -1.204 0.524 -5.176 110 HD12 ILE 12 HD12 ILE 12 -0.341 1.544 -6.358 111 HD13 ILE 12 HD13 ILE 12 -2.013 1.045 -6.669 112 H ASN 13 H ASN 13 3.662 -1.831 -6.683 113 HA ASN 13 HA ASN 13 4.117 -4.053 -4.764 114 HB2 ASN 13 HB2 ASN 13 5.614 -3.622 -7.374 115 HB3 ASN 13 HB3 ASN 13 6.202 -4.637 -6.049 116 HD21 ASN 13 HD22 ASN 13 5.288 -6.646 -5.630 117 HD22 ASN 13 HD21 ASN 13 4.124 -7.386 -6.699 118 H ILE 14 H ILE 14 6.085 -3.936 -3.595 119 HA ILE 14 HA ILE 14 7.561 -1.378 -3.622 120 HB ILE 14 HB ILE 14 6.293 -2.580 -1.120 121 HG12 ILE 14 HG12 ILE 14 5.569 -0.064 -2.678 122 HG13 ILE 14 HG13 ILE 14 4.587 -1.538 -2.559 123 HG21 ILE 14 HG21 ILE 14 7.856 -0.000 -1.550 124 HG22 ILE 14 HG22 ILE 14 7.135 -0.530 -0.013 125 HG23 ILE 14 HG23 ILE 14 8.468 -1.445 -0.713 126 HD11 ILE 14 HD11 ILE 14 5.269 0.362 -0.280 127 HD12 ILE 14 HD12 ILE 14 3.692 0.105 -1.043 128 HD13 ILE 14 HD13 ILE 14 4.428 -1.201 -0.087 129 H GLY 15 H GLY 15 9.650 -1.576 -2.673 130 HA2 GLY 15 HA2 GLY 15 11.658 -2.671 -2.347 131 HA3 GLY 15 HA3 GLY 15 10.725 -3.790 -1.345 132 H ASP 16 H ASP 16 11.754 -5.661 -1.957 133 HA ASP 16 HA ASP 16 11.123 -6.599 -4.696 134 HB2 ASP 16 HB2 ASP 16 13.216 -7.811 -4.792 135 HB3 ASP 16 HB3 ASP 16 13.536 -6.094 -4.550 136 H ASP 17 H ASP 17 10.095 -6.766 -1.725 137 HA ASP 17 HA ASP 17 9.410 -9.639 -1.882 138 HB2 ASP 17 HB2 ASP 17 10.555 -8.246 0.576 139 HB3 ASP 17 HB3 ASP 17 9.784 -9.838 0.586 140 H ILE 18 H ILE 18 8.104 -6.673 -2.056 141 HA ILE 18 HA ILE 18 5.820 -7.485 -0.328 142 HB ILE 18 HB ILE 18 6.795 -4.634 -0.710 143 HG12 ILE 18 HG12 ILE 18 7.011 -4.963 1.925 144 HG13 ILE 18 HG13 ILE 18 7.299 -6.650 1.477 145 HG21 ILE 18 HG21 ILE 18 5.124 -4.176 1.082 146 HG22 ILE 18 HG22 ILE 18 4.387 -4.763 -0.411 147 HG23 ILE 18 HG23 ILE 18 4.581 -5.867 0.970 148 HD11 ILE 18 HD11 ILE 18 9.398 -5.318 1.667 149 HD12 ILE 18 HD12 ILE 18 9.178 -5.910 0.010 150 HD13 ILE 18 HD13 ILE 18 8.800 -4.217 0.402 151 H THR 19 H THR 19 3.784 -7.045 -1.072 152 HA THR 19 HA THR 19 3.450 -5.821 -3.754 153 HB THR 19 HB THR 19 2.318 -8.521 -2.914 154 HG1 THR 19 HG1 THR 19 3.712 -9.323 -4.473 155 HG21 THR 19 HG21 THR 19 0.781 -7.386 -4.419 156 HG22 THR 19 HG22 THR 19 2.112 -6.926 -5.504 157 HG23 THR 19 HG23 THR 19 1.650 -8.632 -5.341 158 H ILE 20 H ILE 20 1.265 -5.110 -4.110 159 HA ILE 20 HA ILE 20 -0.492 -4.946 -1.717 160 HB ILE 20 HB ILE 20 0.365 -2.683 -3.569 161 HG12 ILE 20 HG12 ILE 20 2.082 -3.248 -1.871 162 HG13 ILE 20 HG13 ILE 20 1.412 -1.630 -1.683 163 HG21 ILE 20 HG21 ILE 20 -1.617 -2.698 -1.264 164 HG22 ILE 20 HG22 ILE 20 -1.000 -1.234 -2.063 165 HG23 ILE 20 HG23 ILE 20 -1.968 -2.403 -2.981 166 HD11 ILE 20 HD11 ILE 20 1.685 -2.792 0.482 167 HD12 ILE 20 HD12 ILE 20 -0.014 -2.373 0.171 168 HD13 ILE 20 HD13 ILE 20 0.546 -4.049 -0.050 169 H THR 21 H THR 21 -2.716 -4.804 -2.268 170 HA THR 21 HA THR 21 -3.412 -4.936 -5.152 171 HB THR 21 HB THR 21 -4.375 -6.954 -3.089 172 HG1 THR 21 HG1 THR 21 -2.420 -7.199 -5.127 173 HG21 THR 21 HG21 THR 21 -4.578 -6.876 -6.132 174 HG22 THR 21 HG22 THR 21 -5.142 -8.198 -5.084 175 HG23 THR 21 HG23 THR 21 -5.918 -6.604 -4.992 176 H ILE 22 H ILE 22 -5.630 -4.453 -5.561 177 HA ILE 22 HA ILE 22 -7.024 -3.068 -3.317 178 HB ILE 22 HB ILE 22 -6.164 -1.384 -4.689 179 HG12 ILE 22 HG12 ILE 22 -8.026 -0.241 -5.645 180 HG13 ILE 22 HG13 ILE 22 -8.940 -1.748 -5.845 181 HG21 ILE 22 HG21 ILE 22 -7.113 -2.942 -7.115 182 HG22 ILE 22 HG22 ILE 22 -6.457 -1.287 -7.144 183 HG23 ILE 22 HG23 ILE 22 -5.432 -2.629 -6.610 184 HD11 ILE 22 HD11 ILE 22 -8.121 -0.592 -3.166 185 HD12 ILE 22 HD12 ILE 22 -9.735 -0.451 -3.927 186 HD13 ILE 22 HD13 ILE 22 -9.116 -2.045 -3.457 187 H LEU 23 H LEU 23 -8.339 -4.810 -2.742 188 HA LEU 23 HA LEU 23 -9.424 -6.590 -4.693 189 HB2 LEU 23 HB2 LEU 23 -10.629 -6.188 -1.961 190 HB3 LEU 23 HB3 LEU 23 -10.561 -7.654 -2.938 191 HG LEU 23 HG LEU 23 -8.336 -6.324 -1.370 192 HD11 LEU 23 HD11 LEU 23 -9.392 -9.181 -1.308 193 HD12 LEU 23 HD12 LEU 23 -8.343 -8.387 -0.124 194 HD13 LEU 23 HD13 LEU 23 -10.036 -7.885 -0.262 195 HD21 LEU 23 HD21 LEU 23 -6.749 -7.876 -2.158 196 HD22 LEU 23 HD22 LEU 23 -7.960 -8.844 -3.026 197 HD23 LEU 23 HD23 LEU 23 -7.489 -7.230 -3.625 198 H GLY 24 H GLY 24 -10.631 -3.523 -3.357 199 HA2 GLY 24 HA2 GLY 24 -12.372 -2.942 -5.373 200 HA3 GLY 24 HA3 GLY 24 -13.353 -3.995 -4.379 201 H VAL 25 H VAL 25 -14.584 -1.790 -4.482 202 HA VAL 25 HA VAL 25 -13.913 -0.335 -1.976 203 HB VAL 25 HB VAL 25 -14.223 1.791 -2.888 204 HG11 VAL 25 HG11 VAL 25 -12.043 0.775 -3.537 205 HG12 VAL 25 HG12 VAL 25 -12.763 0.297 -5.098 206 HG13 VAL 25 HG13 VAL 25 -12.604 2.015 -4.680 207 HG21 VAL 25 HG21 VAL 25 -14.981 2.228 -5.210 208 HG22 VAL 25 HG22 VAL 25 -15.321 0.486 -5.399 209 HG23 VAL 25 HG23 VAL 25 -16.209 1.462 -4.202 210 H SER 26 H SER 26 -15.729 0.853 -1.059 211 HA SER 26 HA SER 26 -18.412 0.422 -2.161 212 HB2 SER 26 HB2 SER 26 -18.019 -1.627 -0.812 213 HB3 SER 26 HB3 SER 26 -17.653 -0.611 0.599 214 HG SER 26 HG SER 26 -19.846 -1.296 0.532 215 H GLY 27 H GLY 27 -19.094 2.522 -2.156 216 HA2 GLY 27 HA2 GLY 27 -19.664 4.597 -1.300 217 HA3 GLY 27 HA3 GLY 27 -19.320 3.949 0.321 218 H GLN 28 H GLN 28 -17.436 4.510 1.345 219 HA GLN 28 HA GLN 28 -15.353 5.935 -0.271 220 HB2 GLN 28 HB2 GLN 28 -16.090 6.256 2.661 221 HB3 GLN 28 HB3 GLN 28 -14.730 7.051 1.866 222 HG2 GLN 28 HG2 GLN 28 -17.647 7.487 1.167 223 HG3 GLN 28 HG3 GLN 28 -16.629 8.520 2.201 224 HE21 GLN 28 HE22 GLN 28 -16.755 7.152 -1.167 225 HE22 GLN 28 HE21 GLN 28 -15.969 8.526 -1.908 226 H GLN 29 H GLN 29 -16.132 3.205 1.759 227 HA GLN 29 HA GLN 29 -13.423 2.808 2.686 228 HB2 GLN 29 HB2 GLN 29 -15.750 0.842 2.473 229 HB3 GLN 29 HB3 GLN 29 -14.160 0.490 3.155 230 HG2 GLN 29 HG2 GLN 29 -15.511 0.975 5.015 231 HG3 GLN 29 HG3 GLN 29 -14.465 2.377 4.780 232 HE21 GLN 29 HE22 GLN 29 -15.392 4.357 4.547 233 HE22 GLN 29 HE21 GLN 29 -17.117 4.616 4.294 234 H VAL 30 H VAL 30 -11.917 1.370 1.942 235 HA VAL 30 HA VAL 30 -12.153 0.426 -0.864 236 HB VAL 30 HB VAL 30 -9.898 2.027 0.436 237 HG11 VAL 30 HG11 VAL 30 -10.126 1.013 -2.419 238 HG12 VAL 30 HG12 VAL 30 -8.786 1.939 -1.706 239 HG13 VAL 30 HG13 VAL 30 -9.097 0.271 -1.162 240 HG21 VAL 30 HG21 VAL 30 -11.752 3.472 -0.220 241 HG22 VAL 30 HG22 VAL 30 -10.417 3.672 -1.369 242 HG23 VAL 30 HG23 VAL 30 -11.831 2.694 -1.822 243 H ARG 31 H ARG 31 -11.883 -1.727 -0.737 244 HA ARG 31 HA ARG 31 -10.524 -2.949 1.561 245 HB2 ARG 31 HB2 ARG 31 -12.351 -3.773 -0.638 246 HB3 ARG 31 HB3 ARG 31 -11.134 -4.984 -0.201 247 HG2 ARG 31 HG2 ARG 31 -12.897 -3.607 1.864 248 HG3 ARG 31 HG3 ARG 31 -13.312 -5.134 1.071 249 HD2 ARG 31 HD2 ARG 31 -11.034 -6.013 1.822 250 HD3 ARG 31 HD3 ARG 31 -10.912 -4.563 2.847 251 HE ARG 31 HE ARG 31 -13.386 -6.038 3.228 252 HH11 ARG 31 HH11 ARG 31 -9.988 -5.855 4.157 253 HH12 ARG 31 HH12 ARG 31 -10.235 -6.701 5.675 254 HH21 ARG 31 HH21 ARG 31 -13.689 -7.111 5.182 255 HH22 ARG 31 HH22 ARG 31 -12.334 -7.422 6.252 256 H ILE 32 H ILE 32 -8.475 -3.447 1.594 257 HA ILE 32 HA ILE 32 -6.943 -3.480 -0.965 258 HB ILE 32 HB ILE 32 -5.908 -2.318 1.638 259 HG12 ILE 32 HG12 ILE 32 -7.518 -0.946 -0.542 260 HG13 ILE 32 HG13 ILE 32 -7.821 -0.985 1.201 261 HG21 ILE 32 HG21 ILE 32 -5.096 -1.839 -1.254 262 HG22 ILE 32 HG22 ILE 32 -4.276 -1.227 0.197 263 HG23 ILE 32 HG23 ILE 32 -4.266 -2.956 -0.138 264 HD11 ILE 32 HD11 ILE 32 -6.961 1.190 0.599 265 HD12 ILE 32 HD12 ILE 32 -5.721 0.345 1.553 266 HD13 ILE 32 HD13 ILE 32 -5.563 0.474 -0.222 267 H GLY 33 H GLY 33 -5.001 -4.747 -0.904 268 HA2 GLY 33 HA2 GLY 33 -4.835 -6.707 1.345 269 HA3 GLY 33 HA3 GLY 33 -4.646 -7.172 -0.361 270 H ILE 34 H ILE 34 -2.740 -7.482 1.784 271 HA ILE 34 HA ILE 34 -0.443 -5.994 0.625 272 HB ILE 34 HB ILE 34 -0.976 -6.270 3.616 273 HG12 ILE 34 HG12 ILE 34 -1.149 -3.742 1.912 274 HG13 ILE 34 HG13 ILE 34 -2.545 -4.635 2.552 275 HG21 ILE 34 HG21 ILE 34 0.995 -4.760 3.799 276 HG22 ILE 34 HG22 ILE 34 1.402 -6.270 2.990 277 HG23 ILE 34 HG23 ILE 34 1.168 -4.781 2.034 278 HD11 ILE 34 HD11 ILE 34 -1.693 -4.302 4.858 279 HD12 ILE 34 HD12 ILE 34 -0.411 -3.248 4.201 280 HD13 ILE 34 HD13 ILE 34 -2.117 -2.792 4.023 281 H ASN 35 H ASN 35 1.423 -7.198 0.564 282 HA ASN 35 HA ASN 35 1.347 -9.866 1.854 283 HB2 ASN 35 HB2 ASN 35 0.346 -9.924 -0.462 284 HB3 ASN 35 HB3 ASN 35 1.908 -9.412 -1.096 285 HD21 ASN 35 HD22 ASN 35 0.401 -11.907 -1.577 286 HD22 ASN 35 HD21 ASN 35 1.417 -13.228 -1.048 287 H ALA 36 H ALA 36 3.051 -9.682 3.153 288 HA ALA 36 HA ALA 36 5.703 -9.266 1.933 289 HB1 ALA 36 HB1 ALA 36 4.673 -7.735 4.370 290 HB2 ALA 36 HB2 ALA 36 6.343 -7.720 3.779 291 HB3 ALA 36 HB3 ALA 36 5.051 -7.027 2.776 292 HA PRO 37 HA PRO 37 6.762 -12.525 4.727 293 HB2 PRO 37 HB2 PRO 37 9.347 -11.785 5.433 294 HB3 PRO 37 HB3 PRO 37 8.912 -12.528 3.847 295 HG2 PRO 37 HG2 PRO 37 9.298 -9.603 4.548 296 HG3 PRO 37 HG3 PRO 37 9.935 -10.508 3.129 297 HD2 PRO 37 HD2 PRO 37 7.717 -8.982 2.948 298 HD3 PRO 37 HD3 PRO 37 7.820 -10.573 2.116 299 H LYS 38 H LYS 38 7.136 -12.969 6.998 300 HA LYS 38 HA LYS 38 6.280 -10.883 8.815 301 HB2 LYS 38 HB2 LYS 38 7.509 -13.642 9.275 302 HB3 LYS 38 HB3 LYS 38 6.791 -12.640 10.559 303 HG2 LYS 38 HG2 LYS 38 5.280 -13.505 8.057 304 HG3 LYS 38 HG3 LYS 38 5.259 -14.430 9.568 305 HD2 LYS 38 HD2 LYS 38 4.542 -11.476 9.570 306 HD3 LYS 38 HD3 LYS 38 3.376 -12.692 9.044 307 HE2 LYS 38 HE2 LYS 38 3.675 -13.911 11.179 308 HE3 LYS 38 HE3 LYS 38 4.858 -12.697 11.712 309 HZ1 LYS 38 HZ1 LYS 38 2.672 -12.277 12.604 310 HZ2 LYS 38 HZ2 LYS 38 3.105 -11.054 11.593 311 HZ3 LYS 38 HZ3 LYS 38 2.024 -12.199 11.097 312 H ASP 39 H ASP 39 9.053 -11.293 7.211 313 HA ASP 39 HA ASP 39 11.073 -10.551 9.098 314 HB2 ASP 39 HB2 ASP 39 11.225 -11.524 6.685 315 HB3 ASP 39 HB3 ASP 39 10.988 -9.873 6.135 316 H VAL 40 H VAL 40 8.371 -8.847 7.897 317 HA VAL 40 HA VAL 40 9.523 -6.260 8.751 318 HB VAL 40 HB VAL 40 8.591 -5.109 6.840 319 HG11 VAL 40 HG11 VAL 40 10.150 -7.536 5.840 320 HG12 VAL 40 HG12 VAL 40 10.004 -5.960 5.038 321 HG13 VAL 40 HG13 VAL 40 10.879 -6.088 6.581 322 HG21 VAL 40 HG21 VAL 40 6.633 -6.574 6.456 323 HG22 VAL 40 HG22 VAL 40 7.541 -6.233 4.970 324 HG23 VAL 40 HG23 VAL 40 7.726 -7.810 5.767 325 H ALA 41 H ALA 41 7.666 -4.596 8.940 326 HA ALA 41 HA ALA 41 5.424 -6.007 10.296 327 HB1 ALA 41 HB1 ALA 41 5.260 -3.954 11.654 328 HB2 ALA 41 HB2 ALA 41 6.897 -4.637 11.735 329 HB3 ALA 41 HB3 ALA 41 6.570 -3.212 10.715 330 H VAL 42 H VAL 42 3.293 -5.144 10.146 331 HA VAL 42 HA VAL 42 2.749 -2.884 8.387 332 HB VAL 42 HB VAL 42 2.765 -4.363 6.586 333 HG11 VAL 42 HG11 VAL 42 1.775 -6.666 6.670 334 HG12 VAL 42 HG12 VAL 42 3.220 -6.441 7.668 335 HG13 VAL 42 HG13 VAL 42 1.611 -6.476 8.433 336 HG21 VAL 42 HG21 VAL 42 0.563 -3.231 6.745 337 HG22 VAL 42 HG22 VAL 42 0.456 -4.816 5.951 338 HG23 VAL 42 HG23 VAL 42 -0.078 -4.639 7.629 339 H HIS 43 H HIS 43 1.118 -1.773 9.246 340 HA HIS 43 HA HIS 43 -1.088 -3.134 10.620 341 HB2 HIS 43 HB2 HIS 43 0.411 -0.978 12.136 342 HB3 HIS 43 HB3 HIS 43 -0.809 -2.095 12.720 343 HD2 HIS 43 HD2 HIS 43 2.943 -1.905 11.841 344 HE1 HIS 43 HE1 HIS 43 2.391 -5.466 14.104 345 HE2 HIS 43 HE2 HIS 43 4.109 -3.923 13.050 346 H ARG 44 H ARG 44 -2.723 -1.388 11.402 347 HA ARG 44 HA ARG 44 -3.100 0.597 9.323 348 HB2 ARG 44 HB2 ARG 44 -4.439 0.203 12.046 349 HB3 ARG 44 HB3 ARG 44 -4.968 1.362 10.815 350 HG2 ARG 44 HG2 ARG 44 -5.254 -0.524 9.203 351 HG3 ARG 44 HG3 ARG 44 -4.859 -1.669 10.496 352 HD2 ARG 44 HD2 ARG 44 -7.182 0.303 10.495 353 HD3 ARG 44 HD3 ARG 44 -7.301 -1.432 10.184 354 HE ARG 44 HE ARG 44 -6.552 -1.839 12.504 355 HH11 ARG 44 HH11 ARG 44 -7.809 1.390 11.739 356 HH12 ARG 44 HH12 ARG 44 -8.194 1.743 13.410 357 HH21 ARG 44 HH21 ARG 44 -7.115 -1.369 14.611 358 HH22 ARG 44 HH22 ARG 44 -7.817 0.183 15.034 359 H GLU 45 H GLU 45 -3.245 2.964 9.805 360 HA GLU 45 HA GLU 45 -0.834 3.861 10.998 361 HB2 GLU 45 HB2 GLU 45 -2.269 4.919 9.186 362 HB3 GLU 45 HB3 GLU 45 -3.345 5.510 10.449 363 HG2 GLU 45 HG2 GLU 45 -0.350 6.110 10.305 364 HG3 GLU 45 HG3 GLU 45 -1.592 7.129 9.554 365 H GLU 46 H GLU 46 -3.930 3.070 12.325 366 HA GLU 46 HA GLU 46 -3.815 4.647 14.735 367 HB2 GLU 46 HB2 GLU 46 -5.879 3.713 13.665 368 HB3 GLU 46 HB3 GLU 46 -5.290 2.077 13.991 369 HG2 GLU 46 HG2 GLU 46 -5.346 2.583 16.446 370 HG3 GLU 46 HG3 GLU 46 -6.038 4.168 16.070 371 H ILE 47 H ILE 47 -2.655 1.391 13.788 372 HA ILE 47 HA ILE 47 -1.994 0.710 16.584 373 HB ILE 47 HB ILE 47 -1.987 -0.728 13.912 374 HG12 ILE 47 HG12 ILE 47 -3.307 -2.395 15.157 375 HG13 ILE 47 HG13 ILE 47 -3.099 -1.471 16.647 376 HG21 ILE 47 HG21 ILE 47 0.152 -1.363 14.944 377 HG22 ILE 47 HG22 ILE 47 -0.676 -1.696 16.485 378 HG23 ILE 47 HG23 ILE 47 -0.987 -2.705 15.052 379 HD11 ILE 47 HD11 ILE 47 -4.564 -0.468 14.172 380 HD12 ILE 47 HD12 ILE 47 -5.336 -1.175 15.609 381 HD13 ILE 47 HD13 ILE 47 -4.464 0.360 15.748 382 H TYR 48 H TYR 48 -0.521 1.906 13.620 383 HA TYR 48 HA TYR 48 2.163 1.151 14.056 384 HB2 TYR 48 HB2 TYR 48 1.158 2.042 11.966 385 HB3 TYR 48 HB3 TYR 48 0.985 3.619 12.722 386 HD1 TYR 48 HD2 TYR 48 3.528 1.061 11.732 387 HD2 TYR 48 HD1 TYR 48 2.743 5.180 12.707 388 HE1 TYR 48 HE2 TYR 48 5.789 1.679 10.919 389 HE2 TYR 48 HE1 TYR 48 4.960 5.816 11.880 390 HH TYR 48 HH TYR 48 6.934 5.084 10.895 391 H GLN 49 H GLN 49 0.252 3.794 15.453 392 HA GLN 49 HA GLN 49 2.478 5.357 16.375 393 HB2 GLN 49 HB2 GLN 49 -0.441 5.178 17.230 394 HB3 GLN 49 HB3 GLN 49 0.687 6.418 17.807 395 HG2 GLN 49 HG2 GLN 49 0.998 7.304 15.585 396 HG3 GLN 49 HG3 GLN 49 0.141 5.955 14.850 397 HE21 GLN 49 HE22 GLN 49 -1.317 7.449 13.839 398 HE22 GLN 49 HE21 GLN 49 -2.611 8.207 14.720 399 H ARG 50 H ARG 50 0.954 2.443 17.587 400 HA ARG 50 HA ARG 50 1.790 2.789 20.373 401 HB2 ARG 50 HB2 ARG 50 0.661 0.509 18.699 402 HB3 ARG 50 HB3 ARG 50 1.255 0.242 20.327 403 HG2 ARG 50 HG2 ARG 50 -1.137 0.567 20.415 404 HG3 ARG 50 HG3 ARG 50 -0.346 1.941 21.203 405 HD2 ARG 50 HD2 ARG 50 -0.677 3.322 19.207 406 HD3 ARG 50 HD3 ARG 50 -1.375 1.945 18.337 407 HE ARG 50 HE ARG 50 -2.661 3.627 20.358 408 HH11 ARG 50 HH11 ARG 50 -2.767 0.533 18.649 409 HH12 ARG 50 HH12 ARG 50 -4.484 0.320 18.907 410 HH21 ARG 50 HH21 ARG 50 -4.891 3.313 20.692 411 HH22 ARG 50 HH22 ARG 50 -5.677 1.888 20.058 412 H ILE 51 H ILE 51 3.258 1.886 17.418 413 HA ILE 51 HA ILE 51 5.277 0.164 18.741 414 HB ILE 51 HB ILE 51 4.549 0.670 15.833 415 HG12 ILE 51 HG12 ILE 51 4.092 -1.736 17.658 416 HG13 ILE 51 HG13 ILE 51 2.854 -0.534 17.271 417 HG21 ILE 51 HG21 ILE 51 6.448 -1.377 17.055 418 HG22 ILE 51 HG22 ILE 51 6.041 -1.210 15.326 419 HG23 ILE 51 HG23 ILE 51 6.950 0.068 16.145 420 HD11 ILE 51 HD11 ILE 51 3.057 -1.073 14.867 421 HD12 ILE 51 HD12 ILE 51 4.214 -2.371 15.277 422 HD13 ILE 51 HD13 ILE 51 2.532 -2.443 15.862 423 H GLN 52 H GLN 52 4.976 3.091 16.642 424 HA GLN 52 HA GLN 52 7.837 3.532 16.639 425 HB2 GLN 52 HB2 GLN 52 5.507 5.359 15.896 426 HB3 GLN 52 HB3 GLN 52 7.210 5.697 15.560 427 HG2 GLN 52 HG2 GLN 52 5.519 3.460 14.421 428 HG3 GLN 52 HG3 GLN 52 6.342 4.786 13.574 429 HE21 GLN 52 HE22 GLN 52 6.501 1.528 14.280 430 HE22 GLN 52 HE21 GLN 52 8.217 1.263 14.051 431 H ALA 53 H ALA 53 5.803 3.709 19.194 432 HA ALA 53 HA ALA 53 6.456 6.214 20.373 433 HB1 ALA 53 HB1 ALA 53 5.727 3.545 21.643 434 HB2 ALA 53 HB2 ALA 53 5.686 5.132 22.451 435 HB3 ALA 53 HB3 ALA 53 4.586 4.787 21.089 436 H GLY 54 H GLY 54 8.434 3.408 19.811 437 HA2 GLY 54 HA2 GLY 54 10.840 4.400 20.398 438 HA3 GLY 54 HA3 GLY 54 10.270 4.039 22.037 439 H LEU 55 H LEU 55 9.210 1.897 19.424 440 HA LEU 55 HA LEU 55 11.255 -0.106 20.019 441 HB2 LEU 55 HB2 LEU 55 9.532 -1.661 21.042 442 HB3 LEU 55 HB3 LEU 55 10.038 -0.294 22.025 443 HG LEU 55 HG LEU 55 7.945 0.952 21.195 444 HD11 LEU 55 HD11 LEU 55 7.137 -1.890 20.448 445 HD12 LEU 55 HD12 LEU 55 6.058 -0.481 20.537 446 HD13 LEU 55 HD13 LEU 55 7.331 -0.538 19.305 447 HD21 LEU 55 HD21 LEU 55 6.560 -0.163 22.883 448 HD22 LEU 55 HD22 LEU 55 7.692 -1.548 22.890 449 HD23 LEU 55 HD23 LEU 55 8.230 0.060 23.435 450 H THR 56 H THR 56 9.900 -2.387 19.276 451 HA THR 56 HA THR 56 8.619 -1.775 16.663 452 HB THR 56 HB THR 56 10.803 -3.860 16.975 453 HG1 THR 56 HG1 THR 56 12.119 -2.348 15.940 454 HG21 THR 56 HG21 THR 56 10.862 -3.619 14.472 455 HG22 THR 56 HG22 THR 56 9.327 -4.266 15.073 456 HG23 THR 56 HG23 THR 56 9.435 -2.559 14.581 457 H ALA 57 H ALA 57 8.611 -3.447 19.605 458 HA ALA 57 HA ALA 57 6.311 -5.043 18.760 459 HB1 ALA 57 HB1 ALA 57 8.838 -6.351 19.846 460 HB2 ALA 57 HB2 ALA 57 7.274 -7.159 19.591 461 HB3 ALA 57 HB3 ALA 57 8.188 -6.540 18.203 462 HA PRO 58 HA PRO 58 5.742 -3.092 22.870 463 HB2 PRO 58 HB2 PRO 58 3.008 -4.127 22.171 464 HB3 PRO 58 HB3 PRO 58 3.462 -2.585 22.965 465 HG2 PRO 58 HG2 PRO 58 2.814 -2.647 20.312 466 HG3 PRO 58 HG3 PRO 58 4.239 -1.692 20.860 467 HD2 PRO 58 HD2 PRO 58 4.189 -4.454 19.625 468 HD3 PRO 58 HD3 PRO 58 5.290 -3.086 19.279 469 H ASP 59 H ASP 59 4.620 -3.855 24.872 470 HA ASP 59 HA ASP 59 5.587 -6.394 25.664 471 HB2 ASP 59 HB2 ASP 59 5.113 -4.288 27.013 472 HB3 ASP 59 HB3 ASP 59 3.403 -4.713 26.955 473 H5' U 36 H5' U 36 -4.505 10.319 -16.980 474 H5'' U 36 H5'' U 36 -5.467 10.417 -15.490 475 H4' U 36 H4' U 36 -2.865 11.941 -15.954 476 H3' U 36 H3' U 36 -2.857 9.231 -15.731 477 H2' U 36 H2' U 36 -4.441 9.142 -13.940 478 HO2' U 36 HO2' U 36 -2.549 7.953 -13.330 479 H1' U 36 H1' U 36 -2.818 11.243 -12.496 480 H3 U 36 H3 U 36 -5.706 12.096 -9.176 481 H5 U 36 H5 U 36 -8.106 10.132 -12.009 482 H6 U 36 H6 U 36 -6.217 10.058 -13.492 483 HO5' U 36 HO5' U 36 -6.146 11.912 -17.118 484 H5' C 37 H5' C 37 -0.300 8.876 -18.380 485 H5'' C 37 H5'' C 37 -1.739 8.507 -17.402 486 H4' C 37 H4' C 37 0.746 6.768 -17.327 487 H3' C 37 H3' C 37 -0.614 7.086 -19.694 488 H2' C 37 H2' C 37 -2.759 6.678 -18.877 489 HO2' C 37 HO2' C 37 -1.684 4.140 -19.566 490 H1' C 37 H1' C 37 -1.815 4.367 -17.187 491 H41 C 37 H41 C 37 -7.407 5.383 -14.352 492 H42 C 37 H42 C 37 -7.489 7.037 -14.935 493 H5 C 37 H5 C 37 -5.709 8.048 -16.282 494 H6 C 37 H6 C 37 -3.542 7.644 -17.301 495 H5' A 38 H5' A 38 2.486 7.655 -18.156 496 H5'' A 38 H5'' A 38 3.999 6.999 -18.810 497 H4' A 38 H4' A 38 4.404 7.694 -16.542 498 H3' A 38 H3' A 38 5.125 5.183 -17.354 499 H2' A 38 H2' A 38 3.011 4.189 -16.735 500 HO2' A 38 HO2' A 38 4.815 3.898 -14.553 501 H1' A 38 H1' A 38 3.299 5.657 -14.103 502 H8 A 38 H8 A 38 1.081 3.607 -16.365 503 H61 A 38 H61 A 38 -3.464 4.746 -12.292 504 H62 A 38 H62 A 38 -2.996 3.797 -13.685 505 H2 A 38 H2 A 38 0.005 7.328 -11.265 506 H5' G 39 H5' G 39 5.038 8.567 -14.630 507 H5'' G 39 H5'' G 39 6.421 9.513 -15.210 508 H4' G 39 H4' G 39 5.736 10.631 -13.275 509 H3' G 39 H3' G 39 8.268 9.725 -13.207 510 H2' G 39 H2' G 39 7.865 7.581 -12.301 511 HO2' G 39 HO2' G 39 8.181 9.310 -10.082 512 H1' G 39 H1' G 39 5.852 8.403 -10.274 513 H8 G 39 H8 G 39 3.646 6.938 -12.390 514 H1 G 39 H1 G 39 7.755 2.273 -10.802 515 H21 G 39 H21 G 39 9.570 3.124 -9.927 516 H22 G 39 H22 G 39 9.791 4.848 -9.705 517 H5' G 40 H5' G 40 7.122 11.072 -8.789 518 H5'' G 40 H5'' G 40 8.227 12.405 -8.451 519 H4' G 40 H4' G 40 7.769 11.037 -6.464 520 H3' G 40 H3' G 40 10.318 11.956 -7.260 521 H2' G 40 H2' G 40 10.953 9.701 -7.923 522 HO2' G 40 HO2' G 40 11.579 10.102 -5.172 523 H1' G 40 H1' G 40 9.432 8.884 -5.425 524 H8 G 40 H8 G 40 9.908 7.440 -9.009 525 H1 G 40 H1 G 40 11.776 3.602 -4.212 526 H21 G 40 H21 G 40 11.548 4.657 -2.266 527 H22 G 40 H22 G 40 10.891 6.271 -2.165 528 H5' A 41 H5' A 41 7.480 13.878 -3.978 529 H5'' A 41 H5'' A 41 7.225 12.654 -5.227 530 H4' A 41 H4' A 41 7.245 15.624 -5.871 531 H3' A 41 H3' A 41 5.117 13.921 -4.623 532 H2' A 41 H2' A 41 3.470 14.571 -6.158 533 HO2' A 41 HO2' A 41 3.897 16.840 -5.889 534 H1' A 41 H1' A 41 5.100 15.012 -8.387 535 H8 A 41 H8 A 41 4.461 12.003 -5.981 536 H61 A 41 H61 A 41 2.498 9.193 -11.172 537 H62 A 41 H62 A 41 2.623 9.016 -9.433 538 H2 A 41 H2 A 41 4.015 13.186 -12.264 539 H5' C 42 H5' C 42 1.672 15.269 -2.138 540 H5'' C 42 H5'' C 42 2.670 13.938 -2.730 541 H4' C 42 H4' C 42 1.404 13.839 -4.812 542 H3' C 42 H3' C 42 0.604 16.330 -4.785 543 H2' C 42 H2' C 42 -0.191 16.222 -2.457 544 HO2' C 42 HO2' C 42 -2.385 15.947 -4.263 545 H1' C 42 H1' C 42 -1.849 13.881 -3.400 546 H41 C 42 H41 C 42 -3.032 14.003 2.900 547 H42 C 42 H42 C 42 -1.349 13.653 3.250 548 H5 C 42 H5 C 42 0.353 13.497 1.490 549 H6 C 42 H6 C 42 0.737 13.692 -0.902 550 H5' A 43 H5' A 43 -0.016 17.786 -7.197 551 H5'' A 43 H5'' A 43 -0.934 17.207 -5.798 552 H4' A 43 H4' A 43 -3.056 17.705 -7.209 553 H3' A 43 H3' A 43 -1.578 18.729 -9.160 554 H2' A 43 H2' A 43 0.032 19.889 -7.886 555 HO2' A 43 HO2' A 43 -0.983 21.490 -9.221 556 H1' A 43 H1' A 43 -1.730 21.176 -5.912 557 H8 A 43 H8 A 43 -0.785 18.386 -4.034 558 H61 A 43 H61 A 43 5.088 20.416 -3.618 559 H62 A 43 H62 A 43 3.958 19.219 -3.022 560 H2 A 43 H2 A 43 3.066 22.723 -6.796 561 H5' U 44 H5' U 44 -6.567 19.563 -7.052 562 H5'' U 44 H5'' U 44 -4.926 19.970 -6.523 563 H4' U 44 H4' U 44 -6.431 17.431 -5.716 564 H3' U 44 H3' U 44 -6.052 20.105 -4.349 565 HO3' U 44 HO3' U 44 -8.235 19.681 -3.784 566 H2' U 44 H2' U 44 -6.061 18.925 -2.242 567 HO2' U 44 HO2' U 44 -7.723 17.375 -2.833 568 H1' U 44 H1' U 44 -4.341 17.004 -3.063 569 H3 U 44 H3 U 44 -1.892 19.779 -0.434 570 H5 U 44 H5 U 44 -2.376 21.921 -4.026 571 H6 U 44 H6 U 44 -3.862 20.193 -4.792 572 H1 MET 1 H1 MET 1 1.160 -12.753 3.967 573 H2 MET 1 H2 MET 1 0.241 -12.914 5.326 574 H3 MET 1 H3 MET 1 1.090 -11.525 5.061 575 HA MET 1 HA MET 1 -0.240 -10.990 3.161 576 HB2 MET 1 HB2 MET 1 -0.718 -13.367 2.542 577 HB3 MET 1 HB3 MET 1 -1.800 -13.489 3.949 578 HG2 MET 1 HG2 MET 1 -3.134 -13.027 1.974 579 HG3 MET 1 HG3 MET 1 -3.161 -11.611 3.015 580 HE1 MET 1 HE1 MET 1 -3.460 -9.555 1.806 581 HE2 MET 1 HE2 MET 1 -3.169 -9.391 0.061 582 HE3 MET 1 HE3 MET 1 -4.236 -10.691 0.693 583 H LEU 2 H LEU 2 -1.714 -9.348 3.646 584 HA LEU 2 HA LEU 2 -3.408 -9.737 6.041 585 HB2 LEU 2 HB2 LEU 2 -1.146 -7.887 5.745 586 HB3 LEU 2 HB3 LEU 2 -2.661 -7.037 6.112 587 HG LEU 2 HG LEU 2 -1.418 -9.288 7.717 588 HD11 LEU 2 HD11 LEU 2 -1.107 -7.565 9.409 589 HD12 LEU 2 HD12 LEU 2 -0.317 -7.073 7.891 590 HD13 LEU 2 HD13 LEU 2 -1.872 -6.341 8.349 591 HD21 LEU 2 HD21 LEU 2 -3.175 -8.688 9.395 592 HD22 LEU 2 HD22 LEU 2 -3.985 -7.694 8.144 593 HD23 LEU 2 HD23 LEU 2 -3.840 -9.462 7.952 594 H ILE 3 H ILE 3 -5.453 -8.917 5.815 595 HA ILE 3 HA ILE 3 -6.000 -7.410 3.305 596 HB ILE 3 HB ILE 3 -8.191 -8.636 4.929 597 HG12 ILE 3 HG12 ILE 3 -7.215 -10.687 4.870 598 HG13 ILE 3 HG13 ILE 3 -8.055 -10.671 3.350 599 HG21 ILE 3 HG21 ILE 3 -7.666 -8.302 1.961 600 HG22 ILE 3 HG22 ILE 3 -9.192 -8.837 2.693 601 HG23 ILE 3 HG23 ILE 3 -8.600 -7.185 2.981 602 HD11 ILE 3 HD11 ILE 3 -5.060 -10.370 3.747 603 HD12 ILE 3 HD12 ILE 3 -5.959 -11.643 2.950 604 HD13 ILE 3 HD13 ILE 3 -5.909 -10.023 2.203 605 H LEU 4 H LEU 4 -7.045 -5.428 3.482 606 HA LEU 4 HA LEU 4 -7.567 -4.385 6.232 607 HB2 LEU 4 HB2 LEU 4 -5.545 -3.577 4.175 608 HB3 LEU 4 HB3 LEU 4 -6.482 -2.259 4.866 609 HG LEU 4 HG LEU 4 -4.392 -2.507 6.033 610 HD11 LEU 4 HD11 LEU 4 -5.244 -2.504 8.288 611 HD12 LEU 4 HD12 LEU 4 -6.418 -1.704 7.202 612 HD13 LEU 4 HD13 LEU 4 -6.724 -3.355 7.784 613 HD21 LEU 4 HD21 LEU 4 -4.145 -5.006 5.735 614 HD22 LEU 4 HD22 LEU 4 -3.783 -4.392 7.362 615 HD23 LEU 4 HD23 LEU 4 -5.330 -5.202 7.058 616 H THR 5 H THR 5 -8.965 -2.544 6.296 617 HA THR 5 HA THR 5 -10.047 -1.662 3.677 618 HB THR 5 HB THR 5 -11.864 -1.729 6.083 619 HG1 THR 5 HG1 THR 5 -11.242 -3.872 5.711 620 HG21 THR 5 HG21 THR 5 -13.539 -1.712 4.261 621 HG22 THR 5 HG22 THR 5 -12.436 -0.323 4.177 622 HG23 THR 5 HG23 THR 5 -12.218 -1.698 3.064 623 H ARG 6 H ARG 6 -10.062 0.494 3.485 624 HA ARG 6 HA ARG 6 -9.732 2.239 5.863 625 HB2 ARG 6 HB2 ARG 6 -7.485 1.502 4.834 626 HB3 ARG 6 HB3 ARG 6 -8.004 2.272 3.342 627 HG2 ARG 6 HG2 ARG 6 -6.624 3.856 4.271 628 HG3 ARG 6 HG3 ARG 6 -8.206 4.450 4.787 629 HD2 ARG 6 HD2 ARG 6 -6.373 2.669 6.471 630 HD3 ARG 6 HD3 ARG 6 -6.348 4.439 6.517 631 HE ARG 6 HE ARG 6 -8.999 3.383 7.025 632 HH11 ARG 6 HH11 ARG 6 -5.838 4.008 8.476 633 HH12 ARG 6 HH12 ARG 6 -6.487 4.226 10.086 634 HH21 ARG 6 HH21 ARG 6 -9.819 3.649 9.147 635 HH22 ARG 6 HH22 ARG 6 -8.724 4.016 10.462 636 H LYS 7 H LYS 7 -10.293 4.588 5.207 637 HA LYS 7 HA LYS 7 -11.656 4.635 2.556 638 HB2 LYS 7 HB2 LYS 7 -13.364 6.086 3.355 639 HB3 LYS 7 HB3 LYS 7 -13.423 4.576 4.257 640 HG2 LYS 7 HG2 LYS 7 -12.360 5.676 6.189 641 HG3 LYS 7 HG3 LYS 7 -12.133 7.165 5.235 642 HD2 LYS 7 HD2 LYS 7 -14.643 7.220 4.879 643 HD3 LYS 7 HD3 LYS 7 -14.770 5.883 6.040 644 HE2 LYS 7 HE2 LYS 7 -13.579 7.341 7.718 645 HE3 LYS 7 HE3 LYS 7 -13.633 8.660 6.525 646 HZ1 LYS 7 HZ1 LYS 7 -15.988 7.309 7.661 647 HZ2 LYS 7 HZ2 LYS 7 -15.452 8.803 8.076 648 HZ3 LYS 7 HZ3 LYS 7 -16.018 8.535 6.558 649 H VAL 8 H VAL 8 -12.094 6.913 1.827 650 HA VAL 8 HA VAL 8 -9.521 7.840 1.215 651 HB VAL 8 HB VAL 8 -10.517 9.569 -0.045 652 HG11 VAL 8 HG11 VAL 8 -12.346 7.114 -0.042 653 HG12 VAL 8 HG12 VAL 8 -12.088 8.224 -1.394 654 HG13 VAL 8 HG13 VAL 8 -10.749 7.198 -0.824 655 HG21 VAL 8 HG21 VAL 8 -12.180 10.492 1.489 656 HG22 VAL 8 HG22 VAL 8 -12.902 10.039 -0.066 657 HG23 VAL 8 HG23 VAL 8 -13.147 8.997 1.358 658 H GLY 9 H GLY 9 -8.118 9.123 2.065 659 HA2 GLY 9 HA2 GLY 9 -7.504 11.214 3.090 660 HA3 GLY 9 HA3 GLY 9 -8.984 11.164 4.058 661 H GLU 10 H GLU 10 -7.919 8.034 4.224 662 HA GLU 10 HA GLU 10 -6.396 8.599 6.731 663 HB2 GLU 10 HB2 GLU 10 -8.078 6.210 5.931 664 HB3 GLU 10 HB3 GLU 10 -7.188 6.383 7.458 665 HG2 GLU 10 HG2 GLU 10 -9.456 8.167 6.487 666 HG3 GLU 10 HG3 GLU 10 -9.564 6.932 7.742 667 H SER 11 H SER 11 -5.120 6.308 7.284 668 HA SER 11 HA SER 11 -3.432 5.712 4.914 669 HB2 SER 11 HB2 SER 11 -2.451 6.916 7.526 670 HB3 SER 11 HB3 SER 11 -1.408 6.313 6.228 671 HG SER 11 HG SER 11 -1.789 8.580 6.142 672 H ILE 12 H ILE 12 -1.705 4.189 5.409 673 HA ILE 12 HA ILE 12 -2.129 2.250 7.612 674 HB ILE 12 HB ILE 12 -1.887 1.604 4.644 675 HG12 ILE 12 HG12 ILE 12 -4.185 2.261 5.305 676 HG13 ILE 12 HG13 ILE 12 -4.064 0.586 4.778 677 HG21 ILE 12 HG21 ILE 12 -0.634 -0.074 5.833 678 HG22 ILE 12 HG22 ILE 12 -1.915 -0.261 7.052 679 HG23 ILE 12 HG23 ILE 12 -2.184 -0.780 5.378 680 HD11 ILE 12 HD11 ILE 12 -4.055 -0.179 7.141 681 HD12 ILE 12 HD12 ILE 12 -4.201 1.509 7.679 682 HD13 ILE 12 HD13 ILE 12 -5.510 0.745 6.746 683 H ASN 13 H ASN 13 -0.032 0.821 7.715 684 HA ASN 13 HA ASN 13 2.315 2.326 6.678 685 HB2 ASN 13 HB2 ASN 13 1.715 1.644 9.576 686 HB3 ASN 13 HB3 ASN 13 3.331 2.069 8.985 687 HD21 ASN 13 HD22 ASN 13 3.812 4.202 8.356 688 HD22 ASN 13 HD21 ASN 13 2.727 5.531 8.692 689 H ILE 14 H ILE 14 4.282 1.222 6.679 690 HA ILE 14 HA ILE 14 4.243 -1.700 7.153 691 HB ILE 14 HB ILE 14 5.152 -0.404 4.545 692 HG12 ILE 14 HG12 ILE 14 2.729 -2.156 5.135 693 HG13 ILE 14 HG13 ILE 14 2.693 -0.433 4.713 694 HG21 ILE 14 HG21 ILE 14 4.980 -3.322 5.387 695 HG22 ILE 14 HG22 ILE 14 5.504 -2.721 3.795 696 HG23 ILE 14 HG23 ILE 14 6.485 -2.381 5.222 697 HD11 ILE 14 HD11 ILE 14 3.606 -2.705 2.913 698 HD12 ILE 14 HD12 ILE 14 2.147 -1.709 2.748 699 HD13 ILE 14 HD13 ILE 14 3.750 -0.975 2.520 700 H GLY 15 H GLY 15 6.327 -2.540 7.595 701 HA2 GLY 15 HA2 GLY 15 8.429 -2.448 8.551 702 HA3 GLY 15 HA3 GLY 15 8.777 -1.206 7.332 703 H ASP 16 H ASP 16 9.962 0.169 8.586 704 HA ASP 16 HA ASP 16 8.445 1.659 10.668 705 HB2 ASP 16 HB2 ASP 16 11.390 0.888 10.716 706 HB3 ASP 16 HB3 ASP 16 10.596 1.965 11.869 707 H ASP 17 H ASP 17 9.310 1.808 7.636 708 HA ASP 17 HA ASP 17 10.048 4.669 7.712 709 HB2 ASP 17 HB2 ASP 17 11.564 2.544 6.140 710 HB3 ASP 17 HB3 ASP 17 11.801 4.288 6.001 711 H ILE 18 H ILE 18 7.731 2.591 6.757 712 HA ILE 18 HA ILE 18 7.380 4.020 4.168 713 HB ILE 18 HB ILE 18 6.638 1.117 4.681 714 HG12 ILE 18 HG12 ILE 18 8.350 0.944 2.636 715 HG13 ILE 18 HG13 ILE 18 9.043 2.391 3.389 716 HG21 ILE 18 HG21 ILE 18 6.175 1.145 2.236 717 HG22 ILE 18 HG22 ILE 18 5.107 2.225 3.136 718 HG23 ILE 18 HG23 ILE 18 6.476 2.901 2.223 719 HD11 ILE 18 HD11 ILE 18 10.089 0.275 4.187 720 HD12 ILE 18 HD12 ILE 18 9.295 1.130 5.523 721 HD13 ILE 18 HD13 ILE 18 8.500 -0.277 4.776 722 H THR 19 H THR 19 5.326 4.653 3.652 723 HA THR 19 HA THR 19 3.110 4.046 5.525 724 HB THR 19 HB THR 19 3.934 6.849 4.662 725 HG1 THR 19 HG1 THR 19 5.274 6.002 6.276 726 HG21 THR 19 HG21 THR 19 1.510 6.705 4.931 727 HG22 THR 19 HG22 THR 19 1.703 5.830 6.471 728 HG23 THR 19 HG23 THR 19 2.196 7.536 6.334 729 H ILE 20 H ILE 20 1.040 4.418 4.561 730 HA ILE 20 HA ILE 20 0.992 4.805 1.606 731 HB ILE 20 HB ILE 20 -0.404 2.632 3.226 732 HG12 ILE 20 HG12 ILE 20 1.997 2.166 2.843 733 HG13 ILE 20 HG13 ILE 20 0.916 1.011 2.056 734 HG21 ILE 20 HG21 ILE 20 -0.518 3.294 0.256 735 HG22 ILE 20 HG22 ILE 20 -1.191 1.822 0.992 736 HG23 ILE 20 HG23 ILE 20 -1.848 3.407 1.429 737 HD11 ILE 20 HD11 ILE 20 2.849 1.700 0.629 738 HD12 ILE 20 HD12 ILE 20 1.277 2.044 -0.115 739 HD13 ILE 20 HD13 ILE 20 2.222 3.360 0.615 740 H THR 21 H THR 21 -0.871 5.877 0.894 741 HA THR 21 HA THR 21 -2.916 6.571 2.944 742 HB THR 21 HB THR 21 -1.506 8.576 1.142 743 HG1 THR 21 HG1 THR 21 -1.358 8.183 3.940 744 HG21 THR 21 HG21 THR 21 -3.512 8.961 3.405 745 HG22 THR 21 HG22 THR 21 -2.713 10.258 2.489 746 HG23 THR 21 HG23 THR 21 -3.860 9.183 1.672 747 H ILE 22 H ILE 22 -4.954 6.977 2.116 748 HA ILE 22 HA ILE 22 -5.338 6.253 -0.743 749 HB ILE 22 HB ILE 22 -6.361 4.643 0.597 750 HG12 ILE 22 HG12 ILE 22 -8.719 4.803 0.221 751 HG13 ILE 22 HG13 ILE 22 -8.653 6.574 0.103 752 HG21 ILE 22 HG21 ILE 22 -7.477 6.864 2.339 753 HG22 ILE 22 HG22 ILE 22 -7.926 5.149 2.453 754 HG23 ILE 22 HG23 ILE 22 -6.258 5.648 2.778 755 HD11 ILE 22 HD11 ILE 22 -8.850 5.519 -2.089 756 HD12 ILE 22 HD12 ILE 22 -7.369 6.472 -1.921 757 HD13 ILE 22 HD13 ILE 22 -7.288 4.681 -1.828 758 H LEU 23 H LEU 23 -5.112 8.197 -1.756 759 HA LEU 23 HA LEU 23 -5.910 10.669 -0.592 760 HB2 LEU 23 HB2 LEU 23 -5.504 10.117 -3.547 761 HB3 LEU 23 HB3 LEU 23 -5.355 11.660 -2.700 762 HG LEU 23 HG LEU 23 -3.474 9.275 -2.569 763 HD11 LEU 23 HD11 LEU 23 -3.227 10.827 -4.489 764 HD12 LEU 23 HD12 LEU 23 -3.124 12.192 -3.361 765 HD13 LEU 23 HD13 LEU 23 -1.848 10.954 -3.378 766 HD21 LEU 23 HD21 LEU 23 -3.612 10.176 -0.288 767 HD22 LEU 23 HD22 LEU 23 -2.074 10.636 -1.059 768 HD23 LEU 23 HD23 LEU 23 -3.383 11.828 -0.923 769 H GLY 24 H GLY 24 -7.679 8.334 -2.610 770 HA2 GLY 24 HA2 GLY 24 -10.200 9.111 -1.913 771 HA3 GLY 24 HA3 GLY 24 -9.842 10.237 -3.201 772 H VAL 25 H VAL 25 -11.849 8.960 -4.018 773 HA VAL 25 HA VAL 25 -10.848 6.820 -5.819 774 HB VAL 25 HB VAL 25 -12.764 5.434 -5.463 775 HG11 VAL 25 HG11 VAL 25 -10.906 5.179 -3.818 776 HG12 VAL 25 HG12 VAL 25 -11.774 6.273 -2.711 777 HG13 VAL 25 HG13 VAL 25 -12.488 4.717 -3.157 778 HG21 VAL 25 HG21 VAL 25 -14.506 5.942 -3.792 779 HG22 VAL 25 HG22 VAL 25 -13.805 7.561 -3.565 780 HG23 VAL 25 HG23 VAL 25 -14.498 7.089 -5.140 781 H SER 26 H SER 26 -12.269 6.443 -7.669 782 HA SER 26 HA SER 26 -14.318 8.458 -8.285 783 HB2 SER 26 HB2 SER 26 -11.778 8.108 -9.923 784 HB3 SER 26 HB3 SER 26 -13.240 8.922 -10.508 785 HG SER 26 HG SER 26 -11.728 9.670 -8.221 786 H GLY 27 H GLY 27 -15.759 6.667 -8.222 787 HA2 GLY 27 HA2 GLY 27 -17.009 5.041 -9.317 788 HA3 GLY 27 HA3 GLY 27 -15.888 5.156 -10.684 789 H GLN 28 H GLN 28 -14.156 3.717 -10.848 790 HA GLN 28 HA GLN 28 -13.884 1.686 -8.658 791 HB2 GLN 28 HB2 GLN 28 -13.199 1.488 -11.618 792 HB3 GLN 28 HB3 GLN 28 -12.900 0.234 -10.409 793 HG2 GLN 28 HG2 GLN 28 -15.627 1.282 -11.229 794 HG3 GLN 28 HG3 GLN 28 -14.845 -0.215 -11.793 795 HE21 GLN 28 HE22 GLN 28 -15.854 1.405 -8.698 796 HE22 GLN 28 HE21 GLN 28 -16.276 -0.083 -7.883 797 H GLN 29 H GLN 29 -12.380 4.275 -10.430 798 HA GLN 29 HA GLN 29 -9.660 3.426 -9.992 799 HB2 GLN 29 HB2 GLN 29 -10.747 6.258 -10.250 800 HB3 GLN 29 HB3 GLN 29 -9.078 5.739 -10.485 801 HG2 GLN 29 HG2 GLN 29 -11.465 4.957 -12.202 802 HG3 GLN 29 HG3 GLN 29 -10.172 6.099 -12.622 803 HE21 GLN 29 HE22 GLN 29 -7.834 4.835 -11.979 804 HE22 GLN 29 HE21 GLN 29 -7.695 3.343 -12.887 805 H VAL 30 H VAL 30 -8.238 4.141 -8.386 806 HA VAL 30 HA VAL 30 -9.362 5.303 -5.904 807 HB VAL 30 HB VAL 30 -7.792 2.693 -6.119 808 HG11 VAL 30 HG11 VAL 30 -8.933 4.095 -3.670 809 HG12 VAL 30 HG12 VAL 30 -7.979 2.588 -3.709 810 HG13 VAL 30 HG13 VAL 30 -7.221 4.142 -4.141 811 HG21 VAL 30 HG21 VAL 30 -10.648 3.279 -5.224 812 HG22 VAL 30 HG22 VAL 30 -10.165 2.365 -6.672 813 HG23 VAL 30 HG23 VAL 30 -9.824 1.711 -5.056 814 H ARG 31 H ARG 31 -8.133 7.065 -5.687 815 HA ARG 31 HA ARG 31 -5.441 7.173 -6.833 816 HB2 ARG 31 HB2 ARG 31 -7.201 9.028 -6.869 817 HB3 ARG 31 HB3 ARG 31 -6.880 9.246 -5.135 818 HG2 ARG 31 HG2 ARG 31 -4.468 9.635 -5.674 819 HG3 ARG 31 HG3 ARG 31 -4.838 9.427 -7.404 820 HD2 ARG 31 HD2 ARG 31 -6.484 11.283 -7.246 821 HD3 ARG 31 HD3 ARG 31 -6.013 11.551 -5.556 822 HE ARG 31 HE ARG 31 -3.729 11.615 -7.327 823 HH11 ARG 31 HH11 ARG 31 -6.511 13.516 -6.248 824 HH12 ARG 31 HH12 ARG 31 -5.724 15.051 -6.528 825 HH21 ARG 31 HH21 ARG 31 -2.708 13.661 -7.638 826 HH22 ARG 31 HH22 ARG 31 -3.606 15.127 -7.354 827 H ILE 32 H ILE 32 -3.599 6.857 -5.694 828 HA ILE 32 HA ILE 32 -3.836 6.481 -2.741 829 HB ILE 32 HB ILE 32 -2.289 4.571 -4.517 830 HG12 ILE 32 HG12 ILE 32 -5.213 4.386 -3.712 831 HG13 ILE 32 HG13 ILE 32 -4.515 4.389 -5.340 832 HG21 ILE 32 HG21 ILE 32 -3.457 4.295 -1.715 833 HG22 ILE 32 HG22 ILE 32 -2.440 3.102 -2.549 834 HG23 ILE 32 HG23 ILE 32 -1.752 4.652 -2.081 835 HD11 ILE 32 HD11 ILE 32 -4.239 2.183 -3.262 836 HD12 ILE 32 HD12 ILE 32 -5.138 2.127 -4.787 837 HD13 ILE 32 HD13 ILE 32 -3.364 2.227 -4.818 838 H GLY 33 H GLY 33 -1.825 6.654 -1.602 839 HA2 GLY 33 HA2 GLY 33 0.415 7.847 -3.158 840 HA3 GLY 33 HA3 GLY 33 -0.142 8.561 -1.631 841 H ILE 34 H ILE 34 2.483 7.554 -2.197 842 HA ILE 34 HA ILE 34 2.739 5.432 -0.130 843 HB ILE 34 HB ILE 34 4.115 5.416 -2.855 844 HG12 ILE 34 HG12 ILE 34 1.933 3.526 -1.864 845 HG13 ILE 34 HG13 ILE 34 1.685 4.846 -3.023 846 HG21 ILE 34 HG21 ILE 34 5.472 4.479 -1.028 847 HG22 ILE 34 HG22 ILE 34 4.132 3.400 -0.572 848 HG23 ILE 34 HG23 ILE 34 4.958 3.197 -2.128 849 HD11 ILE 34 HD11 ILE 34 1.959 2.787 -4.253 850 HD12 ILE 34 HD12 ILE 34 3.365 3.837 -4.537 851 HD13 ILE 34 HD13 ILE 34 3.493 2.438 -3.433 852 H ASN 35 H ASN 35 4.623 5.640 1.079 853 HA ASN 35 HA ASN 35 6.431 7.869 0.325 854 HB2 ASN 35 HB2 ASN 35 4.485 8.664 1.721 855 HB3 ASN 35 HB3 ASN 35 5.044 7.620 3.025 856 HD21 ASN 35 HD22 ASN 35 4.768 10.575 2.925 857 HD22 ASN 35 HD21 ASN 35 6.363 11.237 3.213 858 H ALA 36 H ALA 36 8.258 6.768 0.123 859 HA ALA 36 HA ALA 36 9.332 5.352 2.482 860 HB1 ALA 36 HB1 ALA 36 8.265 3.573 1.139 861 HB2 ALA 36 HB2 ALA 36 9.126 4.141 -0.314 862 HB3 ALA 36 HB3 ALA 36 10.037 3.442 1.033 863 HA PRO 37 HA PRO 37 13.068 7.299 1.168 864 HB2 PRO 37 HB2 PRO 37 14.933 5.346 1.836 865 HB3 PRO 37 HB3 PRO 37 14.158 6.462 3.020 866 HG2 PRO 37 HG2 PRO 37 13.442 3.603 2.337 867 HG3 PRO 37 HG3 PRO 37 13.524 4.378 3.950 868 HD2 PRO 37 HD2 PRO 37 11.176 4.004 2.633 869 HD3 PRO 37 HD3 PRO 37 11.462 5.475 3.618 870 H LYS 38 H LYS 38 14.750 7.186 -0.461 871 HA LYS 38 HA LYS 38 14.076 5.555 -2.759 872 HB2 LYS 38 HB2 LYS 38 16.417 7.408 -2.123 873 HB3 LYS 38 HB3 LYS 38 16.155 6.660 -3.715 874 HG2 LYS 38 HG2 LYS 38 14.035 8.350 -2.322 875 HG3 LYS 38 HG3 LYS 38 15.235 9.041 -3.423 876 HD2 LYS 38 HD2 LYS 38 13.560 6.670 -4.311 877 HD3 LYS 38 HD3 LYS 38 12.864 8.291 -4.277 878 HE2 LYS 38 HE2 LYS 38 14.747 9.111 -5.691 879 HE3 LYS 38 HE3 LYS 38 15.434 7.476 -5.724 880 HZ1 LYS 38 HZ1 LYS 38 14.149 7.953 -7.684 881 HZ2 LYS 38 HZ2 LYS 38 13.422 6.745 -6.831 882 HZ3 LYS 38 HZ3 LYS 38 12.812 8.273 -6.781 883 H ASP 39 H ASP 39 15.531 4.818 0.045 884 HA ASP 39 HA ASP 39 17.611 2.986 -0.797 885 HB2 ASP 39 HB2 ASP 39 15.960 3.302 1.741 886 HB3 ASP 39 HB3 ASP 39 17.235 2.095 1.568 887 H VAL 40 H VAL 40 14.244 2.910 -1.182 888 HA VAL 40 HA VAL 40 14.317 -0.027 -1.635 889 HB VAL 40 HB VAL 40 12.098 -0.277 -0.647 890 HG11 VAL 40 HG11 VAL 40 13.937 1.157 1.311 891 HG12 VAL 40 HG12 VAL 40 12.658 0.004 1.715 892 HG13 VAL 40 HG13 VAL 40 14.097 -0.556 0.835 893 HG21 VAL 40 HG21 VAL 40 11.317 2.064 -1.084 894 HG22 VAL 40 HG22 VAL 40 10.994 1.487 0.568 895 HG23 VAL 40 HG23 VAL 40 12.352 2.595 0.275 896 H ALA 41 H ALA 41 12.299 -0.681 -2.942 897 HA ALA 41 HA ALA 41 12.028 1.384 -5.067 898 HB1 ALA 41 HB1 ALA 41 11.692 -0.527 -6.587 899 HB2 ALA 41 HB2 ALA 41 13.207 -0.724 -5.677 900 HB3 ALA 41 HB3 ALA 41 11.760 -1.652 -5.216 901 H VAL 42 H VAL 42 10.011 1.560 -6.226 902 HA VAL 42 HA VAL 42 7.679 0.091 -5.287 903 HB VAL 42 HB VAL 42 7.469 1.667 -3.595 904 HG11 VAL 42 HG11 VAL 42 8.486 3.754 -5.541 905 HG12 VAL 42 HG12 VAL 42 7.794 4.127 -3.935 906 HG13 VAL 42 HG13 VAL 42 9.266 3.148 -4.063 907 HG21 VAL 42 HG21 VAL 42 5.424 1.566 -4.990 908 HG22 VAL 42 HG22 VAL 42 5.637 3.159 -4.224 909 HG23 VAL 42 HG23 VAL 42 6.009 2.956 -5.940 910 H HIS 43 H HIS 43 6.429 -0.296 -6.974 911 HA HIS 43 HA HIS 43 6.116 1.628 -9.163 912 HB2 HIS 43 HB2 HIS 43 7.046 -1.179 -9.860 913 HB3 HIS 43 HB3 HIS 43 6.959 0.247 -10.893 914 HD2 HIS 43 HD2 HIS 43 9.162 -1.401 -8.193 915 HE1 HIS 43 HE1 HIS 43 11.505 1.645 -10.002 916 HE2 HIS 43 HE2 HIS 43 11.534 -0.293 -8.368 917 H ARG 44 H ARG 44 4.546 0.516 -10.903 918 HA ARG 44 HA ARG 44 2.450 -0.838 -9.340 919 HB2 ARG 44 HB2 ARG 44 1.097 -0.592 -11.385 920 HB3 ARG 44 HB3 ARG 44 1.763 0.945 -10.812 921 HG2 ARG 44 HG2 ARG 44 3.593 0.732 -12.519 922 HG3 ARG 44 HG3 ARG 44 2.789 -0.732 -13.141 923 HD2 ARG 44 HD2 ARG 44 0.753 0.578 -13.600 924 HD3 ARG 44 HD3 ARG 44 1.519 2.027 -12.922 925 HE ARG 44 HE ARG 44 2.981 2.157 -14.784 926 HH11 ARG 44 HH11 ARG 44 0.567 -0.412 -15.119 927 HH12 ARG 44 HH12 ARG 44 0.904 -0.650 -16.818 928 HH21 ARG 44 HH21 ARG 44 3.324 1.874 -17.013 929 HH22 ARG 44 HH22 ARG 44 2.424 0.660 -17.890 930 H GLU 45 H GLU 45 1.369 -2.793 -10.490 931 HA GLU 45 HA GLU 45 3.276 -4.832 -10.225 932 HB2 GLU 45 HB2 GLU 45 0.752 -4.827 -9.875 933 HB3 GLU 45 HB3 GLU 45 0.574 -5.108 -11.605 934 HG2 GLU 45 HG2 GLU 45 2.197 -6.879 -9.723 935 HG3 GLU 45 HG3 GLU 45 0.489 -7.148 -10.088 936 H GLU 46 H GLU 46 2.444 -2.981 -13.080 937 HA GLU 46 HA GLU 46 3.309 -4.956 -15.004 938 HB2 GLU 46 HB2 GLU 46 1.773 -3.045 -15.500 939 HB3 GLU 46 HB3 GLU 46 3.122 -1.922 -15.188 940 HG2 GLU 46 HG2 GLU 46 4.412 -3.031 -17.029 941 HG3 GLU 46 HG3 GLU 46 3.033 -4.095 -17.335 942 H ILE 47 H ILE 47 4.880 -2.089 -13.463 943 HA ILE 47 HA ILE 47 7.308 -2.401 -15.025 944 HB ILE 47 HB ILE 47 6.410 -0.691 -12.699 945 HG12 ILE 47 HG12 ILE 47 6.886 1.155 -14.247 946 HG13 ILE 47 HG13 ILE 47 7.508 0.017 -15.445 947 HG21 ILE 47 HG21 ILE 47 8.773 -1.171 -12.210 948 HG22 ILE 47 HG22 ILE 47 9.219 -0.803 -13.888 949 HG23 ILE 47 HG23 ILE 47 8.611 0.481 -12.828 950 HD11 ILE 47 HD11 ILE 47 5.289 -0.927 -15.785 951 HD12 ILE 47 HD12 ILE 47 4.633 0.044 -14.441 952 HD13 ILE 47 HD13 ILE 47 5.194 0.832 -15.936 953 H TYR 48 H TYR 48 6.062 -3.679 -11.995 954 HA TYR 48 HA TYR 48 8.521 -4.215 -10.705 955 HB2 TYR 48 HB2 TYR 48 6.260 -4.269 -9.688 956 HB3 TYR 48 HB3 TYR 48 5.885 -5.727 -10.613 957 HD1 TYR 48 HD1 TYR 48 8.213 -4.347 -8.024 958 HD2 TYR 48 HD2 TYR 48 6.513 -7.865 -9.826 959 HE1 TYR 48 HE1 TYR 48 9.132 -5.718 -6.184 960 HE2 TYR 48 HE2 TYR 48 7.392 -9.244 -7.987 961 HH TYR 48 HH TYR 48 9.276 -7.818 -5.273 962 H GLN 49 H GLN 49 6.815 -5.940 -13.301 963 HA GLN 49 HA GLN 49 8.302 -8.396 -12.994 964 HB2 GLN 49 HB2 GLN 49 6.655 -7.229 -15.273 965 HB3 GLN 49 HB3 GLN 49 7.307 -8.882 -15.259 966 HG2 GLN 49 HG2 GLN 49 6.003 -9.449 -13.281 967 HG3 GLN 49 HG3 GLN 49 5.464 -7.782 -13.095 968 HE21 GLN 49 HE22 GLN 49 3.244 -8.400 -13.233 969 HE22 GLN 49 HE21 GLN 49 2.504 -8.822 -14.749 970 H ARG 50 H ARG 50 8.967 -5.325 -14.543 971 HA ARG 50 HA ARG 50 10.982 -6.338 -16.406 972 HB2 ARG 50 HB2 ARG 50 10.152 -3.600 -15.368 973 HB3 ARG 50 HB3 ARG 50 11.605 -3.801 -16.332 974 HG2 ARG 50 HG2 ARG 50 9.793 -3.144 -17.784 975 HG3 ARG 50 HG3 ARG 50 10.246 -4.812 -18.170 976 HD2 ARG 50 HD2 ARG 50 8.342 -5.667 -16.901 977 HD3 ARG 50 HD3 ARG 50 7.935 -4.035 -16.342 978 HE ARG 50 HE ARG 50 7.455 -5.205 -19.009 979 HH11 ARG 50 HH11 ARG 50 7.496 -2.245 -17.060 980 HH12 ARG 50 HH12 ARG 50 6.370 -1.415 -18.109 981 HH21 ARG 50 HH21 ARG 50 6.004 -4.080 -20.346 982 HH22 ARG 50 HH22 ARG 50 5.540 -2.440 -19.948 983 H ILE 51 H ILE 51 10.785 -5.712 -13.053 984 HA ILE 51 HA ILE 51 13.691 -5.185 -12.811 985 HB ILE 51 HB ILE 51 11.339 -4.920 -10.901 986 HG12 ILE 51 HG12 ILE 51 13.110 -2.857 -12.292 987 HG13 ILE 51 HG13 ILE 51 11.494 -3.323 -12.847 988 HG21 ILE 51 HG21 ILE 51 14.242 -4.117 -10.532 989 HG22 ILE 51 HG22 ILE 51 12.910 -3.832 -9.374 990 HG23 ILE 51 HG23 ILE 51 13.454 -5.483 -9.712 991 HD11 ILE 51 HD11 ILE 51 12.153 -2.040 -10.180 992 HD12 ILE 51 HD12 ILE 51 11.340 -1.281 -11.580 993 HD13 ILE 51 HD13 ILE 51 10.535 -2.597 -10.696 994 H GLN 52 H GLN 52 11.117 -7.388 -11.522 995 HA GLN 52 HA GLN 52 13.008 -8.964 -10.053 996 HB2 GLN 52 HB2 GLN 52 10.163 -9.550 -10.971 997 HB3 GLN 52 HB3 GLN 52 11.084 -10.557 -9.841 998 HG2 GLN 52 HG2 GLN 52 10.138 -7.706 -9.442 999 HG3 GLN 52 HG3 GLN 52 9.758 -9.151 -8.490 1000 HE21 GLN 52 HE22 GLN 52 11.629 -6.358 -8.591 1001 HE22 GLN 52 HE21 GLN 52 12.898 -6.821 -7.480 1002 H ALA 53 H ALA 53 12.876 -8.611 -13.314 1003 HA ALA 53 HA ALA 53 13.142 -11.305 -14.243 1004 HB1 ALA 53 HB1 ALA 53 14.114 -10.211 -16.230 1005 HB2 ALA 53 HB2 ALA 53 12.645 -9.373 -15.687 1006 HB3 ALA 53 HB3 ALA 53 14.250 -8.684 -15.332 1007 H GLY 54 H GLY 54 15.273 -9.273 -12.342 1008 HA2 GLY 54 HA2 GLY 54 17.037 -11.143 -11.560 1009 HA3 GLY 54 HA3 GLY 54 17.684 -10.755 -13.160 1010 H LEU 55 H LEU 55 16.174 -8.080 -11.364 1011 HA LEU 55 HA LEU 55 18.752 -7.125 -10.374 1012 HB2 LEU 55 HB2 LEU 55 18.743 -5.178 -12.010 1013 HB3 LEU 55 HB3 LEU 55 19.147 -6.761 -12.667 1014 HG LEU 55 HG LEU 55 16.716 -6.980 -13.434 1015 HD11 LEU 55 HD11 LEU 55 16.736 -3.980 -12.860 1016 HD12 LEU 55 HD12 LEU 55 15.502 -4.864 -13.795 1017 HD13 LEU 55 HD13 LEU 55 15.689 -5.183 -12.066 1018 HD21 LEU 55 HD21 LEU 55 18.453 -4.761 -14.559 1019 HD22 LEU 55 HD22 LEU 55 18.583 -6.509 -14.906 1020 HD23 LEU 55 HD23 LEU 55 17.141 -5.607 -15.417 1021 H THR 56 H THR 56 18.497 -4.589 -9.997 1022 HA THR 56 HA THR 56 15.756 -3.826 -9.228 1023 HB THR 56 HB THR 56 16.717 -2.939 -7.021 1024 HG1 THR 56 HG1 THR 56 18.488 -4.127 -6.260 1025 HG21 THR 56 HG21 THR 56 16.519 -5.958 -7.340 1026 HG22 THR 56 HG22 THR 56 16.222 -5.007 -5.870 1027 HG23 THR 56 HG23 THR 56 15.133 -4.837 -7.264 1028 H ALA 57 H ALA 57 18.295 -3.146 -11.047 1029 HA ALA 57 HA ALA 57 17.719 -0.262 -11.000 1030 HB1 ALA 57 HB1 ALA 57 20.531 -1.387 -10.691 1031 HB2 ALA 57 HB2 ALA 57 20.122 0.313 -10.993 1032 HB3 ALA 57 HB3 ALA 57 19.620 -0.459 -9.473 1033 HA PRO 58 HA PRO 58 17.563 -1.377 -15.368 1034 HB2 PRO 58 HB2 PRO 58 17.960 1.627 -15.399 1035 HB3 PRO 58 HB3 PRO 58 16.902 0.647 -16.451 1036 HG2 PRO 58 HG2 PRO 58 15.838 1.945 -14.339 1037 HG3 PRO 58 HG3 PRO 58 15.406 0.212 -14.591 1038 HD2 PRO 58 HD2 PRO 58 17.447 1.384 -12.678 1039 HD3 PRO 58 HD3 PRO 58 16.242 0.082 -12.398 1040 H ASP 59 H ASP 59 20.044 0.750 -13.925 1041 HA ASP 59 HA ASP 59 22.160 -0.327 -15.576 1042 HB2 ASP 59 HB2 ASP 59 20.971 1.094 -17.200 1043 HB3 ASP 59 HB3 ASP 59 21.118 2.484 -16.127 1044 H5' U 36 H5' U 36 -18.548 -3.846 7.649 1045 H5'' U 36 H5'' U 36 -17.704 -3.939 6.090 1046 H4' U 36 H4' U 36 -16.784 -5.294 8.664 1047 H3' U 36 H3' U 36 -16.628 -2.544 7.900 1048 H2' U 36 H2' U 36 -14.467 -2.286 7.005 1049 HO2' U 36 HO2' U 36 -13.458 -2.987 8.928 1050 H1' U 36 H1' U 36 -13.842 -4.763 6.104 1051 H3 U 36 H3 U 36 -16.264 -5.095 2.162 1052 H5 U 36 H5 U 36 -16.808 -1.195 3.609 1053 H6 U 36 H6 U 36 -15.805 -1.873 5.688 1054 HO5' U 36 HO5' U 36 -17.942 -6.214 6.206 1055 H5' C 37 H5' C 37 -13.323 -1.800 12.357 1056 H5'' C 37 H5'' C 37 -13.553 -3.343 11.533 1057 H4' C 37 H4' C 37 -14.372 -2.656 14.391 1058 H3' C 37 H3' C 37 -11.898 -3.350 13.586 1059 H2' C 37 H2' C 37 -12.539 -5.079 12.126 1060 HO2' C 37 HO2' C 37 -10.998 -5.990 13.544 1061 H1' C 37 H1' C 37 -14.322 -6.282 14.234 1062 H41 C 37 H41 C 37 -16.626 -9.390 9.187 1063 H42 C 37 H42 C 37 -15.966 -8.200 8.080 1064 H5 C 37 H5 C 37 -14.781 -6.192 8.835 1065 H6 C 37 H6 C 37 -14.018 -4.978 10.762 1066 H5' A 38 H5' A 38 -10.661 -6.070 15.715 1067 H5'' A 38 H5'' A 38 -9.476 -5.564 16.917 1068 H4' A 38 H4' A 38 -8.491 -6.939 15.077 1069 H3' A 38 H3' A 38 -7.285 -4.792 16.242 1070 H2' A 38 H2' A 38 -8.273 -3.179 14.748 1071 HO2' A 38 HO2' A 38 -5.752 -3.915 13.648 1072 H1' A 38 H1' A 38 -7.466 -4.984 12.462 1073 H8 A 38 H8 A 38 -9.834 -2.227 13.745 1074 H61 A 38 H61 A 38 -11.068 -1.226 7.757 1075 H62 A 38 H62 A 38 -11.405 -0.702 9.400 1076 H2 A 38 H2 A 38 -8.533 -4.850 8.032 1077 H5' G 39 H5' G 39 -7.629 -8.151 13.640 1078 H5'' G 39 H5'' G 39 -7.272 -9.501 14.728 1079 H4' G 39 H4' G 39 -7.450 -10.469 12.577 1080 H3' G 39 H3' G 39 -5.105 -10.888 13.809 1081 H2' G 39 H2' G 39 -3.967 -8.938 13.110 1082 HO2' G 39 HO2' G 39 -3.476 -10.889 11.127 1083 H1' G 39 H1' G 39 -4.881 -8.999 10.281 1084 H8 G 39 H8 G 39 -6.848 -6.433 10.960 1085 H1 G 39 H1 G 39 -1.070 -4.296 12.736 1086 H21 G 39 H21 G 39 0.325 -5.968 12.964 1087 H22 G 39 H22 G 39 -0.152 -7.629 12.666 1088 H5' G 40 H5' G 40 -4.370 -12.175 9.199 1089 H5'' G 40 H5'' G 40 -3.858 -13.852 9.342 1090 H4' G 40 H4' G 40 -2.569 -12.563 7.661 1091 H3' G 40 H3' G 40 -1.576 -14.411 9.548 1092 H2' G 40 H2' G 40 -0.562 -12.591 10.816 1093 HO2' G 40 HO2' G 40 1.281 -13.522 8.848 1094 H1' G 40 H1' G 40 0.078 -11.478 8.069 1095 H8 G 40 H8 G 40 -0.871 -10.019 11.564 1096 H1 G 40 H1 G 40 4.661 -7.923 9.059 1097 H21 G 40 H21 G 40 5.064 -8.975 7.132 1098 H22 G 40 H22 G 40 3.939 -10.120 6.461 1099 H5' A 41 H5' A 41 -2.490 -15.187 4.924 1100 H5'' A 41 H5'' A 41 -2.956 -13.829 5.976 1101 H4' A 41 H4' A 41 -4.450 -16.474 5.789 1102 H3' A 41 H3' A 41 -4.741 -13.968 4.136 1103 H2' A 41 H2' A 41 -7.032 -13.817 4.483 1104 HO2' A 41 HO2' A 41 -7.509 -15.984 3.968 1105 H1' A 41 H1' A 41 -7.222 -14.736 7.065 1106 H8 A 41 H8 A 41 -4.846 -12.188 5.296 1107 H61 A 41 H61 A 41 -7.446 -8.113 9.205 1108 H62 A 41 H62 A 41 -6.354 -8.275 7.842 1109 H2 A 41 H2 A 41 -9.010 -12.122 10.181 1110 H5' C 42 H5' C 42 -6.156 -13.882 -0.126 1111 H5'' C 42 H5'' C 42 -5.387 -12.479 0.615 1112 H4' C 42 H4' C 42 -7.467 -13.122 2.378 1113 H3' C 42 H3' C 42 -8.411 -14.394 0.174 1114 H2' C 42 H2' C 42 -8.227 -12.831 -1.598 1115 HO2' C 42 HO2' C 42 -10.377 -12.086 -0.083 1116 H1' C 42 H1' C 42 -8.274 -10.296 -0.242 1117 H41 C 42 H41 C 42 -2.999 -9.227 -3.490 1118 H42 C 42 H42 C 42 -3.019 -10.867 -4.116 1119 H5 C 42 H5 C 42 -4.551 -12.577 -3.270 1120 H6 C 42 H6 C 42 -6.393 -12.989 -1.751 1121 H5' A 43 H5' A 43 -11.168 -11.552 1.835 1122 H5'' A 43 H5'' A 43 -12.433 -11.439 3.025 1123 H4' A 43 H4' A 43 -13.421 -11.311 0.791 1124 H3' A 43 H3' A 43 -14.499 -13.114 2.521 1125 H2' A 43 H2' A 43 -12.906 -14.836 1.838 1126 HO2' A 43 HO2' A 43 -14.221 -16.360 0.730 1127 H1' A 43 H1' A 43 -13.697 -14.117 -0.996 1128 H8 A 43 H8 A 43 -10.564 -13.787 -1.683 1129 H61 A 43 H61 A 43 -9.012 -19.781 -1.263 1130 H62 A 43 H62 A 43 -8.524 -18.213 -1.885 1131 H2 A 43 H2 A 43 -12.862 -19.202 0.873 1132 H5' U 44 H5' U 44 -16.428 -10.989 -2.614 1133 H5'' U 44 H5'' U 44 -15.798 -12.584 -2.191 1134 H4' U 44 H4' U 44 -14.749 -11.949 -4.234 1135 H3' U 44 H3' U 44 -13.158 -12.071 -1.774 1136 HO3' U 44 HO3' U 44 -12.759 -13.150 -4.379 1137 H2' U 44 H2' U 44 -11.237 -10.918 -2.572 1138 HO2' U 44 HO2' U 44 -11.092 -11.966 -4.600 1139 H1' U 44 H1' U 44 -12.436 -8.946 -3.874 1140 H3 U 44 H3 U 44 -14.778 -6.624 -0.527 1141 H5 U 44 H5 U 44 -12.365 -9.495 1.352 1142 H6 U 44 H6 U 44 -11.932 -10.487 -0.782 Start of MODEL 6 1 H1 MET 1 H1 MET 1 8.496 10.149 -0.869 2 H2 MET 1 H2 MET 1 8.698 10.694 -2.409 3 H3 MET 1 H3 MET 1 8.624 9.075 -2.110 4 HA MET 1 HA MET 1 6.367 9.231 -1.404 5 HB2 MET 1 HB2 MET 1 6.515 11.577 -0.555 6 HB3 MET 1 HB3 MET 1 6.684 12.151 -2.223 7 HG2 MET 1 HG2 MET 1 4.398 12.478 -1.555 8 HG3 MET 1 HG3 MET 1 4.440 11.199 -2.754 9 HE1 MET 1 HE1 MET 1 2.013 11.884 -1.097 10 HE2 MET 1 HE2 MET 1 2.004 10.460 -2.162 11 HE3 MET 1 HE3 MET 1 1.413 10.311 -0.489 12 H LEU 2 H LEU 2 4.897 8.514 -2.932 13 HA LEU 2 HA LEU 2 5.262 9.413 -5.728 14 HB2 LEU 2 HB2 LEU 2 6.014 6.860 -4.659 15 HB3 LEU 2 HB3 LEU 2 4.550 6.608 -5.622 16 HG LEU 2 HG LEU 2 7.213 7.732 -6.502 17 HD11 LEU 2 HD11 LEU 2 6.969 5.291 -6.323 18 HD12 LEU 2 HD12 LEU 2 5.575 5.342 -7.427 19 HD13 LEU 2 HD13 LEU 2 7.198 5.818 -8.001 20 HD21 LEU 2 HD21 LEU 2 5.501 9.063 -7.687 21 HD22 LEU 2 HD22 LEU 2 6.244 7.900 -8.785 22 HD23 LEU 2 HD23 LEU 2 4.628 7.565 -8.124 23 H ILE 3 H ILE 3 3.292 9.249 -6.959 24 HA ILE 3 HA ILE 3 0.869 8.384 -5.475 25 HB ILE 3 HB ILE 3 1.133 11.035 -6.973 26 HG12 ILE 3 HG12 ILE 3 0.168 11.911 -4.751 27 HG13 ILE 3 HG13 ILE 3 0.717 10.401 -4.022 28 HG21 ILE 3 HG21 ILE 3 -1.232 9.633 -5.661 29 HG22 ILE 3 HG22 ILE 3 -1.249 11.295 -6.270 30 HG23 ILE 3 HG23 ILE 3 -1.018 9.954 -7.406 31 HD11 ILE 3 HD11 ILE 3 2.406 12.524 -5.435 32 HD12 ILE 3 HD12 ILE 3 2.298 12.251 -3.681 33 HD13 ILE 3 HD13 ILE 3 3.069 11.032 -4.714 34 H LEU 4 H LEU 4 -0.569 7.324 -6.726 35 HA LEU 4 HA LEU 4 -0.743 7.656 -9.569 36 HB2 LEU 4 HB2 LEU 4 -0.217 5.118 -9.961 37 HB3 LEU 4 HB3 LEU 4 1.065 6.326 -9.953 38 HG LEU 4 HG LEU 4 1.635 5.734 -7.608 39 HD11 LEU 4 HD11 LEU 4 0.890 3.556 -6.757 40 HD12 LEU 4 HD12 LEU 4 -0.480 4.689 -6.875 41 HD13 LEU 4 HD13 LEU 4 -0.264 3.402 -8.101 42 HD21 LEU 4 HD21 LEU 4 1.676 3.469 -9.640 43 HD22 LEU 4 HD22 LEU 4 2.823 4.828 -9.567 44 HD23 LEU 4 HD23 LEU 4 2.760 3.643 -8.242 45 H THR 5 H THR 5 -2.378 6.035 -10.516 46 HA THR 5 HA THR 5 -4.463 5.610 -8.413 47 HB THR 5 HB THR 5 -5.111 6.191 -11.314 48 HG1 THR 5 HG1 THR 5 -3.807 7.895 -10.556 49 HG21 THR 5 HG21 THR 5 -7.201 6.951 -10.438 50 HG22 THR 5 HG22 THR 5 -6.871 5.381 -9.694 51 HG23 THR 5 HG23 THR 5 -6.607 6.880 -8.765 52 H ARG 6 H ARG 6 -5.853 3.813 -8.683 53 HA ARG 6 HA ARG 6 -5.010 1.668 -10.568 54 HB2 ARG 6 HB2 ARG 6 -3.673 1.630 -8.341 55 HB3 ARG 6 HB3 ARG 6 -5.222 1.404 -7.532 56 HG2 ARG 6 HG2 ARG 6 -4.376 -0.747 -7.652 57 HG3 ARG 6 HG3 ARG 6 -5.484 -0.709 -9.028 58 HD2 ARG 6 HD2 ARG 6 -2.456 -0.349 -9.092 59 HD3 ARG 6 HD3 ARG 6 -3.346 -1.784 -9.605 60 HE ARG 6 HE ARG 6 -4.254 -0.534 -11.477 61 HH11 ARG 6 HH11 ARG 6 -1.644 1.069 -9.705 62 HH12 ARG 6 HH12 ARG 6 -1.286 2.176 -11.006 63 HH21 ARG 6 HH21 ARG 6 -3.683 0.818 -13.188 64 HH22 ARG 6 HH22 ARG 6 -2.420 2.018 -12.997 65 H LYS 7 H LYS 7 -6.565 0.016 -10.827 66 HA LYS 7 HA LYS 7 -9.244 0.786 -9.769 67 HB2 LYS 7 HB2 LYS 7 -8.392 -0.530 -12.369 68 HB3 LYS 7 HB3 LYS 7 -10.000 -0.785 -11.645 69 HG2 LYS 7 HG2 LYS 7 -9.997 1.846 -11.449 70 HG3 LYS 7 HG3 LYS 7 -8.866 1.713 -12.813 71 HD2 LYS 7 HD2 LYS 7 -11.684 0.550 -12.611 72 HD3 LYS 7 HD3 LYS 7 -11.191 1.952 -13.573 73 HE2 LYS 7 HE2 LYS 7 -9.658 0.425 -14.867 74 HE3 LYS 7 HE3 LYS 7 -10.310 -0.943 -13.938 75 HZ1 LYS 7 HZ1 LYS 7 -11.415 -0.689 -16.049 76 HZ2 LYS 7 HZ2 LYS 7 -12.473 -0.436 -14.825 77 HZ3 LYS 7 HZ3 LYS 7 -11.881 0.841 -15.676 78 H VAL 8 H VAL 8 -10.722 -0.943 -9.335 79 HA VAL 8 HA VAL 8 -9.561 -2.654 -7.405 80 HB VAL 8 HB VAL 8 -11.736 -3.645 -7.134 81 HG11 VAL 8 HG11 VAL 8 -11.265 -1.351 -6.258 82 HG12 VAL 8 HG12 VAL 8 -11.939 -0.660 -7.748 83 HG13 VAL 8 HG13 VAL 8 -12.987 -1.585 -6.651 84 HG21 VAL 8 HG21 VAL 8 -12.477 -3.915 -9.453 85 HG22 VAL 8 HG22 VAL 8 -13.656 -3.004 -8.489 86 HG23 VAL 8 HG23 VAL 8 -12.602 -2.142 -9.635 87 H GLY 9 H GLY 9 -8.877 -4.714 -7.368 88 HA2 GLY 9 HA2 GLY 9 -8.673 -6.935 -8.146 89 HA3 GLY 9 HA3 GLY 9 -9.302 -6.441 -9.729 90 H GLU 10 H GLU 10 -7.017 -4.138 -8.903 91 HA GLU 10 HA GLU 10 -4.890 -5.590 -10.413 92 HB2 GLU 10 HB2 GLU 10 -5.397 -2.613 -10.103 93 HB3 GLU 10 HB3 GLU 10 -4.084 -3.344 -11.035 94 HG2 GLU 10 HG2 GLU 10 -7.067 -3.694 -11.569 95 HG3 GLU 10 HG3 GLU 10 -5.958 -2.666 -12.482 96 H SER 11 H SER 11 -2.630 -4.256 -9.834 97 HA SER 11 HA SER 11 -2.392 -4.346 -6.864 98 HB2 SER 11 HB2 SER 11 -0.716 -6.012 -8.775 99 HB3 SER 11 HB3 SER 11 -0.557 -5.938 -7.009 100 HG SER 11 HG SER 11 -1.779 -7.738 -7.686 101 H ILE 12 H ILE 12 -0.212 -3.833 -6.129 102 HA ILE 12 HA ILE 12 1.459 -2.108 -7.852 103 HB ILE 12 HB ILE 12 0.305 -1.277 -5.142 104 HG12 ILE 12 HG12 ILE 12 -0.246 -0.206 -7.937 105 HG13 ILE 12 HG13 ILE 12 -1.376 -1.133 -6.938 106 HG21 ILE 12 HG21 ILE 12 1.447 0.884 -5.553 107 HG22 ILE 12 HG22 ILE 12 2.612 -0.424 -5.505 108 HG23 ILE 12 HG23 ILE 12 2.104 0.260 -7.072 109 HD11 ILE 12 HD11 ILE 12 -1.311 0.672 -5.218 110 HD12 ILE 12 HD12 ILE 12 -0.314 1.650 -6.332 111 HD13 ILE 12 HD13 ILE 12 -1.962 1.197 -6.786 112 H ASN 13 H ASN 13 3.633 -1.740 -6.622 113 HA ASN 13 HA ASN 13 4.172 -4.013 -4.775 114 HB2 ASN 13 HB2 ASN 13 5.667 -3.408 -7.352 115 HB3 ASN 13 HB3 ASN 13 6.135 -4.624 -6.161 116 HD21 ASN 13 HD22 ASN 13 4.830 -6.580 -5.974 117 HD22 ASN 13 HD21 ASN 13 3.680 -6.996 -7.234 118 H ILE 14 H ILE 14 6.076 -3.852 -3.562 119 HA ILE 14 HA ILE 14 7.540 -1.273 -3.602 120 HB ILE 14 HB ILE 14 6.276 -2.470 -1.111 121 HG12 ILE 14 HG12 ILE 14 5.561 0.048 -2.677 122 HG13 ILE 14 HG13 ILE 14 4.573 -1.419 -2.559 123 HG21 ILE 14 HG21 ILE 14 7.116 -0.443 0.008 124 HG22 ILE 14 HG22 ILE 14 8.447 -1.342 -0.705 125 HG23 ILE 14 HG23 ILE 14 7.830 0.116 -1.522 126 HD11 ILE 14 HD11 ILE 14 5.254 0.492 -0.297 127 HD12 ILE 14 HD12 ILE 14 3.677 0.226 -1.053 128 HD13 ILE 14 HD13 ILE 14 4.418 -1.071 -0.086 129 H GLY 15 H GLY 15 9.654 -1.461 -2.768 130 HA2 GLY 15 HA2 GLY 15 11.670 -2.568 -2.521 131 HA3 GLY 15 HA3 GLY 15 10.785 -3.634 -1.417 132 H ASP 16 H ASP 16 11.692 -5.569 -2.011 133 HA ASP 16 HA ASP 16 10.903 -6.566 -4.687 134 HB2 ASP 16 HB2 ASP 16 12.961 -7.813 -4.891 135 HB3 ASP 16 HB3 ASP 16 13.321 -6.099 -4.702 136 H ASP 17 H ASP 17 10.051 -6.652 -1.651 137 HA ASP 17 HA ASP 17 9.336 -9.521 -1.722 138 HB2 ASP 17 HB2 ASP 17 10.502 -8.072 0.689 139 HB3 ASP 17 HB3 ASP 17 9.784 -9.685 0.717 140 H ILE 18 H ILE 18 8.052 -6.530 -1.914 141 HA ILE 18 HA ILE 18 5.774 -7.316 -0.162 142 HB ILE 18 HB ILE 18 6.760 -4.473 -0.562 143 HG12 ILE 18 HG12 ILE 18 6.988 -4.831 2.078 144 HG13 ILE 18 HG13 ILE 18 7.308 -6.504 1.596 145 HG21 ILE 18 HG21 ILE 18 4.564 -5.695 1.163 146 HG22 ILE 18 HG22 ILE 18 5.115 -4.006 1.249 147 HG23 ILE 18 HG23 ILE 18 4.352 -4.603 -0.229 148 HD11 ILE 18 HD11 ILE 18 9.385 -5.134 1.791 149 HD12 ILE 18 HD12 ILE 18 9.155 -5.696 0.124 150 HD13 ILE 18 HD13 ILE 18 8.746 -4.018 0.559 151 H THR 19 H THR 19 3.746 -6.946 -0.929 152 HA THR 19 HA THR 19 3.403 -5.617 -3.557 153 HB THR 19 HB THR 19 2.455 -8.430 -2.874 154 HG1 THR 19 HG1 THR 19 4.619 -8.304 -3.503 155 HG21 THR 19 HG21 THR 19 1.683 -8.441 -5.266 156 HG22 THR 19 HG22 THR 19 0.750 -7.347 -4.231 157 HG23 THR 19 HG23 THR 19 1.981 -6.689 -5.334 158 H ILE 20 H ILE 20 1.208 -5.008 -3.946 159 HA ILE 20 HA ILE 20 -0.611 -4.988 -1.587 160 HB ILE 20 HB ILE 20 0.106 -2.642 -3.399 161 HG12 ILE 20 HG12 ILE 20 1.857 -3.144 -1.717 162 HG13 ILE 20 HG13 ILE 20 1.094 -1.564 -1.499 163 HG21 ILE 20 HG21 ILE 20 -2.236 -2.529 -2.799 164 HG22 ILE 20 HG22 ILE 20 -1.867 -2.874 -1.093 165 HG23 ILE 20 HG23 ILE 20 -1.354 -1.338 -1.826 166 HD11 ILE 20 HD11 ILE 20 0.339 -4.048 0.090 167 HD12 ILE 20 HD12 ILE 20 1.461 -2.784 0.644 168 HD13 ILE 20 HD13 ILE 20 -0.252 -2.394 0.352 169 H THR 21 H THR 21 -2.816 -5.066 -2.168 170 HA THR 21 HA THR 21 -3.448 -5.187 -5.066 171 HB THR 21 HB THR 21 -4.225 -7.369 -3.082 172 HG1 THR 21 HG1 THR 21 -2.743 -8.616 -4.254 173 HG21 THR 21 HG21 THR 21 -4.462 -7.173 -6.120 174 HG22 THR 21 HG22 THR 21 -4.951 -8.561 -5.109 175 HG23 THR 21 HG23 THR 21 -5.805 -7.010 -4.976 176 H ILE 22 H ILE 22 -5.151 -3.900 -5.398 177 HA ILE 22 HA ILE 22 -6.896 -3.109 -3.192 178 HB ILE 22 HB ILE 22 -6.306 -1.382 -4.667 179 HG12 ILE 22 HG12 ILE 22 -8.375 -0.649 -5.739 180 HG13 ILE 22 HG13 ILE 22 -9.063 -2.282 -5.586 181 HG21 ILE 22 HG21 ILE 22 -6.670 -1.437 -7.112 182 HG22 ILE 22 HG22 ILE 22 -5.448 -2.599 -6.569 183 HG23 ILE 22 HG23 ILE 22 -7.085 -3.157 -7.008 184 HD11 ILE 22 HD11 ILE 22 -8.223 -0.509 -3.279 185 HD12 ILE 22 HD12 ILE 22 -9.895 -0.815 -3.832 186 HD13 ILE 22 HD13 ILE 22 -8.931 -2.148 -3.154 187 H LEU 23 H LEU 23 -8.290 -4.652 -2.485 188 HA LEU 23 HA LEU 23 -9.204 -6.751 -4.231 189 HB2 LEU 23 HB2 LEU 23 -10.317 -5.988 -1.511 190 HB3 LEU 23 HB3 LEU 23 -10.452 -7.544 -2.336 191 HG LEU 23 HG LEU 23 -7.999 -6.306 -1.058 192 HD11 LEU 23 HD11 LEU 23 -9.555 -7.555 0.394 193 HD12 LEU 23 HD12 LEU 23 -9.473 -8.953 -0.711 194 HD13 LEU 23 HD13 LEU 23 -8.033 -8.460 0.193 195 HD21 LEU 23 HD21 LEU 23 -7.214 -7.293 -3.162 196 HD22 LEU 23 HD22 LEU 23 -6.746 -8.308 -1.780 197 HD23 LEU 23 HD23 LEU 23 -8.112 -8.793 -2.811 198 H GLY 24 H GLY 24 -10.550 -3.629 -3.192 199 HA2 GLY 24 HA2 GLY 24 -12.205 -3.162 -5.287 200 HA3 GLY 24 HA3 GLY 24 -13.213 -4.213 -4.311 201 H VAL 25 H VAL 25 -14.538 -2.105 -4.432 202 HA VAL 25 HA VAL 25 -13.857 -0.421 -2.069 203 HB VAL 25 HB VAL 25 -14.571 1.585 -3.195 204 HG11 VAL 25 HG11 VAL 25 -12.843 1.840 -4.906 205 HG12 VAL 25 HG12 VAL 25 -12.202 0.897 -3.541 206 HG13 VAL 25 HG13 VAL 25 -12.682 0.082 -5.051 207 HG21 VAL 25 HG21 VAL 25 -16.345 0.735 -4.584 208 HG22 VAL 25 HG22 VAL 25 -15.176 1.617 -5.583 209 HG23 VAL 25 HG23 VAL 25 -15.181 -0.168 -5.588 210 H SER 26 H SER 26 -15.692 0.744 -1.190 211 HA SER 26 HA SER 26 -18.388 -0.113 -1.962 212 HB2 SER 26 HB2 SER 26 -17.637 -1.867 -0.365 213 HB3 SER 26 HB3 SER 26 -17.291 -0.613 0.837 214 HG SER 26 HG SER 26 -19.382 -1.528 1.096 215 H GLY 27 H GLY 27 -18.682 2.091 -2.524 216 HA2 GLY 27 HA2 GLY 27 -19.377 4.260 -2.043 217 HA3 GLY 27 HA3 GLY 27 -19.328 3.843 -0.314 218 H GLN 28 H GLN 28 -17.598 4.577 0.921 219 HA GLN 28 HA GLN 28 -15.354 5.862 -0.573 220 HB2 GLN 28 HB2 GLN 28 -16.177 6.167 2.350 221 HB3 GLN 28 HB3 GLN 28 -14.848 7.000 1.546 222 HG2 GLN 28 HG2 GLN 28 -17.812 7.370 1.090 223 HG3 GLN 28 HG3 GLN 28 -16.610 8.530 1.700 224 HE21 GLN 28 HE22 GLN 28 -14.633 8.765 0.024 225 HE22 GLN 28 HE21 GLN 28 -15.138 9.026 -1.638 226 H GLN 29 H GLN 29 -16.274 3.192 1.498 227 HA GLN 29 HA GLN 29 -13.668 2.684 2.600 228 HB2 GLN 29 HB2 GLN 29 -16.107 0.919 2.097 229 HB3 GLN 29 HB3 GLN 29 -14.624 0.316 2.816 230 HG2 GLN 29 HG2 GLN 29 -16.227 2.648 3.927 231 HG3 GLN 29 HG3 GLN 29 -16.323 0.982 4.517 232 HE21 GLN 29 HE22 GLN 29 -15.549 3.242 6.115 233 HE22 GLN 29 HE21 GLN 29 -13.888 2.979 6.616 234 H VAL 30 H VAL 30 -12.102 1.272 1.961 235 HA VAL 30 HA VAL 30 -12.202 0.251 -0.821 236 HB VAL 30 HB VAL 30 -9.944 1.900 0.402 237 HG11 VAL 30 HG11 VAL 30 -10.273 0.766 -2.401 238 HG12 VAL 30 HG12 VAL 30 -8.906 1.731 -1.796 239 HG13 VAL 30 HG13 VAL 30 -9.194 0.093 -1.152 240 HG21 VAL 30 HG21 VAL 30 -10.483 3.501 -1.439 241 HG22 VAL 30 HG22 VAL 30 -11.905 2.521 -1.850 242 HG23 VAL 30 HG23 VAL 30 -11.814 3.341 -0.272 243 H ARG 31 H ARG 31 -11.913 -1.868 -0.626 244 HA ARG 31 HA ARG 31 -10.629 -2.960 1.787 245 HB2 ARG 31 HB2 ARG 31 -12.850 -3.748 0.715 246 HB3 ARG 31 HB3 ARG 31 -11.844 -4.533 -0.519 247 HG2 ARG 31 HG2 ARG 31 -10.686 -5.823 1.246 248 HG3 ARG 31 HG3 ARG 31 -11.580 -4.925 2.490 249 HD2 ARG 31 HD2 ARG 31 -13.705 -5.750 1.248 250 HD3 ARG 31 HD3 ARG 31 -12.639 -6.970 0.524 251 HE ARG 31 HE ARG 31 -13.425 -6.677 3.375 252 HH11 ARG 31 HH11 ARG 31 -11.571 -8.526 0.970 253 HH12 ARG 31 HH12 ARG 31 -11.322 -9.860 2.085 254 HH21 ARG 31 HH21 ARG 31 -13.099 -8.451 4.722 255 HH22 ARG 31 HH22 ARG 31 -12.156 -9.817 4.143 256 H ILE 32 H ILE 32 -8.599 -3.776 1.801 257 HA ILE 32 HA ILE 32 -7.195 -4.024 -0.811 258 HB ILE 32 HB ILE 32 -5.896 -2.531 1.462 259 HG12 ILE 32 HG12 ILE 32 -7.893 -1.405 -0.519 260 HG13 ILE 32 HG13 ILE 32 -7.852 -1.240 1.240 261 HG21 ILE 32 HG21 ILE 32 -5.565 -2.401 -1.565 262 HG22 ILE 32 HG22 ILE 32 -4.530 -1.605 -0.349 263 HG23 ILE 32 HG23 ILE 32 -4.543 -3.357 -0.474 264 HD11 ILE 32 HD11 ILE 32 -5.906 0.016 -0.731 265 HD12 ILE 32 HD12 ILE 32 -7.151 0.835 0.215 266 HD13 ILE 32 HD13 ILE 32 -5.758 0.101 1.049 267 H GLY 33 H GLY 33 -5.232 -5.238 -0.724 268 HA2 GLY 33 HA2 GLY 33 -4.863 -6.819 1.770 269 HA3 GLY 33 HA3 GLY 33 -4.774 -7.544 0.150 270 H ILE 34 H ILE 34 -2.701 -7.610 2.070 271 HA ILE 34 HA ILE 34 -0.543 -6.089 0.712 272 HB ILE 34 HB ILE 34 -0.916 -6.291 3.735 273 HG12 ILE 34 HG12 ILE 34 -1.187 -3.807 1.995 274 HG13 ILE 34 HG13 ILE 34 -2.560 -4.723 2.652 275 HG21 ILE 34 HG21 ILE 34 1.148 -4.815 2.034 276 HG22 ILE 34 HG22 ILE 34 1.033 -4.726 3.801 277 HG23 ILE 34 HG23 ILE 34 1.433 -6.258 3.030 278 HD11 ILE 34 HD11 ILE 34 -0.429 -3.298 4.274 279 HD12 ILE 34 HD12 ILE 34 -2.141 -2.849 4.107 280 HD13 ILE 34 HD13 ILE 34 -1.704 -4.351 4.950 281 H ASN 35 H ASN 35 1.430 -7.208 0.713 282 HA ASN 35 HA ASN 35 1.407 -9.887 1.987 283 HB2 ASN 35 HB2 ASN 35 0.414 -9.937 -0.329 284 HB3 ASN 35 HB3 ASN 35 1.969 -9.406 -0.965 285 HD21 ASN 35 HD22 ASN 35 0.371 -11.951 -1.297 286 HD22 ASN 35 HD21 ASN 35 1.460 -13.245 -0.846 287 H ALA 36 H ALA 36 3.101 -9.694 3.279 288 HA ALA 36 HA ALA 36 5.767 -9.176 2.108 289 HB1 ALA 36 HB1 ALA 36 6.316 -7.661 3.997 290 HB2 ALA 36 HB2 ALA 36 5.051 -6.969 2.942 291 HB3 ALA 36 HB3 ALA 36 4.619 -7.689 4.512 292 HA PRO 37 HA PRO 37 6.855 -12.437 4.887 293 HB2 PRO 37 HB2 PRO 37 9.416 -11.653 5.615 294 HB3 PRO 37 HB3 PRO 37 8.996 -12.422 4.040 295 HG2 PRO 37 HG2 PRO 37 9.399 -9.492 4.690 296 HG3 PRO 37 HG3 PRO 37 9.979 -10.407 3.266 297 HD2 PRO 37 HD2 PRO 37 7.758 -8.843 3.183 298 HD3 PRO 37 HD3 PRO 37 7.841 -10.379 2.274 299 H LYS 38 H LYS 38 7.237 -12.901 7.154 300 HA LYS 38 HA LYS 38 6.212 -10.884 8.954 301 HB2 LYS 38 HB2 LYS 38 7.467 -13.631 9.390 302 HB3 LYS 38 HB3 LYS 38 6.763 -12.655 10.694 303 HG2 LYS 38 HG2 LYS 38 5.203 -13.432 8.195 304 HG3 LYS 38 HG3 LYS 38 5.218 -14.420 9.662 305 HD2 LYS 38 HD2 LYS 38 4.605 -11.536 10.129 306 HD3 LYS 38 HD3 LYS 38 3.447 -12.399 9.113 307 HE2 LYS 38 HE2 LYS 38 2.782 -12.550 11.454 308 HE3 LYS 38 HE3 LYS 38 3.195 -14.145 10.827 309 HZ1 LYS 38 HZ1 LYS 38 4.137 -13.829 12.964 310 HZ2 LYS 38 HZ2 LYS 38 5.356 -13.930 11.876 311 HZ3 LYS 38 HZ3 LYS 38 4.938 -12.463 12.505 312 H ASP 39 H ASP 39 9.190 -11.283 7.548 313 HA ASP 39 HA ASP 39 10.972 -10.453 9.646 314 HB2 ASP 39 HB2 ASP 39 11.026 -10.299 6.611 315 HB3 ASP 39 HB3 ASP 39 12.377 -9.785 7.629 316 H VAL 40 H VAL 40 8.388 -8.837 8.162 317 HA VAL 40 HA VAL 40 9.454 -6.214 9.048 318 HB VAL 40 HB VAL 40 8.535 -5.117 7.080 319 HG11 VAL 40 HG11 VAL 40 10.291 -7.457 6.232 320 HG12 VAL 40 HG12 VAL 40 10.103 -5.919 5.374 321 HG13 VAL 40 HG13 VAL 40 10.884 -5.948 6.977 322 HG21 VAL 40 HG21 VAL 40 6.716 -6.796 6.620 323 HG22 VAL 40 HG22 VAL 40 7.654 -6.330 5.185 324 HG23 VAL 40 HG23 VAL 40 7.983 -7.886 5.978 325 H ALA 41 H ALA 41 7.538 -4.598 9.158 326 HA ALA 41 HA ALA 41 5.274 -6.100 10.375 327 HB1 ALA 41 HB1 ALA 41 6.674 -4.845 11.966 328 HB2 ALA 41 HB2 ALA 41 6.389 -3.346 11.047 329 HB3 ALA 41 HB3 ALA 41 5.037 -4.157 11.866 330 H VAL 42 H VAL 42 3.149 -5.170 10.231 331 HA VAL 42 HA VAL 42 2.712 -2.891 8.447 332 HB VAL 42 HB VAL 42 2.771 -4.388 6.676 333 HG11 VAL 42 HG11 VAL 42 1.736 -6.665 6.728 334 HG12 VAL 42 HG12 VAL 42 3.132 -6.460 7.797 335 HG13 VAL 42 HG13 VAL 42 1.489 -6.459 8.485 336 HG21 VAL 42 HG21 VAL 42 -0.121 -4.581 7.614 337 HG22 VAL 42 HG22 VAL 42 0.593 -3.206 6.738 338 HG23 VAL 42 HG23 VAL 42 0.471 -4.804 5.962 339 H HIS 43 H HIS 43 1.021 -1.746 9.175 340 HA HIS 43 HA HIS 43 -1.265 -3.026 10.486 341 HB2 HIS 43 HB2 HIS 43 0.225 -0.883 12.024 342 HB3 HIS 43 HB3 HIS 43 -1.056 -1.958 12.574 343 HD2 HIS 43 HD2 HIS 43 2.737 -1.882 11.897 344 HE1 HIS 43 HE1 HIS 43 1.945 -5.420 14.129 345 HE2 HIS 43 HE2 HIS 43 3.774 -3.927 13.177 346 H ARG 44 H ARG 44 -2.879 -1.170 11.183 347 HA ARG 44 HA ARG 44 -3.045 0.777 9.030 348 HB2 ARG 44 HB2 ARG 44 -5.011 -0.333 10.132 349 HB3 ARG 44 HB3 ARG 44 -4.648 0.561 11.620 350 HG2 ARG 44 HG2 ARG 44 -5.063 2.685 10.521 351 HG3 ARG 44 HG3 ARG 44 -5.101 1.904 8.929 352 HD2 ARG 44 HD2 ARG 44 -7.358 2.415 9.603 353 HD3 ARG 44 HD3 ARG 44 -7.131 0.653 9.597 354 HE ARG 44 HE ARG 44 -6.622 1.588 12.224 355 HH11 ARG 44 HH11 ARG 44 -9.315 1.376 9.939 356 HH12 ARG 44 HH12 ARG 44 -10.517 1.206 11.198 357 HH21 ARG 44 HH21 ARG 44 -8.248 1.409 13.853 358 HH22 ARG 44 HH22 ARG 44 -9.914 1.200 13.384 359 H GLU 45 H GLU 45 -3.127 3.172 9.510 360 HA GLU 45 HA GLU 45 -0.713 3.943 10.726 361 HB2 GLU 45 HB2 GLU 45 -2.081 5.108 8.960 362 HB3 GLU 45 HB3 GLU 45 -3.155 5.703 10.220 363 HG2 GLU 45 HG2 GLU 45 -0.146 6.207 10.134 364 HG3 GLU 45 HG3 GLU 45 -1.342 7.295 9.420 365 H GLU 46 H GLU 46 -3.872 3.407 12.134 366 HA GLU 46 HA GLU 46 -3.557 4.956 14.520 367 HB2 GLU 46 HB2 GLU 46 -5.713 4.138 13.603 368 HB3 GLU 46 HB3 GLU 46 -5.189 2.472 13.874 369 HG2 GLU 46 HG2 GLU 46 -5.067 2.912 16.322 370 HG3 GLU 46 HG3 GLU 46 -5.562 4.591 16.037 371 H ILE 47 H ILE 47 -2.681 1.567 13.637 372 HA ILE 47 HA ILE 47 -1.962 0.958 16.419 373 HB ILE 47 HB ILE 47 -2.055 -0.550 13.790 374 HG12 ILE 47 HG12 ILE 47 -3.558 -2.049 15.018 375 HG13 ILE 47 HG13 ILE 47 -3.304 -1.131 16.506 376 HG21 ILE 47 HG21 ILE 47 -0.005 -1.327 14.889 377 HG22 ILE 47 HG22 ILE 47 -0.873 -1.513 16.432 378 HG23 ILE 47 HG23 ILE 47 -1.260 -2.567 15.047 379 HD11 ILE 47 HD11 ILE 47 -4.563 0.014 13.984 380 HD12 ILE 47 HD12 ILE 47 -5.472 -0.645 15.367 381 HD13 ILE 47 HD13 ILE 47 -4.463 0.794 15.588 382 H TYR 48 H TYR 48 -0.468 2.005 13.400 383 HA TYR 48 HA TYR 48 2.164 1.129 13.770 384 HB2 TYR 48 HB2 TYR 48 1.237 2.134 11.734 385 HB3 TYR 48 HB3 TYR 48 1.156 3.696 12.565 386 HD1 TYR 48 HD2 TYR 48 3.515 1.024 11.433 387 HD2 TYR 48 HD1 TYR 48 3.078 5.115 12.701 388 HE1 TYR 48 HE2 TYR 48 5.833 1.494 10.712 389 HE2 TYR 48 HE1 TYR 48 5.348 5.616 11.926 390 HH TYR 48 HH TYR 48 7.260 4.779 10.927 391 H GLN 49 H GLN 49 0.394 3.790 15.298 392 HA GLN 49 HA GLN 49 2.677 5.240 16.269 393 HB2 GLN 49 HB2 GLN 49 -0.246 5.125 17.077 394 HB3 GLN 49 HB3 GLN 49 0.925 6.286 17.761 395 HG2 GLN 49 HG2 GLN 49 1.321 7.289 15.604 396 HG3 GLN 49 HG3 GLN 49 0.459 6.005 14.766 397 HE21 GLN 49 HE22 GLN 49 -0.939 7.529 13.767 398 HE22 GLN 49 HE21 GLN 49 -2.243 8.294 14.630 399 H ARG 50 H ARG 50 1.069 2.313 17.355 400 HA ARG 50 HA ARG 50 2.226 2.499 20.055 401 HB2 ARG 50 HB2 ARG 50 0.576 0.413 18.573 402 HB3 ARG 50 HB3 ARG 50 1.396 0.053 20.093 403 HG2 ARG 50 HG2 ARG 50 -0.843 0.662 20.644 404 HG3 ARG 50 HG3 ARG 50 0.225 1.974 21.171 405 HD2 ARG 50 HD2 ARG 50 -0.409 3.264 19.125 406 HD3 ARG 50 HD3 ARG 50 -1.512 1.952 18.671 407 HE ARG 50 HE ARG 50 -2.040 2.809 21.361 408 HH11 ARG 50 HH11 ARG 50 -2.535 3.844 17.999 409 HH12 ARG 50 HH12 ARG 50 -3.909 4.837 18.407 410 HH21 ARG 50 HH21 ARG 50 -3.855 4.089 21.826 411 HH22 ARG 50 HH22 ARG 50 -4.665 4.959 20.545 412 H ILE 51 H ILE 51 3.057 1.325 16.873 413 HA ILE 51 HA ILE 51 5.103 -0.535 17.704 414 HB ILE 51 HB ILE 51 5.104 1.030 15.107 415 HG12 ILE 51 HG12 ILE 51 2.776 0.322 15.422 416 HG13 ILE 51 HG13 ILE 51 3.578 -0.478 14.053 417 HG21 ILE 51 HG21 ILE 51 5.962 -1.114 14.222 418 HG22 ILE 51 HG22 ILE 51 6.965 -0.454 15.530 419 HG23 ILE 51 HG23 ILE 51 5.864 -1.808 15.863 420 HD11 ILE 51 HD11 ILE 51 3.813 -2.517 15.354 421 HD12 ILE 51 HD12 ILE 51 3.098 -1.707 16.784 422 HD13 ILE 51 HD13 ILE 51 2.114 -1.964 15.321 423 H GLN 52 H GLN 52 5.112 2.782 16.333 424 HA GLN 52 HA GLN 52 7.938 3.136 16.613 425 HB2 GLN 52 HB2 GLN 52 5.677 5.091 16.028 426 HB3 GLN 52 HB3 GLN 52 7.401 5.436 15.812 427 HG2 GLN 52 HG2 GLN 52 5.718 3.400 14.322 428 HG3 GLN 52 HG3 GLN 52 6.583 4.806 13.674 429 HE21 GLN 52 HE22 GLN 52 6.653 1.505 13.838 430 HE22 GLN 52 HE21 GLN 52 8.373 1.218 13.708 431 H ALA 53 H ALA 53 5.740 2.972 19.041 432 HA ALA 53 HA ALA 53 6.446 5.232 20.649 433 HB1 ALA 53 HB1 ALA 53 4.426 3.861 20.979 434 HB2 ALA 53 HB2 ALA 53 5.437 2.469 21.429 435 HB3 ALA 53 HB3 ALA 53 5.412 3.920 22.456 436 H GLY 54 H GLY 54 8.264 2.427 19.734 437 HA2 GLY 54 HA2 GLY 54 10.680 3.157 20.667 438 HA3 GLY 54 HA3 GLY 54 9.963 2.502 22.146 439 H LEU 55 H LEU 55 8.975 0.978 19.120 440 HA LEU 55 HA LEU 55 10.912 -1.201 19.382 441 HB2 LEU 55 HB2 LEU 55 9.121 -2.836 20.075 442 HB3 LEU 55 HB3 LEU 55 9.593 -1.660 21.296 443 HG LEU 55 HG LEU 55 7.558 -0.259 20.577 444 HD11 LEU 55 HD11 LEU 55 6.774 -2.940 19.345 445 HD12 LEU 55 HD12 LEU 55 5.686 -1.560 19.625 446 HD13 LEU 55 HD13 LEU 55 7.012 -1.412 18.458 447 HD21 LEU 55 HD21 LEU 55 7.727 -1.504 22.659 448 HD22 LEU 55 HD22 LEU 55 6.076 -1.600 22.001 449 HD23 LEU 55 HD23 LEU 55 7.178 -2.992 21.841 450 H THR 56 H THR 56 9.702 -3.235 18.201 451 HA THR 56 HA THR 56 8.138 -2.278 15.879 452 HB THR 56 HB THR 56 10.558 -4.098 15.570 453 HG1 THR 56 HG1 THR 56 10.279 -1.363 14.881 454 HG21 THR 56 HG21 THR 56 10.237 -3.465 13.143 455 HG22 THR 56 HG22 THR 56 8.939 -4.468 13.803 456 HG23 THR 56 HG23 THR 56 8.682 -2.720 13.610 457 H ALA 57 H ALA 57 8.485 -4.345 18.464 458 HA ALA 57 HA ALA 57 6.406 -6.125 17.377 459 HB1 ALA 57 HB1 ALA 57 8.493 -7.296 16.870 460 HB2 ALA 57 HB2 ALA 57 9.031 -7.117 18.553 461 HB3 ALA 57 HB3 ALA 57 7.623 -8.134 18.170 462 HA PRO 58 HA PRO 58 4.883 -5.124 21.527 463 HB2 PRO 58 HB2 PRO 58 3.190 -7.485 20.725 464 HB3 PRO 58 HB3 PRO 58 2.686 -5.963 21.531 465 HG2 PRO 58 HG2 PRO 58 2.257 -6.293 18.884 466 HG3 PRO 58 HG3 PRO 58 2.908 -4.732 19.495 467 HD2 PRO 58 HD2 PRO 58 4.414 -7.027 18.217 468 HD3 PRO 58 HD3 PRO 58 4.591 -5.264 17.942 469 H ASP 59 H ASP 59 4.202 -6.596 23.450 470 HA ASP 59 HA ASP 59 6.479 -7.837 24.458 471 HB2 ASP 59 HB2 ASP 59 4.481 -6.883 25.671 472 HB3 ASP 59 HB3 ASP 59 3.592 -8.347 25.264 473 H5' U 36 H5' U 36 -3.884 4.383 -17.283 474 H5'' U 36 H5'' U 36 -4.892 3.821 -15.946 475 H4' U 36 H4' U 36 -5.853 4.652 -18.730 476 H3' U 36 H3' U 36 -5.132 6.390 -16.756 477 H2' U 36 H2' U 36 -6.489 5.991 -14.960 478 HO2' U 36 HO2' U 36 -8.410 6.819 -16.864 479 H1' U 36 H1' U 36 -8.665 4.472 -15.874 480 H3 U 36 H3 U 36 -7.108 0.116 -14.770 481 H5 U 36 H5 U 36 -5.242 2.948 -12.303 482 H6 U 36 H6 U 36 -6.078 4.691 -13.721 483 HO5' U 36 HO5' U 36 -3.966 2.098 -17.170 484 H5' C 37 H5' C 37 -2.992 5.598 -19.135 485 H5'' C 37 H5'' C 37 -3.564 6.537 -17.753 486 H4' C 37 H4' C 37 -2.104 7.677 -20.176 487 H3' C 37 H3' C 37 -0.892 6.031 -18.383 488 H2' C 37 H2' C 37 -0.952 7.134 -16.350 489 HO2' C 37 HO2' C 37 1.148 7.822 -17.022 490 H1' C 37 H1' C 37 -1.430 9.865 -17.074 491 H41 C 37 H41 C 37 -6.357 9.439 -13.152 492 H42 C 37 H42 C 37 -6.197 7.695 -13.034 493 H5 C 37 H5 C 37 -4.525 6.440 -14.334 494 H6 C 37 H6 C 37 -2.796 6.622 -15.979 495 H5' A 38 H5' A 38 2.553 8.686 -18.288 496 H5'' A 38 H5'' A 38 3.893 7.804 -19.043 497 H4' A 38 H4' A 38 4.438 8.575 -16.755 498 H3' A 38 H3' A 38 5.178 6.162 -17.760 499 H2' A 38 H2' A 38 3.155 5.013 -17.165 500 HO2' A 38 HO2' A 38 5.047 4.708 -15.074 501 H1' A 38 H1' A 38 3.312 6.218 -14.416 502 H8 A 38 H8 A 38 1.198 4.525 -17.082 503 H61 A 38 H61 A 38 -3.308 4.654 -12.809 504 H62 A 38 H62 A 38 -2.847 4.018 -14.383 505 H2 A 38 H2 A 38 -0.080 7.402 -11.501 506 H5' G 39 H5' G 39 4.962 9.286 -14.862 507 H5'' G 39 H5'' G 39 6.297 10.380 -15.259 508 H4' G 39 H4' G 39 5.561 11.215 -13.217 509 H3' G 39 H3' G 39 8.069 10.220 -13.142 510 H2' G 39 H2' G 39 7.474 7.999 -12.550 511 HO2' G 39 HO2' G 39 7.931 7.697 -10.360 512 H1' G 39 H1' G 39 5.521 8.898 -10.458 513 H8 G 39 H8 G 39 3.291 7.452 -12.580 514 H1 G 39 H1 G 39 7.101 2.668 -10.640 515 H21 G 39 H21 G 39 8.960 3.464 -9.817 516 H22 G 39 H22 G 39 9.276 5.182 -9.708 517 H5' G 40 H5' G 40 6.990 11.245 -8.419 518 H5'' G 40 H5'' G 40 8.108 12.610 -8.287 519 H4' G 40 H4' G 40 8.040 11.418 -6.167 520 H3' G 40 H3' G 40 10.441 11.907 -7.698 521 H2' G 40 H2' G 40 10.873 9.619 -7.920 522 HO2' G 40 HO2' G 40 11.774 10.355 -5.332 523 H1' G 40 H1' G 40 9.550 9.102 -5.238 524 H8 G 40 H8 G 40 9.537 7.671 -8.860 525 H1 G 40 H1 G 40 11.705 3.667 -4.335 526 H21 G 40 H21 G 40 11.635 4.669 -2.342 527 H22 G 40 H22 G 40 11.025 6.291 -2.159 528 H5' A 41 H5' A 41 7.527 13.688 -3.332 529 H5'' A 41 H5'' A 41 7.816 12.467 -4.569 530 H4' A 41 H4' A 41 7.693 15.322 -5.500 531 H3' A 41 H3' A 41 5.384 13.855 -4.210 532 H2' A 41 H2' A 41 3.960 14.544 -5.914 533 HO2' A 41 HO2' A 41 4.145 16.702 -5.963 534 H1' A 41 H1' A 41 6.003 14.923 -7.902 535 H8 A 41 H8 A 41 4.687 11.764 -6.016 536 H61 A 41 H61 A 41 2.221 10.277 -11.520 537 H62 A 41 H62 A 41 2.378 9.779 -9.845 538 H2 A 41 H2 A 41 4.361 14.123 -11.968 539 H5' C 42 H5' C 42 2.506 14.680 -1.706 540 H5'' C 42 H5'' C 42 3.227 13.974 -3.170 541 H4' C 42 H4' C 42 1.595 14.792 -4.572 542 H3' C 42 H3' C 42 1.535 17.147 -3.037 543 H2' C 42 H2' C 42 0.218 16.242 -1.326 544 HO2' C 42 HO2' C 42 -1.738 17.007 -3.243 545 H1' C 42 H1' C 42 -1.396 14.635 -3.375 546 H41 C 42 H41 C 42 -3.510 13.141 2.549 547 H42 C 42 H42 C 42 -1.914 12.556 2.986 548 H5 C 42 H5 C 42 -0.013 12.637 1.444 549 H6 C 42 H6 C 42 0.712 13.422 -0.757 550 H5' A 43 H5' A 43 1.415 14.600 -6.359 551 H5'' A 43 H5'' A 43 1.518 15.008 -8.071 552 H4' A 43 H4' A 43 0.106 13.078 -7.894 553 H3' A 43 H3' A 43 -1.436 15.639 -8.371 554 H2' A 43 H2' A 43 -3.470 14.286 -8.364 555 HO2' A 43 HO2' A 43 -2.477 12.581 -9.621 556 H1' A 43 H1' A 43 -2.791 12.646 -6.378 557 H8 A 43 H8 A 43 -1.775 16.198 -5.391 558 H61 A 43 H61 A 43 -7.192 16.140 -2.355 559 H62 A 43 H62 A 43 -5.672 16.996 -2.559 560 H2 A 43 H2 A 43 -7.063 12.598 -5.017 561 H5' U 44 H5' U 44 -3.870 16.897 -10.898 562 H5'' U 44 H5'' U 44 -2.831 16.723 -9.483 563 H4' U 44 H4' U 44 -5.586 15.428 -9.468 564 H3' U 44 H3' U 44 -4.679 18.239 -8.995 565 HO3' U 44 HO3' U 44 -6.980 17.216 -10.368 566 H2' U 44 H2' U 44 -6.585 18.525 -7.513 567 HO2' U 44 HO2' U 44 -8.134 17.167 -8.566 568 H1' U 44 H1' U 44 -5.852 16.327 -6.161 569 H3 U 44 H3 U 44 -4.700 20.367 -4.193 570 H5 U 44 H5 U 44 -1.506 19.399 -6.745 571 H6 U 44 H6 U 44 -2.806 17.539 -7.581 572 H1 MET 1 H1 MET 1 -0.040 -13.128 5.205 573 H2 MET 1 H2 MET 1 0.876 -11.768 5.068 574 H3 MET 1 H3 MET 1 0.920 -12.918 3.887 575 HA MET 1 HA MET 1 -0.371 -11.024 3.191 576 HB2 MET 1 HB2 MET 1 -0.932 -13.308 2.342 577 HB3 MET 1 HB3 MET 1 -2.014 -13.537 3.728 578 HG2 MET 1 HG2 MET 1 -3.329 -12.915 1.791 579 HG3 MET 1 HG3 MET 1 -3.387 -11.613 2.966 580 HE1 MET 1 HE1 MET 1 -3.734 -9.826 -0.450 581 HE2 MET 1 HE2 MET 1 -4.371 -11.406 0.093 582 HE3 MET 1 HE3 MET 1 -4.369 -10.019 1.206 583 H LEU 2 H LEU 2 -1.806 -9.402 3.718 584 HA LEU 2 HA LEU 2 -3.569 -9.826 6.074 585 HB2 LEU 2 HB2 LEU 2 -1.354 -7.887 5.744 586 HB3 LEU 2 HB3 LEU 2 -2.894 -7.129 6.158 587 HG LEU 2 HG LEU 2 -1.567 -9.376 7.703 588 HD11 LEU 2 HD11 LEU 2 -0.381 -7.210 7.825 589 HD12 LEU 2 HD12 LEU 2 -1.880 -6.406 8.332 590 HD13 LEU 2 HD13 LEU 2 -1.137 -7.636 9.385 591 HD21 LEU 2 HD21 LEU 2 -4.029 -9.431 7.989 592 HD22 LEU 2 HD22 LEU 2 -3.260 -8.801 9.452 593 HD23 LEU 2 HD23 LEU 2 -4.042 -7.681 8.308 594 H ILE 3 H ILE 3 -5.466 -8.519 6.030 595 HA ILE 3 HA ILE 3 -5.990 -7.003 3.528 596 HB ILE 3 HB ILE 3 -7.801 -9.134 4.751 597 HG12 ILE 3 HG12 ILE 3 -7.725 -9.797 2.198 598 HG13 ILE 3 HG13 ILE 3 -6.195 -8.911 2.190 599 HG21 ILE 3 HG21 ILE 3 -9.121 -7.179 4.018 600 HG22 ILE 3 HG22 ILE 3 -8.290 -7.216 2.437 601 HG23 ILE 3 HG23 ILE 3 -9.346 -8.552 2.922 602 HD11 ILE 3 HD11 ILE 3 -6.949 -11.278 3.964 603 HD12 ILE 3 HD12 ILE 3 -5.865 -11.325 2.554 604 HD13 ILE 3 HD13 ILE 3 -5.369 -10.461 4.013 605 H LEU 4 H LEU 4 -7.405 -5.291 3.807 606 HA LEU 4 HA LEU 4 -8.381 -4.633 6.524 607 HB2 LEU 4 HB2 LEU 4 -6.457 -2.953 4.856 608 HB3 LEU 4 HB3 LEU 4 -7.341 -2.347 6.253 609 HG LEU 4 HG LEU 4 -5.288 -4.600 6.332 610 HD11 LEU 4 HD11 LEU 4 -5.221 -1.648 7.081 611 HD12 LEU 4 HD12 LEU 4 -3.938 -2.821 7.485 612 HD13 LEU 4 HD13 LEU 4 -4.302 -2.451 5.783 613 HD21 LEU 4 HD21 LEU 4 -6.941 -4.810 8.156 614 HD22 LEU 4 HD22 LEU 4 -5.407 -4.208 8.796 615 HD23 LEU 4 HD23 LEU 4 -6.759 -3.080 8.531 616 H THR 5 H THR 5 -9.799 -2.674 6.456 617 HA THR 5 HA THR 5 -10.590 -1.865 3.719 618 HB THR 5 HB THR 5 -12.783 -2.294 5.745 619 HG1 THR 5 HG1 THR 5 -11.800 -4.317 5.554 620 HG21 THR 5 HG21 THR 5 -12.622 -2.383 2.716 621 HG22 THR 5 HG22 THR 5 -14.104 -2.467 3.696 622 HG23 THR 5 HG23 THR 5 -13.131 -0.977 3.693 623 H ARG 6 H ARG 6 -9.726 0.156 3.875 624 HA ARG 6 HA ARG 6 -11.028 1.922 5.890 625 HB2 ARG 6 HB2 ARG 6 -8.862 3.309 5.749 626 HB3 ARG 6 HB3 ARG 6 -8.938 1.897 6.817 627 HG2 ARG 6 HG2 ARG 6 -7.046 1.183 5.913 628 HG3 ARG 6 HG3 ARG 6 -7.903 0.890 4.392 629 HD2 ARG 6 HD2 ARG 6 -6.558 3.496 5.224 630 HD3 ARG 6 HD3 ARG 6 -5.914 2.347 4.065 631 HE ARG 6 HE ARG 6 -8.395 3.929 3.635 632 HH11 ARG 6 HH11 ARG 6 -5.483 2.359 2.417 633 HH12 ARG 6 HH12 ARG 6 -5.959 2.479 0.741 634 HH21 ARG 6 HH21 ARG 6 -9.091 3.895 1.419 635 HH22 ARG 6 HH22 ARG 6 -7.970 3.376 0.178 636 H LYS 7 H LYS 7 -10.859 4.269 5.241 637 HA LYS 7 HA LYS 7 -11.795 4.341 2.402 638 HB2 LYS 7 HB2 LYS 7 -13.515 5.889 3.035 639 HB3 LYS 7 HB3 LYS 7 -13.676 4.441 4.016 640 HG2 LYS 7 HG2 LYS 7 -12.562 5.630 5.915 641 HG3 LYS 7 HG3 LYS 7 -12.397 7.073 4.890 642 HD2 LYS 7 HD2 LYS 7 -14.904 7.051 4.574 643 HD3 LYS 7 HD3 LYS 7 -14.989 5.735 5.766 644 HE2 LYS 7 HE2 LYS 7 -13.835 7.240 7.416 645 HE3 LYS 7 HE3 LYS 7 -13.879 8.538 6.206 646 HZ1 LYS 7 HZ1 LYS 7 -16.269 8.403 6.226 647 HZ2 LYS 7 HZ2 LYS 7 -16.238 7.196 7.348 648 HZ3 LYS 7 HZ3 LYS 7 -15.707 8.699 7.739 649 H VAL 8 H VAL 8 -12.137 6.793 1.747 650 HA VAL 8 HA VAL 8 -9.501 7.591 1.215 651 HB VAL 8 HB VAL 8 -10.405 9.514 0.116 652 HG11 VAL 8 HG11 VAL 8 -11.951 8.359 -1.398 653 HG12 VAL 8 HG12 VAL 8 -10.643 7.257 -0.895 654 HG13 VAL 8 HG13 VAL 8 -12.265 7.110 -0.179 655 HG21 VAL 8 HG21 VAL 8 -13.085 8.857 1.391 656 HG22 VAL 8 HG22 VAL 8 -12.081 10.293 1.737 657 HG23 VAL 8 HG23 VAL 8 -12.764 10.060 0.115 658 H GLY 9 H GLY 9 -8.155 9.191 1.851 659 HA2 GLY 9 HA2 GLY 9 -7.367 10.959 3.135 660 HA3 GLY 9 HA3 GLY 9 -8.865 10.950 4.087 661 H GLU 10 H GLU 10 -8.153 7.787 4.132 662 HA GLU 10 HA GLU 10 -6.841 7.958 6.744 663 HB2 GLU 10 HB2 GLU 10 -8.860 6.539 6.181 664 HB3 GLU 10 HB3 GLU 10 -7.803 5.516 5.206 665 HG2 GLU 10 HG2 GLU 10 -8.274 4.632 7.496 666 HG3 GLU 10 HG3 GLU 10 -6.551 4.841 7.191 667 H SER 11 H SER 11 -5.240 5.894 7.057 668 HA SER 11 HA SER 11 -3.299 5.710 4.835 669 HB2 SER 11 HB2 SER 11 -2.649 6.853 7.581 670 HB3 SER 11 HB3 SER 11 -1.442 6.394 6.363 671 HG SER 11 HG SER 11 -2.310 7.961 4.995 672 H ILE 12 H ILE 12 -1.555 4.196 5.343 673 HA ILE 12 HA ILE 12 -2.021 2.236 7.505 674 HB ILE 12 HB ILE 12 -1.782 1.472 4.555 675 HG12 ILE 12 HG12 ILE 12 -4.191 1.328 6.419 676 HG13 ILE 12 HG13 ILE 12 -4.002 2.439 5.051 677 HG21 ILE 12 HG21 ILE 12 -2.375 -0.238 7.003 678 HG22 ILE 12 HG22 ILE 12 -2.206 -0.820 5.333 679 HG23 ILE 12 HG23 ILE 12 -0.796 -0.190 6.171 680 HD11 ILE 12 HD11 ILE 12 -4.124 -0.601 4.805 681 HD12 ILE 12 HD12 ILE 12 -5.444 0.511 4.483 682 HD13 ILE 12 HD13 ILE 12 -3.982 0.578 3.471 683 H ASN 13 H ASN 13 0.035 0.751 7.604 684 HA ASN 13 HA ASN 13 2.406 2.209 6.547 685 HB2 ASN 13 HB2 ASN 13 1.791 1.567 9.447 686 HB3 ASN 13 HB3 ASN 13 3.419 1.922 8.858 687 HD21 ASN 13 HD22 ASN 13 4.007 4.033 8.314 688 HD22 ASN 13 HD21 ASN 13 2.963 5.406 8.607 689 H ILE 14 H ILE 14 4.348 1.080 6.567 690 HA ILE 14 HA ILE 14 4.289 -1.831 7.083 691 HB ILE 14 HB ILE 14 5.208 -0.591 4.450 692 HG12 ILE 14 HG12 ILE 14 2.766 -2.306 5.090 693 HG13 ILE 14 HG13 ILE 14 2.750 -0.594 4.625 694 HG21 ILE 14 HG21 ILE 14 5.040 -3.493 5.364 695 HG22 ILE 14 HG22 ILE 14 5.521 -2.942 3.743 696 HG23 ILE 14 HG23 ILE 14 6.535 -2.553 5.129 697 HD11 ILE 14 HD11 ILE 14 2.175 -1.905 2.694 698 HD12 ILE 14 HD12 ILE 14 3.783 -1.203 2.436 699 HD13 ILE 14 HD13 ILE 14 3.608 -2.926 2.878 700 H GLY 15 H GLY 15 6.374 -2.682 7.522 701 HA2 GLY 15 HA2 GLY 15 8.496 -2.598 8.433 702 HA3 GLY 15 HA3 GLY 15 8.837 -1.362 7.213 703 H ASP 16 H ASP 16 10.039 0.011 8.441 704 HA ASP 16 HA ASP 16 8.566 1.519 10.546 705 HB2 ASP 16 HB2 ASP 16 11.503 0.709 10.551 706 HB3 ASP 16 HB3 ASP 16 10.744 1.786 11.727 707 H ASP 17 H ASP 17 9.411 1.648 7.492 708 HA ASP 17 HA ASP 17 10.182 4.503 7.559 709 HB2 ASP 17 HB2 ASP 17 11.642 2.372 5.945 710 HB3 ASP 17 HB3 ASP 17 11.912 4.114 5.846 711 H ILE 18 H ILE 18 7.836 2.427 6.620 712 HA ILE 18 HA ILE 18 7.454 3.903 4.067 713 HB ILE 18 HB ILE 18 6.735 0.989 4.541 714 HG12 ILE 18 HG12 ILE 18 8.437 0.908 2.455 715 HG13 ILE 18 HG13 ILE 18 9.140 2.291 3.305 716 HG21 ILE 18 HG21 ILE 18 6.529 2.802 2.106 717 HG22 ILE 18 HG22 ILE 18 6.240 1.045 2.106 718 HG23 ILE 18 HG23 ILE 18 5.178 2.112 3.031 719 HD11 ILE 18 HD11 ILE 18 9.335 0.901 5.369 720 HD12 ILE 18 HD12 ILE 18 8.571 -0.459 4.513 721 HD13 ILE 18 HD13 ILE 18 10.166 0.131 3.999 722 H THR 19 H THR 19 5.409 4.562 3.584 723 HA THR 19 HA THR 19 3.207 3.928 5.462 724 HB THR 19 HB THR 19 4.020 6.741 4.615 725 HG1 THR 19 HG1 THR 19 4.556 6.978 6.779 726 HG21 THR 19 HG21 THR 19 1.614 6.591 4.922 727 HG22 THR 19 HG22 THR 19 1.823 5.709 6.451 728 HG23 THR 19 HG23 THR 19 2.323 7.419 6.319 729 H ILE 20 H ILE 20 1.130 4.298 4.518 730 HA ILE 20 HA ILE 20 1.076 4.697 1.564 731 HB ILE 20 HB ILE 20 -0.483 2.668 3.216 732 HG12 ILE 20 HG12 ILE 20 1.899 2.014 2.931 733 HG13 ILE 20 HG13 ILE 20 0.763 0.915 2.141 734 HG21 ILE 20 HG21 ILE 20 -1.814 3.460 1.361 735 HG22 ILE 20 HG22 ILE 20 -0.462 3.247 0.230 736 HG23 ILE 20 HG23 ILE 20 -1.230 1.829 0.987 737 HD11 ILE 20 HD11 ILE 20 2.304 3.114 0.707 738 HD12 ILE 20 HD12 ILE 20 2.771 1.401 0.757 739 HD13 ILE 20 HD13 ILE 20 1.261 1.877 -0.049 740 H THR 21 H THR 21 -0.746 5.840 0.848 741 HA THR 21 HA THR 21 -2.725 6.702 2.888 742 HB THR 21 HB THR 21 -1.178 8.632 1.102 743 HG1 THR 21 HG1 THR 21 0.082 7.852 2.812 744 HG21 THR 21 HG21 THR 21 -3.220 9.068 3.327 745 HG22 THR 21 HG22 THR 21 -2.279 10.350 2.539 746 HG23 THR 21 HG23 THR 21 -3.455 9.410 1.595 747 H ILE 22 H ILE 22 -4.707 7.264 2.019 748 HA ILE 22 HA ILE 22 -5.112 6.578 -0.859 749 HB ILE 22 HB ILE 22 -6.301 5.097 0.475 750 HG12 ILE 22 HG12 ILE 22 -8.729 5.784 0.348 751 HG13 ILE 22 HG13 ILE 22 -8.195 7.364 -0.257 752 HG21 ILE 22 HG21 ILE 22 -7.022 7.445 2.257 753 HG22 ILE 22 HG22 ILE 22 -7.809 5.860 2.361 754 HG23 ILE 22 HG23 ILE 22 -6.071 5.988 2.653 755 HD11 ILE 22 HD11 ILE 22 -7.032 6.263 -2.133 756 HD12 ILE 22 HD12 ILE 22 -7.607 4.680 -1.545 757 HD13 ILE 22 HD13 ILE 22 -8.777 5.895 -2.114 758 H LEU 23 H LEU 23 -4.917 8.488 -2.006 759 HA LEU 23 HA LEU 23 -5.594 10.999 -0.755 760 HB2 LEU 23 HB2 LEU 23 -5.281 10.623 -3.747 761 HB3 LEU 23 HB3 LEU 23 -5.007 12.053 -2.762 762 HG LEU 23 HG LEU 23 -3.287 9.566 -2.987 763 HD11 LEU 23 HD11 LEU 23 -3.008 11.368 -4.651 764 HD12 LEU 23 HD12 LEU 23 -2.787 12.560 -3.355 765 HD13 LEU 23 HD13 LEU 23 -1.585 11.272 -3.582 766 HD21 LEU 23 HD21 LEU 23 -1.787 10.662 -1.290 767 HD22 LEU 23 HD22 LEU 23 -3.110 11.793 -0.922 768 HD23 LEU 23 HD23 LEU 23 -3.311 10.058 -0.603 769 H GLY 24 H GLY 24 -7.356 8.622 -2.664 770 HA2 GLY 24 HA2 GLY 24 -9.824 9.126 -1.785 771 HA3 GLY 24 HA3 GLY 24 -9.708 10.402 -2.980 772 H VAL 25 H VAL 25 -11.619 9.105 -3.860 773 HA VAL 25 HA VAL 25 -10.571 7.036 -5.727 774 HB VAL 25 HB VAL 25 -12.553 5.701 -5.452 775 HG11 VAL 25 HG11 VAL 25 -12.243 4.865 -3.194 776 HG12 VAL 25 HG12 VAL 25 -10.668 5.312 -3.878 777 HG13 VAL 25 HG13 VAL 25 -11.464 6.381 -2.697 778 HG21 VAL 25 HG21 VAL 25 -13.465 7.750 -3.392 779 HG22 VAL 25 HG22 VAL 25 -14.207 7.440 -4.986 780 HG23 VAL 25 HG23 VAL 25 -14.253 6.196 -3.732 781 H SER 26 H SER 26 -11.992 6.654 -7.564 782 HA SER 26 HA SER 26 -13.933 8.730 -8.298 783 HB2 SER 26 HB2 SER 26 -11.374 8.204 -9.878 784 HB3 SER 26 HB3 SER 26 -12.778 9.099 -10.493 785 HG SER 26 HG SER 26 -11.249 9.778 -8.203 786 H GLY 27 H GLY 27 -15.384 6.931 -8.114 787 HA2 GLY 27 HA2 GLY 27 -16.564 5.143 -8.996 788 HA3 GLY 27 HA3 GLY 27 -15.572 5.278 -10.462 789 H GLN 28 H GLN 28 -14.683 3.299 -10.842 790 HA GLN 28 HA GLN 28 -13.936 1.486 -8.671 791 HB2 GLN 28 HB2 GLN 28 -13.957 1.458 -11.681 792 HB3 GLN 28 HB3 GLN 28 -12.881 0.333 -10.840 793 HG2 GLN 28 HG2 GLN 28 -15.195 -0.571 -11.385 794 HG3 GLN 28 HG3 GLN 28 -14.622 -0.774 -9.733 795 HE21 GLN 28 HE22 GLN 28 -15.871 -0.080 -8.073 796 HE22 GLN 28 HE21 GLN 28 -17.244 0.991 -8.219 797 H GLN 29 H GLN 29 -12.429 4.145 -10.288 798 HA GLN 29 HA GLN 29 -9.724 3.117 -9.871 799 HB2 GLN 29 HB2 GLN 29 -10.924 5.216 -11.384 800 HB3 GLN 29 HB3 GLN 29 -9.842 5.983 -10.217 801 HG2 GLN 29 HG2 GLN 29 -8.021 4.410 -11.015 802 HG3 GLN 29 HG3 GLN 29 -9.180 3.719 -12.160 803 HE21 GLN 29 HE22 GLN 29 -10.432 5.546 -13.455 804 HE22 GLN 29 HE21 GLN 29 -9.346 6.664 -14.260 805 H VAL 30 H VAL 30 -8.260 3.914 -8.388 806 HA VAL 30 HA VAL 30 -9.293 5.321 -5.987 807 HB VAL 30 HB VAL 30 -7.858 2.626 -6.065 808 HG11 VAL 30 HG11 VAL 30 -8.822 4.211 -3.657 809 HG12 VAL 30 HG12 VAL 30 -8.011 2.628 -3.649 810 HG13 VAL 30 HG13 VAL 30 -7.122 4.077 -4.163 811 HG21 VAL 30 HG21 VAL 30 -10.246 2.391 -6.553 812 HG22 VAL 30 HG22 VAL 30 -9.910 1.803 -4.912 813 HG23 VAL 30 HG23 VAL 30 -10.658 3.400 -5.148 814 H ARG 31 H ARG 31 -7.894 6.985 -5.666 815 HA ARG 31 HA ARG 31 -5.200 6.773 -6.882 816 HB2 ARG 31 HB2 ARG 31 -6.565 8.720 -7.465 817 HB3 ARG 31 HB3 ARG 31 -6.712 9.164 -5.753 818 HG2 ARG 31 HG2 ARG 31 -4.375 9.626 -5.555 819 HG3 ARG 31 HG3 ARG 31 -3.996 8.801 -7.085 820 HD2 ARG 31 HD2 ARG 31 -5.804 11.226 -6.963 821 HD3 ARG 31 HD3 ARG 31 -4.037 11.349 -7.170 822 HE ARG 31 HE ARG 31 -4.888 9.507 -9.090 823 HH11 ARG 31 HH11 ARG 31 -5.578 12.894 -8.347 824 HH12 ARG 31 HH12 ARG 31 -5.921 13.300 -10.016 825 HH21 ARG 31 HH21 ARG 31 -5.315 10.068 -11.229 826 HH22 ARG 31 HH22 ARG 31 -5.752 11.710 -11.648 827 H ILE 32 H ILE 32 -3.419 6.536 -5.744 828 HA ILE 32 HA ILE 32 -3.658 6.516 -2.777 829 HB ILE 32 HB ILE 32 -2.124 4.409 -4.304 830 HG12 ILE 32 HG12 ILE 32 -5.126 4.423 -3.803 831 HG13 ILE 32 HG13 ILE 32 -4.265 4.210 -5.334 832 HG21 ILE 32 HG21 ILE 32 -3.555 4.407 -1.618 833 HG22 ILE 32 HG22 ILE 32 -2.512 3.109 -2.257 834 HG23 ILE 32 HG23 ILE 32 -1.814 4.677 -1.854 835 HD11 ILE 32 HD11 ILE 32 -4.337 2.252 -3.014 836 HD12 ILE 32 HD12 ILE 32 -5.081 2.062 -4.605 837 HD13 ILE 32 HD13 ILE 32 -3.305 2.068 -4.464 838 H GLY 33 H GLY 33 -1.642 6.723 -1.679 839 HA2 GLY 33 HA2 GLY 33 0.631 7.711 -3.331 840 HA3 GLY 33 HA3 GLY 33 0.090 8.577 -1.881 841 H ILE 34 H ILE 34 2.695 7.465 -2.294 842 HA ILE 34 HA ILE 34 2.828 5.447 -0.113 843 HB ILE 34 HB ILE 34 4.235 5.250 -2.810 844 HG12 ILE 34 HG12 ILE 34 2.057 3.413 -1.730 845 HG13 ILE 34 HG13 ILE 34 1.749 4.726 -2.884 846 HG21 ILE 34 HG21 ILE 34 4.973 3.014 -1.955 847 HG22 ILE 34 HG22 ILE 34 5.584 4.351 -0.976 848 HG23 ILE 34 HG23 ILE 34 4.212 3.390 -0.393 849 HD11 ILE 34 HD11 ILE 34 3.578 2.351 -3.365 850 HD12 ILE 34 HD12 ILE 34 1.995 2.658 -4.105 851 HD13 ILE 34 HD13 ILE 34 3.354 3.746 -4.461 852 H ASN 35 H ASN 35 4.716 5.613 1.098 853 HA ASN 35 HA ASN 35 6.563 7.810 0.328 854 HB2 ASN 35 HB2 ASN 35 4.611 8.609 1.712 855 HB3 ASN 35 HB3 ASN 35 5.201 7.607 3.039 856 HD21 ASN 35 HD22 ASN 35 4.897 10.580 2.772 857 HD22 ASN 35 HD21 ASN 35 6.485 11.245 3.076 858 H ALA 36 H ALA 36 8.378 6.690 0.140 859 HA ALA 36 HA ALA 36 9.471 5.311 2.511 860 HB1 ALA 36 HB1 ALA 36 9.293 4.066 -0.274 861 HB2 ALA 36 HB2 ALA 36 10.165 3.387 1.111 862 HB3 ALA 36 HB3 ALA 36 8.389 3.521 1.157 863 HA PRO 37 HA PRO 37 13.183 7.284 1.141 864 HB2 PRO 37 HB2 PRO 37 15.068 5.324 1.725 865 HB3 PRO 37 HB3 PRO 37 14.318 6.408 2.957 866 HG2 PRO 37 HG2 PRO 37 13.575 3.572 2.196 867 HG3 PRO 37 HG3 PRO 37 13.739 4.279 3.838 868 HD2 PRO 37 HD2 PRO 37 11.320 3.991 2.665 869 HD3 PRO 37 HD3 PRO 37 11.719 5.461 3.622 870 H LYS 38 H LYS 38 14.778 7.225 -0.563 871 HA LYS 38 HA LYS 38 14.121 5.586 -2.838 872 HB2 LYS 38 HB2 LYS 38 16.533 7.349 -2.191 873 HB3 LYS 38 HB3 LYS 38 16.203 6.649 -3.793 874 HG2 LYS 38 HG2 LYS 38 14.248 8.460 -2.303 875 HG3 LYS 38 HG3 LYS 38 15.420 9.053 -3.493 876 HD2 LYS 38 HD2 LYS 38 13.448 6.842 -4.178 877 HD3 LYS 38 HD3 LYS 38 13.010 8.553 -4.238 878 HE2 LYS 38 HE2 LYS 38 14.890 8.989 -5.788 879 HE3 LYS 38 HE3 LYS 38 15.371 7.282 -5.705 880 HZ1 LYS 38 HZ1 LYS 38 12.822 8.317 -6.744 881 HZ2 LYS 38 HZ2 LYS 38 14.062 7.759 -7.654 882 HZ3 LYS 38 HZ3 LYS 38 13.243 6.720 -6.675 883 H ASP 39 H ASP 39 15.502 4.826 -0.031 884 HA ASP 39 HA ASP 39 17.575 2.973 -0.719 885 HB2 ASP 39 HB2 ASP 39 16.933 4.043 1.551 886 HB3 ASP 39 HB3 ASP 39 15.669 2.817 1.633 887 H VAL 40 H VAL 40 14.196 2.926 -1.287 888 HA VAL 40 HA VAL 40 14.254 0.018 -1.862 889 HB VAL 40 HB VAL 40 12.098 -0.320 -0.842 890 HG11 VAL 40 HG11 VAL 40 13.867 1.186 1.136 891 HG12 VAL 40 HG12 VAL 40 12.635 -0.030 1.528 892 HG13 VAL 40 HG13 VAL 40 14.103 -0.507 0.647 893 HG21 VAL 40 HG21 VAL 40 11.138 1.921 -1.255 894 HG22 VAL 40 HG22 VAL 40 10.913 1.376 0.422 895 HG23 VAL 40 HG23 VAL 40 12.161 2.582 0.050 896 H ALA 41 H ALA 41 12.248 -0.587 -3.183 897 HA ALA 41 HA ALA 41 11.895 1.546 -5.230 898 HB1 ALA 41 HB1 ALA 41 11.477 -0.348 -6.762 899 HB2 ALA 41 HB2 ALA 41 13.053 -0.501 -5.955 900 HB3 ALA 41 HB3 ALA 41 11.670 -1.484 -5.407 901 H VAL 42 H VAL 42 9.822 1.717 -6.302 902 HA VAL 42 HA VAL 42 7.521 0.283 -5.246 903 HB VAL 42 HB VAL 42 7.393 1.837 -3.527 904 HG11 VAL 42 HG11 VAL 42 7.797 4.292 -3.822 905 HG12 VAL 42 HG12 VAL 42 9.229 3.279 -4.032 906 HG13 VAL 42 HG13 VAL 42 8.396 3.955 -5.463 907 HG21 VAL 42 HG21 VAL 42 5.299 1.866 -4.861 908 HG22 VAL 42 HG22 VAL 42 5.614 3.423 -4.060 909 HG23 VAL 42 HG23 VAL 42 5.925 3.252 -5.794 910 H HIS 43 H HIS 43 6.185 -0.090 -6.912 911 HA HIS 43 HA HIS 43 5.713 1.952 -8.945 912 HB2 HIS 43 HB2 HIS 43 6.647 -0.740 -9.972 913 HB3 HIS 43 HB3 HIS 43 6.535 0.790 -10.818 914 HD2 HIS 43 HD2 HIS 43 8.799 -1.086 -8.294 915 HE1 HIS 43 HE1 HIS 43 11.151 1.993 -10.050 916 HE2 HIS 43 HE2 HIS 43 11.191 -0.048 -8.519 917 H ARG 44 H ARG 44 4.136 1.166 -10.618 918 HA ARG 44 HA ARG 44 2.003 -0.471 -9.598 919 HB2 ARG 44 HB2 ARG 44 1.754 1.379 -11.209 920 HB3 ARG 44 HB3 ARG 44 2.790 0.538 -12.370 921 HG2 ARG 44 HG2 ARG 44 1.127 -1.214 -12.675 922 HG3 ARG 44 HG3 ARG 44 0.136 -0.552 -11.359 923 HD2 ARG 44 HD2 ARG 44 -0.776 0.123 -13.512 924 HD3 ARG 44 HD3 ARG 44 -0.179 1.545 -12.645 925 HE ARG 44 HE ARG 44 0.920 0.357 -15.109 926 HH11 ARG 44 HH11 ARG 44 1.370 2.780 -12.546 927 HH12 ARG 44 HH12 ARG 44 2.526 3.691 -13.491 928 HH21 ARG 44 HH21 ARG 44 2.332 1.583 -16.279 929 HH22 ARG 44 HH22 ARG 44 3.083 3.017 -15.600 930 H GLU 45 H GLU 45 1.427 -2.651 -10.425 931 HA GLU 45 HA GLU 45 3.723 -4.325 -10.531 932 HB2 GLU 45 HB2 GLU 45 2.206 -6.164 -10.791 933 HB3 GLU 45 HB3 GLU 45 1.506 -5.003 -9.669 934 HG2 GLU 45 HG2 GLU 45 -0.278 -5.660 -10.987 935 HG3 GLU 45 HG3 GLU 45 0.167 -4.084 -11.665 936 H GLU 46 H GLU 46 2.304 -2.462 -13.006 937 HA GLU 46 HA GLU 46 2.971 -4.111 -15.273 938 HB2 GLU 46 HB2 GLU 46 1.347 -2.201 -15.272 939 HB3 GLU 46 HB3 GLU 46 2.697 -1.089 -14.974 940 HG2 GLU 46 HG2 GLU 46 3.713 -1.714 -17.126 941 HG3 GLU 46 HG3 GLU 46 2.483 -2.966 -17.369 942 H ILE 47 H ILE 47 4.711 -1.664 -13.318 943 HA ILE 47 HA ILE 47 6.959 -1.677 -15.228 944 HB ILE 47 HB ILE 47 6.756 -0.237 -12.575 945 HG12 ILE 47 HG12 ILE 47 4.759 0.474 -13.694 946 HG13 ILE 47 HG13 ILE 47 5.952 1.766 -13.842 947 HG21 ILE 47 HG21 ILE 47 8.288 0.320 -15.150 948 HG22 ILE 47 HG22 ILE 47 8.276 1.371 -13.712 949 HG23 ILE 47 HG23 ILE 47 8.964 -0.259 -13.608 950 HD11 ILE 47 HD11 ILE 47 5.192 -0.246 -16.001 951 HD12 ILE 47 HD12 ILE 47 4.770 1.479 -15.961 952 HD13 ILE 47 HD13 ILE 47 6.462 0.988 -16.169 953 H TYR 48 H TYR 48 5.922 -3.049 -12.173 954 HA TYR 48 HA TYR 48 8.384 -3.637 -10.957 955 HB2 TYR 48 HB2 TYR 48 6.185 -3.803 -9.916 956 HB3 TYR 48 HB3 TYR 48 5.811 -5.189 -10.953 957 HD1 TYR 48 HD1 TYR 48 8.049 -3.989 -8.218 958 HD2 TYR 48 HD2 TYR 48 6.622 -7.403 -10.423 959 HE1 TYR 48 HE1 TYR 48 9.022 -5.493 -6.516 960 HE2 TYR 48 HE2 TYR 48 7.529 -8.903 -8.704 961 HH TYR 48 HH TYR 48 9.294 -7.677 -5.822 962 H GLN 49 H GLN 49 6.709 -5.166 -13.682 963 HA GLN 49 HA GLN 49 8.137 -7.663 -13.614 964 HB2 GLN 49 HB2 GLN 49 6.553 -6.203 -15.762 965 HB3 GLN 49 HB3 GLN 49 7.186 -7.853 -15.951 966 HG2 GLN 49 HG2 GLN 49 5.861 -8.663 -14.095 967 HG3 GLN 49 HG3 GLN 49 5.433 -7.031 -13.599 968 HE21 GLN 49 HE22 GLN 49 3.315 -6.671 -13.978 969 HE22 GLN 49 HE21 GLN 49 2.418 -7.182 -15.383 970 H ARG 50 H ARG 50 8.976 -4.452 -14.730 971 HA ARG 50 HA ARG 50 11.199 -5.440 -16.404 972 HB2 ARG 50 HB2 ARG 50 10.152 -2.695 -15.612 973 HB3 ARG 50 HB3 ARG 50 11.744 -2.903 -16.339 974 HG2 ARG 50 HG2 ARG 50 10.200 -2.380 -18.092 975 HG3 ARG 50 HG3 ARG 50 10.737 -4.052 -18.282 976 HD2 ARG 50 HD2 ARG 50 8.607 -4.846 -17.286 977 HD3 ARG 50 HD3 ARG 50 8.077 -3.152 -17.101 978 HE ARG 50 HE ARG 50 8.875 -3.845 -19.812 979 HH11 ARG 50 HH11 ARG 50 6.148 -3.913 -17.529 980 HH12 ARG 50 HH12 ARG 50 4.962 -4.004 -18.804 981 HH21 ARG 50 HH21 ARG 50 7.285 -3.915 -21.424 982 HH22 ARG 50 HH22 ARG 50 5.595 -3.988 -20.994 983 H ILE 51 H ILE 51 10.532 -4.545 -13.090 984 HA ILE 51 HA ILE 51 13.270 -4.039 -12.326 985 HB ILE 51 HB ILE 51 11.092 -5.146 -10.522 986 HG12 ILE 51 HG12 ILE 51 10.059 -3.359 -11.834 987 HG13 ILE 51 HG13 ILE 51 10.193 -2.987 -10.102 988 HG21 ILE 51 HG21 ILE 51 13.407 -3.235 -10.097 989 HG22 ILE 51 HG22 ILE 51 12.211 -3.693 -8.857 990 HG23 ILE 51 HG23 ILE 51 13.289 -4.926 -9.555 991 HD11 ILE 51 HD11 ILE 51 11.987 -1.914 -12.304 992 HD12 ILE 51 HD12 ILE 51 10.620 -1.072 -11.535 993 HD13 ILE 51 HD13 ILE 51 12.060 -1.478 -10.567 994 H GLN 52 H GLN 52 11.014 -6.789 -11.918 995 HA GLN 52 HA GLN 52 12.975 -8.532 -10.772 996 HB2 GLN 52 HB2 GLN 52 10.193 -9.037 -11.908 997 HB3 GLN 52 HB3 GLN 52 11.110 -10.200 -10.934 998 HG2 GLN 52 HG2 GLN 52 10.046 -7.498 -10.073 999 HG3 GLN 52 HG3 GLN 52 9.639 -9.102 -9.435 1000 HE21 GLN 52 HE22 GLN 52 11.277 -6.330 -8.712 1001 HE22 GLN 52 HE21 GLN 52 12.535 -6.968 -7.679 1002 H ALA 53 H ALA 53 12.881 -7.464 -13.875 1003 HA ALA 53 HA ALA 53 13.231 -9.898 -15.341 1004 HB1 ALA 53 HB1 ALA 53 14.157 -7.059 -15.934 1005 HB2 ALA 53 HB2 ALA 53 14.039 -8.388 -17.109 1006 HB3 ALA 53 HB3 ALA 53 12.567 -7.750 -16.350 1007 H GLY 54 H GLY 54 15.280 -8.278 -13.061 1008 HA2 GLY 54 HA2 GLY 54 17.180 -10.170 -12.823 1009 HA3 GLY 54 HA3 GLY 54 17.776 -9.296 -14.241 1010 H LEU 55 H LEU 55 16.075 -7.360 -11.829 1011 HA LEU 55 HA LEU 55 18.530 -6.507 -10.503 1012 HB2 LEU 55 HB2 LEU 55 18.400 -4.198 -11.541 1013 HB3 LEU 55 HB3 LEU 55 18.939 -5.496 -12.599 1014 HG LEU 55 HG LEU 55 16.514 -5.654 -13.464 1015 HD11 LEU 55 HD11 LEU 55 16.377 -2.897 -12.180 1016 HD12 LEU 55 HD12 LEU 55 15.195 -3.594 -13.309 1017 HD13 LEU 55 HD13 LEU 55 15.399 -4.309 -11.701 1018 HD21 LEU 55 HD21 LEU 55 18.162 -3.148 -13.936 1019 HD22 LEU 55 HD22 LEU 55 18.387 -4.733 -14.722 1020 HD23 LEU 55 HD23 LEU 55 16.901 -3.799 -15.014 1021 H THR 56 H THR 56 17.860 -4.036 -9.636 1022 HA THR 56 HA THR 56 15.038 -4.075 -8.761 1023 HB THR 56 HB THR 56 17.256 -3.616 -6.743 1024 HG1 THR 56 HG1 THR 56 15.809 -5.977 -7.330 1025 HG21 THR 56 HG21 THR 56 14.257 -4.170 -6.567 1026 HG22 THR 56 HG22 THR 56 15.357 -4.159 -5.167 1027 HG23 THR 56 HG23 THR 56 15.089 -2.674 -6.092 1028 H ALA 57 H ALA 57 17.608 -2.447 -10.123 1029 HA ALA 57 HA ALA 57 16.170 0.098 -9.887 1030 HB1 ALA 57 HB1 ALA 57 17.705 0.169 -7.966 1031 HB2 ALA 57 HB2 ALA 57 19.074 -0.216 -9.025 1032 HB3 ALA 57 HB3 ALA 57 18.212 1.325 -9.224 1033 HA PRO 58 HA PRO 58 17.371 -0.208 -14.247 1034 HB2 PRO 58 HB2 PRO 58 16.522 2.668 -13.947 1035 HB3 PRO 58 HB3 PRO 58 16.169 1.537 -15.291 1036 HG2 PRO 58 HG2 PRO 58 14.282 2.015 -13.414 1037 HG3 PRO 58 HG3 PRO 58 14.610 0.317 -13.907 1038 HD2 PRO 58 HD2 PRO 58 15.616 1.784 -11.456 1039 HD3 PRO 58 HD3 PRO 58 14.964 0.115 -11.591 1040 H ASP 59 H ASP 59 18.979 0.625 -15.579 1041 HA ASP 59 HA ASP 59 21.121 1.279 -15.986 1042 HB2 ASP 59 HB2 ASP 59 19.571 3.204 -16.400 1043 HB3 ASP 59 HB3 ASP 59 20.059 3.879 -14.850 1044 H5' U 36 H5' U 36 -17.434 -4.272 10.030 1045 H5'' U 36 H5'' U 36 -17.293 -3.891 8.304 1046 H4' U 36 H4' U 36 -16.488 -6.571 9.516 1047 H3' U 36 H3' U 36 -15.084 -4.371 10.167 1048 H2' U 36 H2' U 36 -15.167 -3.332 8.041 1049 HO2' U 36 HO2' U 36 -12.944 -3.493 8.684 1050 H1' U 36 H1' U 36 -14.267 -5.860 6.683 1051 H3 U 36 H3 U 36 -15.884 -5.199 2.535 1052 H5 U 36 H5 U 36 -17.166 -1.801 4.647 1053 H6 U 36 H6 U 36 -16.341 -2.798 6.665 1054 HO5' U 36 HO5' U 36 -18.646 -5.702 7.898 1055 H5' C 37 H5' C 37 -14.521 -5.502 13.572 1056 H5'' C 37 H5'' C 37 -14.710 -4.358 12.232 1057 H4' C 37 H4' C 37 -12.195 -4.494 13.930 1058 H3' C 37 H3' C 37 -14.601 -3.815 15.049 1059 H2' C 37 H2' C 37 -15.258 -2.172 13.545 1060 HO2' C 37 HO2' C 37 -15.005 -1.092 15.578 1061 H1' C 37 H1' C 37 -12.513 -1.011 13.284 1062 H41 C 37 H41 C 37 -14.986 1.232 7.873 1063 H42 C 37 H42 C 37 -16.243 0.008 7.864 1064 H5 C 37 H5 C 37 -16.398 -1.739 9.557 1065 H6 C 37 H6 C 37 -15.387 -2.630 11.570 1066 H5' A 38 H5' A 38 -9.701 -4.460 17.168 1067 H5'' A 38 H5'' A 38 -10.040 -3.531 15.699 1068 H4' A 38 H4' A 38 -9.417 -6.526 15.705 1069 H3' A 38 H3' A 38 -7.476 -4.834 16.470 1070 H2' A 38 H2' A 38 -8.212 -3.081 14.956 1071 HO2' A 38 HO2' A 38 -6.032 -4.404 13.681 1072 H1' A 38 H1' A 38 -7.961 -5.105 12.726 1073 H8 A 38 H8 A 38 -9.822 -1.953 14.005 1074 H61 A 38 H61 A 38 -11.045 -0.951 8.016 1075 H62 A 38 H62 A 38 -11.123 -0.287 9.637 1076 H2 A 38 H2 A 38 -9.171 -4.976 8.388 1077 H5' G 39 H5' G 39 -8.093 -8.443 13.682 1078 H5'' G 39 H5'' G 39 -7.796 -9.892 14.658 1079 H4' G 39 H4' G 39 -7.646 -10.678 12.466 1080 H3' G 39 H3' G 39 -5.360 -10.900 13.892 1081 H2' G 39 H2' G 39 -4.413 -8.824 13.301 1082 HO2' G 39 HO2' G 39 -2.836 -9.144 11.708 1083 H1' G 39 H1' G 39 -5.133 -9.016 10.401 1084 H8 G 39 H8 G 39 -7.224 -6.474 11.198 1085 H1 G 39 H1 G 39 -1.329 -4.223 12.351 1086 H21 G 39 H21 G 39 0.101 -5.844 12.455 1087 H22 G 39 H22 G 39 -0.361 -7.526 12.269 1088 H5' G 40 H5' G 40 -4.392 -11.995 9.396 1089 H5'' G 40 H5'' G 40 -4.001 -13.718 9.462 1090 H4' G 40 H4' G 40 -2.692 -12.514 7.766 1091 H3' G 40 H3' G 40 -1.667 -14.391 9.605 1092 H2' G 40 H2' G 40 -0.527 -12.636 10.836 1093 HO2' G 40 HO2' G 40 0.999 -14.229 9.981 1094 H1' G 40 H1' G 40 0.019 -11.451 8.095 1095 H8 G 40 H8 G 40 -0.902 -10.093 11.636 1096 H1 G 40 H1 G 40 4.625 -7.927 9.180 1097 H21 G 40 H21 G 40 5.065 -8.978 7.263 1098 H22 G 40 H22 G 40 3.942 -10.125 6.576 1099 H5' A 41 H5' A 41 -2.835 -15.224 5.106 1100 H5'' A 41 H5'' A 41 -3.129 -13.874 6.216 1101 H4' A 41 H4' A 41 -4.814 -16.403 6.304 1102 H3' A 41 H3' A 41 -4.901 -14.073 4.411 1103 H2' A 41 H2' A 41 -7.214 -13.749 4.717 1104 HO2' A 41 HO2' A 41 -7.752 -15.972 4.357 1105 H1' A 41 H1' A 41 -7.409 -14.634 7.369 1106 H8 A 41 H8 A 41 -5.272 -11.929 5.524 1107 H61 A 41 H61 A 41 -8.338 -7.981 9.239 1108 H62 A 41 H62 A 41 -7.195 -8.072 7.911 1109 H2 A 41 H2 A 41 -9.582 -12.087 10.269 1110 H5' C 42 H5' C 42 -6.503 -13.941 0.288 1111 H5'' C 42 H5'' C 42 -5.632 -13.170 1.620 1112 H4' C 42 H4' C 42 -7.719 -12.368 2.599 1113 H3' C 42 H3' C 42 -9.227 -14.293 1.659 1114 H2' C 42 H2' C 42 -8.411 -14.014 -0.650 1115 HO2' C 42 HO2' C 42 -10.924 -12.696 -0.336 1116 H1' C 42 H1' C 42 -9.256 -11.128 -0.319 1117 H41 C 42 H41 C 42 -6.636 -11.162 -6.165 1118 H42 C 42 H42 C 42 -5.078 -11.602 -5.494 1119 H5 C 42 H5 C 42 -4.753 -12.046 -3.101 1120 H6 C 42 H6 C 42 -5.896 -12.209 -0.950 1121 H5' A 43 H5' A 43 -11.568 -15.240 2.931 1122 H5'' A 43 H5'' A 43 -11.225 -14.383 1.426 1123 H4' A 43 H4' A 43 -13.750 -13.853 1.323 1124 H3' A 43 H3' A 43 -14.211 -15.314 3.505 1125 H2' A 43 H2' A 43 -12.760 -17.126 3.080 1126 HO2' A 43 HO2' A 43 -15.248 -17.830 1.891 1127 H1' A 43 H1' A 43 -13.419 -17.627 0.261 1128 H8 A 43 H8 A 43 -10.557 -15.623 -0.150 1129 H61 A 43 H61 A 43 -6.903 -20.123 2.106 1130 H62 A 43 H62 A 43 -6.915 -18.562 1.308 1131 H2 A 43 H2 A 43 -11.102 -21.139 3.088 1132 H5' U 44 H5' U 44 -16.906 -13.942 -1.073 1133 H5'' U 44 H5'' U 44 -15.595 -15.086 -0.728 1134 H4' U 44 H4' U 44 -15.160 -12.196 -1.620 1135 H3' U 44 H3' U 44 -15.196 -14.832 -3.113 1136 HO3' U 44 HO3' U 44 -16.268 -13.492 -4.655 1137 H2' U 44 H2' U 44 -13.535 -13.926 -4.589 1138 HO2' U 44 HO2' U 44 -14.428 -11.749 -4.648 1139 H1' U 44 H1' U 44 -11.986 -12.948 -2.590 1140 H3 U 44 H3 U 44 -9.871 -16.712 -4.015 1141 H5 U 44 H5 U 44 -13.143 -18.150 -1.790 1142 H6 U 44 H6 U 44 -13.936 -15.884 -1.598 Start of MODEL 7 1 H1 MET 1 H1 MET 1 8.385 10.492 -1.107 2 H2 MET 1 H2 MET 1 8.478 10.959 -2.683 3 H3 MET 1 H3 MET 1 8.510 9.358 -2.293 4 HA MET 1 HA MET 1 6.268 9.445 -1.489 5 HB2 MET 1 HB2 MET 1 6.328 11.826 -0.767 6 HB3 MET 1 HB3 MET 1 6.428 12.326 -2.463 7 HG2 MET 1 HG2 MET 1 4.171 12.598 -1.716 8 HG3 MET 1 HG3 MET 1 4.222 11.306 -2.902 9 HE1 MET 1 HE1 MET 1 1.247 10.385 -0.577 10 HE2 MET 1 HE2 MET 1 1.796 12.026 -0.997 11 HE3 MET 1 HE3 MET 1 1.783 10.762 -2.237 12 H LEU 2 H LEU 2 4.772 8.570 -2.926 13 HA LEU 2 HA LEU 2 4.971 9.419 -5.762 14 HB2 LEU 2 HB2 LEU 2 5.468 6.737 -4.574 15 HB3 LEU 2 HB3 LEU 2 4.298 6.736 -5.904 16 HG LEU 2 HG LEU 2 7.101 7.872 -6.035 17 HD11 LEU 2 HD11 LEU 2 5.890 5.340 -7.237 18 HD12 LEU 2 HD12 LEU 2 7.566 5.933 -7.456 19 HD13 LEU 2 HD13 LEU 2 6.989 5.405 -5.852 20 HD21 LEU 2 HD21 LEU 2 4.939 7.480 -8.168 21 HD22 LEU 2 HD22 LEU 2 5.609 9.035 -7.624 22 HD23 LEU 2 HD23 LEU 2 6.636 7.906 -8.514 23 H ILE 3 H ILE 3 3.022 9.107 -6.937 24 HA ILE 3 HA ILE 3 0.647 8.308 -5.350 25 HB ILE 3 HB ILE 3 0.825 10.785 -7.136 26 HG12 ILE 3 HG12 ILE 3 -0.153 11.740 -4.856 27 HG13 ILE 3 HG13 ILE 3 0.644 10.336 -4.143 28 HG21 ILE 3 HG21 ILE 3 -1.498 9.550 -5.599 29 HG22 ILE 3 HG22 ILE 3 -1.540 11.106 -6.455 30 HG23 ILE 3 HG23 ILE 3 -1.347 9.593 -7.366 31 HD11 ILE 3 HD11 ILE 3 1.874 12.641 -5.702 32 HD12 ILE 3 HD12 ILE 3 2.109 12.233 -3.995 33 HD13 ILE 3 HD13 ILE 3 2.803 11.177 -5.225 34 H LEU 4 H LEU 4 -0.930 7.276 -6.555 35 HA LEU 4 HA LEU 4 -0.413 6.697 -9.421 36 HB2 LEU 4 HB2 LEU 4 -0.724 4.649 -7.188 37 HB3 LEU 4 HB3 LEU 4 -0.789 4.271 -8.914 38 HG LEU 4 HG LEU 4 1.642 5.402 -7.463 39 HD11 LEU 4 HD11 LEU 4 0.904 2.609 -8.432 40 HD12 LEU 4 HD12 LEU 4 2.503 3.081 -7.789 41 HD13 LEU 4 HD13 LEU 4 1.066 3.133 -6.744 42 HD21 LEU 4 HD21 LEU 4 1.618 5.990 -9.865 43 HD22 LEU 4 HD22 LEU 4 2.828 4.739 -9.542 44 HD23 LEU 4 HD23 LEU 4 1.270 4.295 -10.284 45 H THR 5 H THR 5 -2.299 5.558 -10.390 46 HA THR 5 HA THR 5 -4.760 5.723 -8.732 47 HB THR 5 HB THR 5 -5.024 6.414 -11.634 48 HG1 THR 5 HG1 THR 5 -4.639 8.564 -11.135 49 HG21 THR 5 HG21 THR 5 -6.361 7.330 -9.052 50 HG22 THR 5 HG22 THR 5 -6.895 7.722 -10.701 51 HG23 THR 5 HG23 THR 5 -6.950 6.034 -10.119 52 H ARG 6 H ARG 6 -4.882 3.637 -8.358 53 HA ARG 6 HA ARG 6 -4.736 1.628 -10.528 54 HB2 ARG 6 HB2 ARG 6 -3.508 1.599 -8.230 55 HB3 ARG 6 HB3 ARG 6 -5.101 1.358 -7.519 56 HG2 ARG 6 HG2 ARG 6 -4.175 -0.763 -7.614 57 HG3 ARG 6 HG3 ARG 6 -5.263 -0.749 -9.006 58 HD2 ARG 6 HD2 ARG 6 -2.286 -0.087 -9.181 59 HD3 ARG 6 HD3 ARG 6 -2.905 -1.742 -9.300 60 HE ARG 6 HE ARG 6 -4.262 -0.029 -11.165 61 HH11 ARG 6 HH11 ARG 6 -1.254 -1.813 -10.635 62 HH12 ARG 6 HH12 ARG 6 -0.922 -1.973 -12.346 63 HH21 ARG 6 HH21 ARG 6 -3.816 -0.257 -13.356 64 HH22 ARG 6 HH22 ARG 6 -2.372 -1.089 -13.893 65 H LYS 7 H LYS 7 -6.617 -0.026 -10.594 66 HA LYS 7 HA LYS 7 -9.031 0.920 -9.141 67 HB2 LYS 7 HB2 LYS 7 -10.454 0.202 -11.001 68 HB3 LYS 7 HB3 LYS 7 -9.482 1.608 -11.415 69 HG2 LYS 7 HG2 LYS 7 -7.967 0.243 -12.734 70 HG3 LYS 7 HG3 LYS 7 -8.766 -1.259 -12.165 71 HD2 LYS 7 HD2 LYS 7 -10.915 -0.363 -13.164 72 HD3 LYS 7 HD3 LYS 7 -9.965 0.938 -13.899 73 HE2 LYS 7 HE2 LYS 7 -9.632 -2.054 -14.357 74 HE3 LYS 7 HE3 LYS 7 -10.353 -0.887 -15.477 75 HZ1 LYS 7 HZ1 LYS 7 -8.179 0.233 -15.525 76 HZ2 LYS 7 HZ2 LYS 7 -7.544 -0.958 -14.583 77 HZ3 LYS 7 HZ3 LYS 7 -8.088 -1.314 -16.079 78 H VAL 8 H VAL 8 -10.786 -0.879 -9.227 79 HA VAL 8 HA VAL 8 -9.627 -2.757 -7.472 80 HB VAL 8 HB VAL 8 -11.759 -3.748 -7.242 81 HG11 VAL 8 HG11 VAL 8 -12.080 -0.755 -7.771 82 HG12 VAL 8 HG12 VAL 8 -13.087 -1.749 -6.708 83 HG13 VAL 8 HG13 VAL 8 -11.376 -1.467 -6.299 84 HG21 VAL 8 HG21 VAL 8 -12.496 -3.981 -9.567 85 HG22 VAL 8 HG22 VAL 8 -13.698 -3.153 -8.558 86 HG23 VAL 8 HG23 VAL 8 -12.689 -2.210 -9.690 87 H GLY 9 H GLY 9 -8.850 -4.713 -7.566 88 HA2 GLY 9 HA2 GLY 9 -8.650 -6.905 -8.421 89 HA3 GLY 9 HA3 GLY 9 -9.237 -6.360 -10.001 90 H GLU 10 H GLU 10 -7.002 -4.054 -9.037 91 HA GLU 10 HA GLU 10 -4.847 -5.410 -10.591 92 HB2 GLU 10 HB2 GLU 10 -5.363 -2.475 -10.059 93 HB3 GLU 10 HB3 GLU 10 -4.062 -3.144 -11.075 94 HG2 GLU 10 HG2 GLU 10 -5.719 -4.121 -12.598 95 HG3 GLU 10 HG3 GLU 10 -7.045 -3.524 -11.586 96 H SER 11 H SER 11 -2.581 -4.141 -9.916 97 HA SER 11 HA SER 11 -2.342 -4.285 -6.962 98 HB2 SER 11 HB2 SER 11 -0.832 -6.057 -8.914 99 HB3 SER 11 HB3 SER 11 -0.489 -5.935 -7.178 100 HG SER 11 HG SER 11 -2.500 -6.775 -6.742 101 H ILE 12 H ILE 12 -0.105 -3.892 -6.223 102 HA ILE 12 HA ILE 12 1.588 -2.187 -7.946 103 HB ILE 12 HB ILE 12 0.618 -1.393 -5.165 104 HG12 ILE 12 HG12 ILE 12 -0.187 -0.203 -7.845 105 HG13 ILE 12 HG13 ILE 12 -1.212 -1.244 -6.842 106 HG21 ILE 12 HG21 ILE 12 2.881 -0.506 -5.722 107 HG22 ILE 12 HG22 ILE 12 2.229 0.199 -7.217 108 HG23 ILE 12 HG23 ILE 12 1.696 0.784 -5.632 109 HD11 ILE 12 HD11 ILE 12 -1.090 0.398 -4.993 110 HD12 ILE 12 HD12 ILE 12 -0.189 1.504 -6.061 111 HD13 ILE 12 HD13 ILE 12 -1.854 1.040 -6.461 112 H ASN 13 H ASN 13 3.791 -1.884 -6.704 113 HA ASN 13 HA ASN 13 4.300 -4.168 -4.861 114 HB2 ASN 13 HB2 ASN 13 5.719 -3.581 -7.487 115 HB3 ASN 13 HB3 ASN 13 6.374 -4.638 -6.225 116 HD21 ASN 13 HD22 ASN 13 5.358 -6.664 -5.770 117 HD22 ASN 13 HD21 ASN 13 4.237 -7.378 -6.903 118 H ILE 14 H ILE 14 6.165 -4.014 -3.614 119 HA ILE 14 HA ILE 14 7.622 -1.436 -3.605 120 HB ILE 14 HB ILE 14 6.337 -2.677 -1.137 121 HG12 ILE 14 HG12 ILE 14 5.611 -0.148 -2.687 122 HG13 ILE 14 HG13 ILE 14 4.633 -1.618 -2.586 123 HG21 ILE 14 HG21 ILE 14 8.493 -1.546 -0.694 124 HG22 ILE 14 HG22 ILE 14 7.901 -0.086 -1.527 125 HG23 ILE 14 HG23 ILE 14 7.158 -0.634 -0.004 126 HD11 ILE 14 HD11 ILE 14 4.452 -1.303 -0.114 127 HD12 ILE 14 HD12 ILE 14 5.289 0.260 -0.296 128 HD13 ILE 14 HD13 ILE 14 3.717 0.006 -1.071 129 H GLY 15 H GLY 15 9.743 -1.639 -2.732 130 HA2 GLY 15 HA2 GLY 15 11.742 -2.754 -2.427 131 HA3 GLY 15 HA3 GLY 15 10.809 -3.856 -1.394 132 H ASP 16 H ASP 16 11.767 -5.754 -2.017 133 HA ASP 16 HA ASP 16 11.037 -6.677 -4.740 134 HB2 ASP 16 HB2 ASP 16 13.104 -7.900 -4.940 135 HB3 ASP 16 HB3 ASP 16 13.455 -6.194 -4.663 136 H ASP 17 H ASP 17 10.127 -6.855 -1.723 137 HA ASP 17 HA ASP 17 9.403 -9.718 -1.891 138 HB2 ASP 17 HB2 ASP 17 10.539 -8.342 0.575 139 HB3 ASP 17 HB3 ASP 17 9.804 -9.947 0.559 140 H ILE 18 H ILE 18 8.130 -6.726 -2.028 141 HA ILE 18 HA ILE 18 5.821 -7.549 -0.329 142 HB ILE 18 HB ILE 18 6.828 -4.695 -0.675 143 HG12 ILE 18 HG12 ILE 18 6.993 -5.073 1.959 144 HG13 ILE 18 HG13 ILE 18 7.299 -6.747 1.476 145 HG21 ILE 18 HG21 ILE 18 4.570 -5.924 0.958 146 HG22 ILE 18 HG22 ILE 18 5.140 -4.247 1.110 147 HG23 ILE 18 HG23 ILE 18 4.414 -4.790 -0.407 148 HD11 ILE 18 HD11 ILE 18 8.803 -4.275 0.491 149 HD12 ILE 18 HD12 ILE 18 9.394 -5.417 1.717 150 HD13 ILE 18 HD13 ILE 18 9.186 -5.953 0.039 151 H THR 19 H THR 19 3.803 -7.106 -1.087 152 HA THR 19 HA THR 19 3.484 -5.809 -3.737 153 HB THR 19 HB THR 19 2.379 -8.549 -2.995 154 HG1 THR 19 HG1 THR 19 3.785 -9.267 -4.587 155 HG21 THR 19 HG21 THR 19 1.711 -8.591 -5.416 156 HG22 THR 19 HG22 THR 19 0.828 -7.384 -4.468 157 HG23 THR 19 HG23 THR 19 2.162 -6.876 -5.534 158 H ILE 20 H ILE 20 1.296 -5.116 -4.096 159 HA ILE 20 HA ILE 20 -0.472 -5.001 -1.700 160 HB ILE 20 HB ILE 20 0.337 -2.699 -3.519 161 HG12 ILE 20 HG12 ILE 20 2.108 -3.289 -1.883 162 HG13 ILE 20 HG13 ILE 20 1.439 -1.674 -1.661 163 HG21 ILE 20 HG21 ILE 20 -1.575 -2.777 -1.147 164 HG22 ILE 20 HG22 ILE 20 -0.992 -1.297 -1.933 165 HG23 ILE 20 HG23 ILE 20 -1.978 -2.454 -2.848 166 HD11 ILE 20 HD11 ILE 20 0.095 -2.417 0.238 167 HD12 ILE 20 HD12 ILE 20 0.618 -4.101 -0.016 168 HD13 ILE 20 HD13 ILE 20 1.793 -2.864 0.486 169 H THR 21 H THR 21 -2.688 -4.923 -2.252 170 HA THR 21 HA THR 21 -3.362 -4.953 -5.143 171 HB THR 21 HB THR 21 -4.209 -7.120 -3.178 172 HG1 THR 21 HG1 THR 21 -2.861 -8.427 -4.445 173 HG21 THR 21 HG21 THR 21 -4.600 -6.872 -6.192 174 HG22 THR 21 HG22 THR 21 -5.089 -8.250 -5.181 175 HG23 THR 21 HG23 THR 21 -5.876 -6.676 -4.966 176 H ILE 22 H ILE 22 -5.458 -4.296 -5.595 177 HA ILE 22 HA ILE 22 -6.961 -3.123 -3.315 178 HB ILE 22 HB ILE 22 -6.307 -1.405 -4.761 179 HG12 ILE 22 HG12 ILE 22 -8.332 -0.538 -5.764 180 HG13 ILE 22 HG13 ILE 22 -9.073 -2.149 -5.774 181 HG21 ILE 22 HG21 ILE 22 -7.154 -3.116 -7.127 182 HG22 ILE 22 HG22 ILE 22 -6.632 -1.421 -7.213 183 HG23 ILE 22 HG23 ILE 22 -5.494 -2.655 -6.674 184 HD11 ILE 22 HD11 ILE 22 -9.915 -0.787 -3.924 185 HD12 ILE 22 HD12 ILE 22 -9.057 -2.234 -3.354 186 HD13 ILE 22 HD13 ILE 22 -8.262 -0.634 -3.271 187 H LEU 23 H LEU 23 -8.244 -4.739 -2.613 188 HA LEU 23 HA LEU 23 -9.189 -6.814 -4.334 189 HB2 LEU 23 HB2 LEU 23 -10.298 -6.103 -1.605 190 HB3 LEU 23 HB3 LEU 23 -10.288 -7.675 -2.401 191 HG LEU 23 HG LEU 23 -7.931 -6.171 -1.197 192 HD11 LEU 23 HD11 LEU 23 -9.371 -7.504 0.342 193 HD12 LEU 23 HD12 LEU 23 -9.139 -8.928 -0.689 194 HD13 LEU 23 HD13 LEU 23 -7.752 -8.225 0.163 195 HD21 LEU 23 HD21 LEU 23 -6.535 -8.107 -1.835 196 HD22 LEU 23 HD22 LEU 23 -7.881 -8.764 -2.797 197 HD23 LEU 23 HD23 LEU 23 -7.115 -7.221 -3.263 198 H GLY 24 H GLY 24 -10.584 -3.706 -3.329 199 HA2 GLY 24 HA2 GLY 24 -12.282 -3.313 -5.384 200 HA3 GLY 24 HA3 GLY 24 -13.259 -4.375 -4.388 201 H VAL 25 H VAL 25 -14.640 -2.284 -4.475 202 HA VAL 25 HA VAL 25 -13.939 -0.677 -2.067 203 HB VAL 25 HB VAL 25 -14.625 1.365 -3.060 204 HG11 VAL 25 HG11 VAL 25 -12.317 0.634 -3.588 205 HG12 VAL 25 HG12 VAL 25 -12.900 -0.056 -5.122 206 HG13 VAL 25 HG13 VAL 25 -13.003 1.694 -4.836 207 HG21 VAL 25 HG21 VAL 25 -15.391 1.537 -5.406 208 HG22 VAL 25 HG22 VAL 25 -15.424 -0.244 -5.514 209 HG23 VAL 25 HG23 VAL 25 -16.511 0.621 -4.393 210 H SER 26 H SER 26 -15.720 0.406 -1.080 211 HA SER 26 HA SER 26 -18.461 -0.476 -1.671 212 HB2 SER 26 HB2 SER 26 -17.065 -1.029 0.986 213 HB3 SER 26 HB3 SER 26 -18.807 -1.218 0.675 214 HG SER 26 HG SER 26 -17.640 -3.181 0.460 215 H GLY 27 H GLY 27 -18.842 1.752 -2.124 216 HA2 GLY 27 HA2 GLY 27 -19.383 3.943 -1.535 217 HA3 GLY 27 HA3 GLY 27 -19.259 3.447 0.166 218 H GLN 28 H GLN 28 -17.926 5.115 1.005 219 HA GLN 28 HA GLN 28 -15.537 5.938 -0.420 220 HB2 GLN 28 HB2 GLN 28 -16.241 6.246 2.541 221 HB3 GLN 28 HB3 GLN 28 -14.884 7.007 1.703 222 HG2 GLN 28 HG2 GLN 28 -17.822 7.573 1.349 223 HG3 GLN 28 HG3 GLN 28 -16.503 8.663 1.837 224 HE21 GLN 28 HE22 GLN 28 -14.566 8.517 0.001 225 HE22 GLN 28 HE21 GLN 28 -15.160 8.778 -1.627 226 H GLN 29 H GLN 29 -16.383 3.218 1.567 227 HA GLN 29 HA GLN 29 -13.719 2.748 2.547 228 HB2 GLN 29 HB2 GLN 29 -16.264 1.603 3.035 229 HB3 GLN 29 HB3 GLN 29 -15.361 0.337 2.215 230 HG2 GLN 29 HG2 GLN 29 -14.968 0.115 4.583 231 HG3 GLN 29 HG3 GLN 29 -13.472 0.757 3.882 232 HE21 GLN 29 HE22 GLN 29 -16.613 2.225 4.951 233 HE22 GLN 29 HE21 GLN 29 -15.875 3.406 6.018 234 H VAL 30 H VAL 30 -12.237 1.185 1.818 235 HA VAL 30 HA VAL 30 -12.440 0.231 -0.975 236 HB VAL 30 HB VAL 30 -10.201 1.928 0.235 237 HG11 VAL 30 HG11 VAL 30 -9.091 1.733 -1.885 238 HG12 VAL 30 HG12 VAL 30 -9.428 0.091 -1.298 239 HG13 VAL 30 HG13 VAL 30 -10.446 0.801 -2.573 240 HG21 VAL 30 HG21 VAL 30 -12.120 3.304 -0.473 241 HG22 VAL 30 HG22 VAL 30 -10.764 3.516 -1.584 242 HG23 VAL 30 HG23 VAL 30 -12.144 2.487 -2.048 243 H ARG 31 H ARG 31 -12.082 -1.944 -0.742 244 HA ARG 31 HA ARG 31 -10.677 -2.896 1.658 245 HB2 ARG 31 HB2 ARG 31 -12.770 -3.997 0.861 246 HB3 ARG 31 HB3 ARG 31 -11.931 -4.464 -0.637 247 HG2 ARG 31 HG2 ARG 31 -10.265 -5.700 0.654 248 HG3 ARG 31 HG3 ARG 31 -11.019 -5.208 2.181 249 HD2 ARG 31 HD2 ARG 31 -12.580 -6.710 0.060 250 HD3 ARG 31 HD3 ARG 31 -11.574 -7.558 1.249 251 HE ARG 31 HE ARG 31 -13.198 -5.786 2.703 252 HH11 ARG 31 HH11 ARG 31 -13.625 -8.586 0.583 253 HH12 ARG 31 HH12 ARG 31 -15.056 -9.144 1.417 254 HH21 ARG 31 HH21 ARG 31 -15.051 -6.578 3.804 255 HH22 ARG 31 HH22 ARG 31 -15.830 -8.038 3.239 256 H ILE 32 H ILE 32 -8.590 -3.376 1.701 257 HA ILE 32 HA ILE 32 -7.107 -3.574 -0.884 258 HB ILE 32 HB ILE 32 -6.042 -2.080 1.527 259 HG12 ILE 32 HG12 ILE 32 -7.759 -0.963 -0.722 260 HG13 ILE 32 HG13 ILE 32 -8.081 -0.923 1.022 261 HG21 ILE 32 HG21 ILE 32 -5.410 -1.922 -1.450 262 HG22 ILE 32 HG22 ILE 32 -4.558 -1.065 -0.140 263 HG23 ILE 32 HG23 ILE 32 -4.459 -2.823 -0.248 264 HD11 ILE 32 HD11 ILE 32 -7.308 1.263 0.345 265 HD12 ILE 32 HD12 ILE 32 -6.052 0.495 1.340 266 HD13 ILE 32 HD13 ILE 32 -5.874 0.572 -0.433 267 H GLY 33 H GLY 33 -5.060 -4.716 -0.707 268 HA2 GLY 33 HA2 GLY 33 -4.786 -6.367 1.764 269 HA3 GLY 33 HA3 GLY 33 -4.742 -7.102 0.151 270 H ILE 34 H ILE 34 -2.680 -7.315 2.008 271 HA ILE 34 HA ILE 34 -0.438 -5.903 0.674 272 HB ILE 34 HB ILE 34 -0.845 -6.140 3.693 273 HG12 ILE 34 HG12 ILE 34 -0.942 -3.615 1.986 274 HG13 ILE 34 HG13 ILE 34 -2.367 -4.438 2.640 275 HG21 ILE 34 HG21 ILE 34 1.320 -4.771 2.045 276 HG22 ILE 34 HG22 ILE 34 1.196 -4.732 3.822 277 HG23 ILE 34 HG23 ILE 34 1.508 -6.260 2.996 278 HD11 ILE 34 HD11 ILE 34 -1.813 -2.620 4.106 279 HD12 ILE 34 HD12 ILE 34 -1.491 -4.161 4.932 280 HD13 ILE 34 HD13 ILE 34 -0.140 -3.184 4.282 281 H ASN 35 H ASN 35 1.422 -7.159 0.592 282 HA ASN 35 HA ASN 35 1.264 -9.841 1.848 283 HB2 ASN 35 HB2 ASN 35 0.234 -9.825 -0.450 284 HB3 ASN 35 HB3 ASN 35 1.795 -9.351 -1.105 285 HD21 ASN 35 HD22 ASN 35 0.228 -11.784 -1.649 286 HD22 ASN 35 HD21 ASN 35 1.215 -13.141 -1.157 287 H ALA 36 H ALA 36 2.984 -9.725 3.124 288 HA ALA 36 HA ALA 36 5.653 -9.385 1.913 289 HB1 ALA 36 HB1 ALA 36 6.321 -7.863 3.757 290 HB2 ALA 36 HB2 ALA 36 5.053 -7.119 2.752 291 HB3 ALA 36 HB3 ALA 36 4.649 -7.826 4.338 292 HA PRO 37 HA PRO 37 6.589 -12.669 4.724 293 HB2 PRO 37 HB2 PRO 37 9.200 -12.017 5.423 294 HB3 PRO 37 HB3 PRO 37 8.734 -12.763 3.852 295 HG2 PRO 37 HG2 PRO 37 9.257 -9.855 4.503 296 HG3 PRO 37 HG3 PRO 37 9.831 -10.803 3.090 297 HD2 PRO 37 HD2 PRO 37 7.675 -9.171 2.910 298 HD3 PRO 37 HD3 PRO 37 7.710 -10.756 2.085 299 H LYS 38 H LYS 38 6.925 -13.100 7.023 300 HA LYS 38 HA LYS 38 6.157 -10.940 8.784 301 HB2 LYS 38 HB2 LYS 38 7.235 -13.742 9.333 302 HB3 LYS 38 HB3 LYS 38 6.581 -12.660 10.576 303 HG2 LYS 38 HG2 LYS 38 5.016 -13.550 8.111 304 HG3 LYS 38 HG3 LYS 38 4.926 -14.374 9.675 305 HD2 LYS 38 HD2 LYS 38 4.402 -11.390 9.452 306 HD3 LYS 38 HD3 LYS 38 3.153 -12.566 9.044 307 HE2 LYS 38 HE2 LYS 38 4.647 -12.498 11.704 308 HE3 LYS 38 HE3 LYS 38 3.087 -11.711 11.424 309 HZ1 LYS 38 HZ1 LYS 38 2.804 -13.874 12.393 310 HZ2 LYS 38 HZ2 LYS 38 2.157 -13.840 10.881 311 HZ3 LYS 38 HZ3 LYS 38 3.592 -14.594 11.138 312 H ASP 39 H ASP 39 8.910 -11.509 7.207 313 HA ASP 39 HA ASP 39 10.964 -10.788 9.060 314 HB2 ASP 39 HB2 ASP 39 11.082 -11.771 6.666 315 HB3 ASP 39 HB3 ASP 39 10.865 -10.116 6.103 316 H VAL 40 H VAL 40 8.299 -9.020 7.875 317 HA VAL 40 HA VAL 40 9.530 -6.460 8.720 318 HB VAL 40 HB VAL 40 8.595 -5.277 6.837 319 HG11 VAL 40 HG11 VAL 40 10.027 -7.771 5.800 320 HG12 VAL 40 HG12 VAL 40 9.923 -6.195 4.988 321 HG13 VAL 40 HG13 VAL 40 10.834 -6.353 6.509 322 HG21 VAL 40 HG21 VAL 40 6.569 -6.651 6.501 323 HG22 VAL 40 HG22 VAL 40 7.453 -6.319 4.999 324 HG23 VAL 40 HG23 VAL 40 7.583 -7.921 5.755 325 H ALA 41 H ALA 41 7.716 -4.744 8.965 326 HA ALA 41 HA ALA 41 5.463 -6.107 10.354 327 HB1 ALA 41 HB1 ALA 41 5.430 -4.090 11.778 328 HB2 ALA 41 HB2 ALA 41 7.034 -4.854 11.783 329 HB3 ALA 41 HB3 ALA 41 6.750 -3.385 10.822 330 H VAL 42 H VAL 42 3.350 -5.182 10.223 331 HA VAL 42 HA VAL 42 2.873 -2.877 8.494 332 HB VAL 42 HB VAL 42 2.887 -4.350 6.694 333 HG11 VAL 42 HG11 VAL 42 1.606 -6.433 8.490 334 HG12 VAL 42 HG12 VAL 42 1.829 -6.622 6.729 335 HG13 VAL 42 HG13 VAL 42 3.244 -6.447 7.781 336 HG21 VAL 42 HG21 VAL 42 0.714 -3.166 6.799 337 HG22 VAL 42 HG22 VAL 42 0.591 -4.757 6.008 338 HG23 VAL 42 HG23 VAL 42 0.010 -4.555 7.669 339 H HIS 43 H HIS 43 1.335 -1.715 9.440 340 HA HIS 43 HA HIS 43 -0.980 -3.027 10.673 341 HB2 HIS 43 HB2 HIS 43 0.452 -1.002 12.387 342 HB3 HIS 43 HB3 HIS 43 -0.741 -2.200 12.835 343 HD2 HIS 43 HD2 HIS 43 3.030 -1.909 12.008 344 HE1 HIS 43 HE1 HIS 43 2.481 -5.566 14.108 345 HE2 HIS 43 HE2 HIS 43 4.201 -3.976 13.123 346 H ARG 44 H ARG 44 -2.564 -1.303 11.482 347 HA ARG 44 HA ARG 44 -2.896 0.717 9.449 348 HB2 ARG 44 HB2 ARG 44 -4.770 -0.504 10.433 349 HB3 ARG 44 HB3 ARG 44 -4.319 0.027 12.058 350 HG2 ARG 44 HG2 ARG 44 -4.971 2.300 11.576 351 HG3 ARG 44 HG3 ARG 44 -5.179 1.942 9.848 352 HD2 ARG 44 HD2 ARG 44 -7.350 1.995 11.086 353 HD3 ARG 44 HD3 ARG 44 -7.023 0.456 10.289 354 HE ARG 44 HE ARG 44 -6.438 -0.532 12.421 355 HH11 ARG 44 HH11 ARG 44 -8.050 2.619 12.639 356 HH12 ARG 44 HH12 ARG 44 -8.574 2.349 14.284 357 HH21 ARG 44 HH21 ARG 44 -7.110 -0.830 14.543 358 HH22 ARG 44 HH22 ARG 44 -8.049 0.403 15.358 359 H GLU 45 H GLU 45 -3.015 3.054 9.902 360 HA GLU 45 HA GLU 45 -0.642 3.927 11.114 361 HB2 GLU 45 HB2 GLU 45 -2.043 5.017 9.328 362 HB3 GLU 45 HB3 GLU 45 -3.153 5.586 10.572 363 HG2 GLU 45 HG2 GLU 45 -0.171 6.232 10.461 364 HG3 GLU 45 HG3 GLU 45 -1.437 7.249 9.765 365 H GLU 46 H GLU 46 -3.781 3.280 12.496 366 HA GLU 46 HA GLU 46 -3.559 4.793 14.922 367 HB2 GLU 46 HB2 GLU 46 -5.629 3.747 13.911 368 HB3 GLU 46 HB3 GLU 46 -4.981 2.159 14.334 369 HG2 GLU 46 HG2 GLU 46 -6.560 2.829 16.041 370 HG3 GLU 46 HG3 GLU 46 -4.944 2.874 16.749 371 H ILE 47 H ILE 47 -2.809 1.366 14.085 372 HA ILE 47 HA ILE 47 -2.021 0.705 16.791 373 HB ILE 47 HB ILE 47 -1.426 -0.804 14.229 374 HG12 ILE 47 HG12 ILE 47 -3.759 -0.356 14.062 375 HG13 ILE 47 HG13 ILE 47 -3.579 -2.023 14.612 376 HG21 ILE 47 HG21 ILE 47 -1.882 -1.712 17.106 377 HG22 ILE 47 HG22 ILE 47 -1.631 -2.791 15.718 378 HG23 ILE 47 HG23 ILE 47 -0.336 -1.691 16.230 379 HD11 ILE 47 HD11 ILE 47 -4.047 -1.300 16.939 380 HD12 ILE 47 HD12 ILE 47 -4.266 0.375 16.354 381 HD13 ILE 47 HD13 ILE 47 -5.377 -0.904 15.817 382 H TYR 48 H TYR 48 -0.423 1.907 13.917 383 HA TYR 48 HA TYR 48 2.216 1.004 14.377 384 HB2 TYR 48 HB2 TYR 48 1.294 1.931 12.286 385 HB3 TYR 48 HB3 TYR 48 1.146 3.515 13.046 386 HD1 TYR 48 HD2 TYR 48 3.608 0.917 11.983 387 HD2 TYR 48 HD1 TYR 48 2.982 5.015 13.137 388 HE1 TYR 48 HE2 TYR 48 5.886 1.487 11.190 389 HE2 TYR 48 HE1 TYR 48 5.223 5.609 12.321 390 HH TYR 48 HH TYR 48 7.160 4.839 11.314 391 H GLN 49 H GLN 49 0.371 3.642 15.838 392 HA GLN 49 HA GLN 49 2.655 5.134 16.764 393 HB2 GLN 49 HB2 GLN 49 -0.283 5.120 17.550 394 HB3 GLN 49 HB3 GLN 49 0.903 6.293 18.159 395 HG2 GLN 49 HG2 GLN 49 1.331 7.140 15.930 396 HG3 GLN 49 HG3 GLN 49 0.384 5.851 15.192 397 HE21 GLN 49 HE22 GLN 49 -0.934 7.443 14.130 398 HE22 GLN 49 HE21 GLN 49 -2.186 8.298 14.991 399 H ARG 50 H ARG 50 0.949 2.307 17.952 400 HA ARG 50 HA ARG 50 1.821 2.560 20.736 401 HB2 ARG 50 HB2 ARG 50 0.568 0.371 19.028 402 HB3 ARG 50 HB3 ARG 50 1.249 0.008 20.608 403 HG2 ARG 50 HG2 ARG 50 -1.100 0.390 20.887 404 HG3 ARG 50 HG3 ARG 50 -0.222 1.724 21.650 405 HD2 ARG 50 HD2 ARG 50 -0.660 3.148 19.675 406 HD3 ARG 50 HD3 ARG 50 -1.503 1.790 18.895 407 HE ARG 50 HE ARG 50 -2.646 2.281 21.471 408 HH11 ARG 50 HH11 ARG 50 -2.502 3.730 18.242 409 HH12 ARG 50 HH12 ARG 50 -4.010 4.578 18.441 410 HH21 ARG 50 HH21 ARG 50 -4.624 3.396 21.683 411 HH22 ARG 50 HH22 ARG 50 -5.206 4.384 20.365 412 H ILE 51 H ILE 51 3.250 1.670 17.756 413 HA ILE 51 HA ILE 51 5.185 -0.177 19.030 414 HB ILE 51 HB ILE 51 4.479 0.443 16.141 415 HG12 ILE 51 HG12 ILE 51 3.939 -2.021 17.866 416 HG13 ILE 51 HG13 ILE 51 2.746 -0.745 17.574 417 HG21 ILE 51 HG21 ILE 51 5.880 -1.487 15.559 418 HG22 ILE 51 HG22 ILE 51 6.849 -0.284 16.429 419 HG23 ILE 51 HG23 ILE 51 6.276 -1.735 17.280 420 HD11 ILE 51 HD11 ILE 51 2.870 -1.143 15.151 421 HD12 ILE 51 HD12 ILE 51 4.002 -2.494 15.441 422 HD13 ILE 51 HD13 ILE 51 2.332 -2.568 16.061 423 H GLN 52 H GLN 52 5.078 2.758 16.904 424 HA GLN 52 HA GLN 52 7.936 3.084 17.005 425 HB2 GLN 52 HB2 GLN 52 5.720 5.036 16.249 426 HB3 GLN 52 HB3 GLN 52 7.440 5.316 15.973 427 HG2 GLN 52 HG2 GLN 52 5.695 3.185 14.724 428 HG3 GLN 52 HG3 GLN 52 6.629 4.479 13.935 429 HE21 GLN 52 HE22 GLN 52 6.582 1.196 14.713 430 HE22 GLN 52 HE21 GLN 52 8.289 0.840 14.549 431 H ALA 53 H ALA 53 5.825 3.307 19.516 432 HA ALA 53 HA ALA 53 6.708 5.677 20.828 433 HB1 ALA 53 HB1 ALA 53 5.724 3.021 21.960 434 HB2 ALA 53 HB2 ALA 53 5.815 4.558 22.849 435 HB3 ALA 53 HB3 ALA 53 4.701 4.393 21.475 436 H GLY 54 H GLY 54 8.361 2.682 20.138 437 HA2 GLY 54 HA2 GLY 54 10.870 3.446 20.668 438 HA3 GLY 54 HA3 GLY 54 10.312 3.103 22.313 439 H LEU 55 H LEU 55 9.019 1.071 19.690 440 HA LEU 55 HA LEU 55 10.940 -1.060 20.254 441 HB2 LEU 55 HB2 LEU 55 9.157 -2.482 21.365 442 HB3 LEU 55 HB3 LEU 55 9.760 -1.123 22.307 443 HG LEU 55 HG LEU 55 7.719 0.215 21.513 444 HD11 LEU 55 HD11 LEU 55 6.781 -2.579 20.724 445 HD12 LEU 55 HD12 LEU 55 5.745 -1.144 20.889 446 HD13 LEU 55 HD13 LEU 55 6.983 -1.182 19.630 447 HD21 LEU 55 HD21 LEU 55 7.984 -0.697 23.742 448 HD22 LEU 55 HD22 LEU 55 6.294 -0.830 23.212 449 HD23 LEU 55 HD23 LEU 55 7.343 -2.273 23.204 450 H THR 56 H THR 56 9.939 -3.249 19.490 451 HA THR 56 HA THR 56 7.935 -3.005 17.350 452 HB THR 56 HB THR 56 9.401 -4.428 15.843 453 HG1 THR 56 HG1 THR 56 11.446 -3.407 17.525 454 HG21 THR 56 HG21 THR 56 8.968 -2.018 15.442 455 HG22 THR 56 HG22 THR 56 10.434 -1.615 16.370 456 HG23 THR 56 HG23 THR 56 10.568 -2.539 14.864 457 H ALA 57 H ALA 57 8.800 -4.365 20.124 458 HA ALA 57 HA ALA 57 7.234 -6.790 19.550 459 HB1 ALA 57 HB1 ALA 57 8.907 -8.218 20.706 460 HB2 ALA 57 HB2 ALA 57 9.553 -7.520 19.206 461 HB3 ALA 57 HB3 ALA 57 10.017 -6.834 20.782 462 HA PRO 58 HA PRO 58 5.483 -5.249 23.407 463 HB2 PRO 58 HB2 PRO 58 4.518 -8.107 23.389 464 HB3 PRO 58 HB3 PRO 58 3.623 -6.611 23.815 465 HG2 PRO 58 HG2 PRO 58 3.297 -7.733 21.364 466 HG3 PRO 58 HG3 PRO 58 3.521 -5.955 21.504 467 HD2 PRO 58 HD2 PRO 58 5.581 -8.048 20.776 468 HD3 PRO 58 HD3 PRO 58 5.273 -6.451 20.026 469 H ASP 59 H ASP 59 5.268 -6.094 25.690 470 HA ASP 59 HA ASP 59 7.817 -6.498 26.794 471 HB2 ASP 59 HB2 ASP 59 5.742 -5.467 27.799 472 HB3 ASP 59 HB3 ASP 59 5.117 -7.097 28.046 473 H5' U 36 H5' U 36 -7.578 9.293 -17.283 474 H5'' U 36 H5'' U 36 -8.105 9.916 -15.707 475 H4' U 36 H4' U 36 -6.268 11.438 -17.617 476 H3' U 36 H3' U 36 -5.357 9.179 -16.544 477 H2' U 36 H2' U 36 -6.379 9.374 -14.466 478 HO2' U 36 HO2' U 36 -3.806 10.540 -14.164 479 H1' U 36 H1' U 36 -5.489 12.210 -14.005 480 H3 U 36 H3 U 36 -9.397 13.817 -12.084 481 H5 U 36 H5 U 36 -9.465 9.636 -11.659 482 H6 U 36 H6 U 36 -7.587 9.492 -13.134 483 HO5' U 36 HO5' U 36 -9.590 10.397 -17.400 484 H5' C 37 H5' C 37 -1.962 8.821 -15.987 485 H5'' C 37 H5'' C 37 -0.962 9.908 -16.935 486 H4' C 37 H4' C 37 0.299 8.082 -17.345 487 H3' C 37 H3' C 37 -1.278 8.288 -19.541 488 H2' C 37 H2' C 37 -3.157 7.117 -18.679 489 HO2' C 37 HO2' C 37 -1.485 5.230 -19.990 490 H1' C 37 H1' C 37 -1.490 4.882 -17.585 491 H41 C 37 H41 C 37 -6.587 4.155 -13.867 492 H42 C 37 H42 C 37 -6.936 5.871 -13.887 493 H5 C 37 H5 C 37 -5.564 7.495 -15.159 494 H6 C 37 H6 C 37 -3.671 7.720 -16.609 495 H5' A 38 H5' A 38 2.273 9.261 -17.811 496 H5'' A 38 H5'' A 38 3.683 8.768 -18.777 497 H4' A 38 H4' A 38 4.328 9.006 -16.456 498 H3' A 38 H3' A 38 5.028 6.824 -17.936 499 H2' A 38 H2' A 38 3.073 5.552 -17.324 500 HO2' A 38 HO2' A 38 5.184 4.917 -15.532 501 H1' A 38 H1' A 38 3.617 6.371 -14.460 502 H8 A 38 H8 A 38 1.390 4.626 -16.887 503 H61 A 38 H61 A 38 -2.880 4.438 -12.377 504 H62 A 38 H62 A 38 -2.399 3.776 -13.928 505 H2 A 38 H2 A 38 0.279 7.346 -11.197 506 H5' G 39 H5' G 39 5.147 9.644 -14.730 507 H5'' G 39 H5'' G 39 6.521 10.688 -15.131 508 H4' G 39 H4' G 39 5.940 11.364 -12.965 509 H3' G 39 H3' G 39 8.423 10.291 -13.197 510 H2' G 39 H2' G 39 7.804 8.053 -12.665 511 HO2' G 39 HO2' G 39 8.384 7.636 -10.508 512 H1' G 39 H1' G 39 6.044 8.928 -10.395 513 H8 G 39 H8 G 39 3.735 7.587 -12.624 514 H1 G 39 H1 G 39 7.285 2.699 -10.453 515 H21 G 39 H21 G 39 9.124 3.447 -9.549 516 H22 G 39 H22 G 39 9.506 5.150 -9.448 517 H5' G 40 H5' G 40 7.277 11.152 -8.705 518 H5'' G 40 H5'' G 40 8.346 12.493 -8.275 519 H4' G 40 H4' G 40 7.766 11.085 -6.345 520 H3' G 40 H3' G 40 10.349 12.031 -6.971 521 H2' G 40 H2' G 40 11.057 9.812 -7.639 522 HO2' G 40 HO2' G 40 12.377 10.598 -5.850 523 H1' G 40 H1' G 40 9.383 8.873 -5.283 524 H8 G 40 H8 G 40 10.033 7.632 -8.915 525 H1 G 40 H1 G 40 11.764 3.555 -4.280 526 H21 G 40 H21 G 40 11.506 4.523 -2.290 527 H22 G 40 H22 G 40 10.833 6.126 -2.127 528 H5' A 41 H5' A 41 7.373 13.902 -3.818 529 H5'' A 41 H5'' A 41 7.176 12.668 -5.075 530 H4' A 41 H4' A 41 7.190 15.634 -5.734 531 H3' A 41 H3' A 41 4.993 13.949 -4.567 532 H2' A 41 H2' A 41 3.446 14.593 -6.187 533 HO2' A 41 HO2' A 41 3.896 16.868 -5.841 534 H1' A 41 H1' A 41 5.201 15.077 -8.326 535 H8 A 41 H8 A 41 4.554 11.963 -6.046 536 H61 A 41 H61 A 41 2.457 9.414 -11.323 537 H62 A 41 H62 A 41 2.645 9.152 -9.600 538 H2 A 41 H2 A 41 3.944 13.471 -12.248 539 H5' C 42 H5' C 42 2.274 14.399 -1.914 540 H5'' C 42 H5'' C 42 2.991 13.866 -3.451 541 H4' C 42 H4' C 42 1.233 14.781 -4.750 542 H3' C 42 H3' C 42 0.434 16.256 -2.231 543 H2' C 42 H2' C 42 -1.847 16.212 -3.063 544 HO2' C 42 HO2' C 42 -2.330 15.706 -5.099 545 H1' C 42 H1' C 42 -1.842 13.594 -3.697 546 H41 C 42 H41 C 42 -3.317 14.106 2.503 547 H42 C 42 H42 C 42 -1.639 13.813 2.920 548 H5 C 42 H5 C 42 0.132 13.661 1.235 549 H6 C 42 H6 C 42 0.579 13.768 -1.178 550 H5' A 43 H5' A 43 -1.539 17.684 -6.440 551 H5'' A 43 H5'' A 43 -0.005 16.810 -6.275 552 H4' A 43 H4' A 43 0.129 19.037 -8.194 553 H3' A 43 H3' A 43 -1.739 16.695 -8.570 554 H2' A 43 H2' A 43 -0.965 16.461 -10.850 555 HO2' A 43 HO2' A 43 -0.634 18.723 -11.297 556 H1' A 43 H1' A 43 1.608 16.376 -10.151 557 H8 A 43 H8 A 43 -0.292 14.987 -7.057 558 H61 A 43 H61 A 43 -0.649 9.732 -10.317 559 H62 A 43 H62 A 43 -0.878 10.461 -8.732 560 H2 A 43 H2 A 43 0.847 12.887 -13.025 561 H5' U 44 H5' U 44 -6.100 17.969 -8.700 562 H5'' U 44 H5'' U 44 -4.717 18.545 -7.763 563 H4' U 44 H4' U 44 -5.929 17.009 -6.387 564 H3' U 44 H3' U 44 -3.205 16.439 -7.256 565 HO3' U 44 HO3' U 44 -3.799 17.393 -5.251 566 H2' U 44 H2' U 44 -3.192 14.093 -7.060 567 HO2' U 44 HO2' U 44 -4.156 14.331 -4.874 568 H1' U 44 H1' U 44 -5.716 13.432 -7.706 569 H3 U 44 H3 U 44 -5.952 14.284 -12.322 570 H5 U 44 H5 U 44 -1.945 14.611 -11.121 571 H6 U 44 H6 U 44 -2.657 14.568 -8.836 572 H1 MET 1 H1 MET 1 0.818 -12.667 3.734 573 H2 MET 1 H2 MET 1 -0.096 -12.909 5.080 574 H3 MET 1 H3 MET 1 0.793 -11.532 4.929 575 HA MET 1 HA MET 1 -0.516 -10.781 3.098 576 HB2 MET 1 HB2 MET 1 -1.083 -13.070 2.259 577 HB3 MET 1 HB3 MET 1 -2.135 -13.301 3.665 578 HG2 MET 1 HG2 MET 1 -3.524 -12.684 1.803 579 HG3 MET 1 HG3 MET 1 -3.493 -11.332 2.934 580 HE1 MET 1 HE1 MET 1 -4.563 -9.818 1.035 581 HE2 MET 1 HE2 MET 1 -3.898 -9.684 -0.609 582 HE3 MET 1 HE3 MET 1 -4.564 -11.236 -0.039 583 H LEU 2 H LEU 2 -1.917 -9.185 3.663 584 HA LEU 2 HA LEU 2 -3.642 -9.579 6.035 585 HB2 LEU 2 HB2 LEU 2 -1.310 -7.800 5.752 586 HB3 LEU 2 HB3 LEU 2 -2.792 -6.903 6.137 587 HG LEU 2 HG LEU 2 -1.602 -9.207 7.715 588 HD11 LEU 2 HD11 LEU 2 -0.371 -7.071 7.867 589 HD12 LEU 2 HD12 LEU 2 -1.872 -6.235 8.323 590 HD13 LEU 2 HD13 LEU 2 -1.175 -7.472 9.401 591 HD21 LEU 2 HD21 LEU 2 -3.291 -8.581 9.423 592 HD22 LEU 2 HD22 LEU 2 -4.062 -7.470 8.252 593 HD23 LEU 2 HD23 LEU 2 -4.057 -9.224 7.962 594 H ILE 3 H ILE 3 -5.514 -8.218 5.997 595 HA ILE 3 HA ILE 3 -5.977 -6.709 3.478 596 HB ILE 3 HB ILE 3 -7.818 -8.841 4.652 597 HG12 ILE 3 HG12 ILE 3 -7.667 -9.530 2.115 598 HG13 ILE 3 HG13 ILE 3 -6.145 -8.629 2.124 599 HG21 ILE 3 HG21 ILE 3 -8.238 -6.902 2.338 600 HG22 ILE 3 HG22 ILE 3 -9.310 -8.250 2.767 601 HG23 ILE 3 HG23 ILE 3 -9.120 -6.895 3.892 602 HD11 ILE 3 HD11 ILE 3 -6.892 -10.940 3.971 603 HD12 ILE 3 HD12 ILE 3 -5.866 -11.071 2.523 604 HD13 ILE 3 HD13 ILE 3 -5.297 -10.148 3.917 605 H LEU 4 H LEU 4 -7.185 -4.935 3.719 606 HA LEU 4 HA LEU 4 -8.298 -4.239 6.401 607 HB2 LEU 4 HB2 LEU 4 -6.433 -2.673 4.563 608 HB3 LEU 4 HB3 LEU 4 -7.495 -1.872 5.714 609 HG LEU 4 HG LEU 4 -5.280 -1.966 6.591 610 HD11 LEU 4 HD11 LEU 4 -7.227 -2.174 8.120 611 HD12 LEU 4 HD12 LEU 4 -7.012 -3.948 8.100 612 HD13 LEU 4 HD13 LEU 4 -5.743 -2.908 8.772 613 HD21 LEU 4 HD21 LEU 4 -4.510 -4.071 5.437 614 HD22 LEU 4 HD22 LEU 4 -4.070 -3.937 7.151 615 HD23 LEU 4 HD23 LEU 4 -5.406 -4.991 6.683 616 H THR 5 H THR 5 -9.942 -2.530 6.236 617 HA THR 5 HA THR 5 -10.856 -1.920 3.484 618 HB THR 5 HB THR 5 -12.944 -2.465 5.599 619 HG1 THR 5 HG1 THR 5 -11.670 -4.372 5.356 620 HG21 THR 5 HG21 THR 5 -12.830 -2.571 2.556 621 HG22 THR 5 HG22 THR 5 -14.267 -2.949 3.533 622 HG23 THR 5 HG23 THR 5 -13.598 -1.301 3.532 623 H ARG 6 H ARG 6 -9.904 0.005 3.661 624 HA ARG 6 HA ARG 6 -10.531 1.834 5.925 625 HB2 ARG 6 HB2 ARG 6 -8.170 1.033 4.673 626 HB3 ARG 6 HB3 ARG 6 -8.528 2.560 3.868 627 HG2 ARG 6 HG2 ARG 6 -8.673 3.708 6.049 628 HG3 ARG 6 HG3 ARG 6 -8.412 2.152 6.890 629 HD2 ARG 6 HD2 ARG 6 -6.266 3.400 6.660 630 HD3 ARG 6 HD3 ARG 6 -6.265 1.869 5.780 631 HE ARG 6 HE ARG 6 -6.770 4.513 4.478 632 HH11 ARG 6 HH21 ARG 6 -5.735 1.150 4.260 633 HH12 ARG 6 HH22 ARG 6 -4.759 1.397 2.830 634 HH21 ARG 6 HH11 ARG 6 -5.300 4.838 2.667 635 HH22 ARG 6 HH12 ARG 6 -4.572 3.438 1.905 636 H LYS 7 H LYS 7 -10.451 4.281 5.052 637 HA LYS 7 HA LYS 7 -11.786 4.381 2.390 638 HB2 LYS 7 HB2 LYS 7 -13.392 6.050 3.219 639 HB3 LYS 7 HB3 LYS 7 -13.644 4.501 4.004 640 HG2 LYS 7 HG2 LYS 7 -12.789 5.255 6.056 641 HG3 LYS 7 HG3 LYS 7 -11.788 6.506 5.286 642 HD2 LYS 7 HD2 LYS 7 -13.888 7.714 4.609 643 HD3 LYS 7 HD3 LYS 7 -14.846 6.489 5.439 644 HE2 LYS 7 HE2 LYS 7 -14.638 8.450 6.833 645 HE3 LYS 7 HE3 LYS 7 -13.758 7.102 7.583 646 HZ1 LYS 7 HZ1 LYS 7 -12.502 9.152 7.633 647 HZ2 LYS 7 HZ2 LYS 7 -11.723 8.045 6.715 648 HZ3 LYS 7 HZ3 LYS 7 -12.544 9.278 5.997 649 H VAL 8 H VAL 8 -12.112 6.728 1.702 650 HA VAL 8 HA VAL 8 -9.510 7.597 1.142 651 HB VAL 8 HB VAL 8 -10.466 9.410 -0.035 652 HG11 VAL 8 HG11 VAL 8 -12.354 7.007 -0.146 653 HG12 VAL 8 HG12 VAL 8 -12.059 8.176 -1.445 654 HG13 VAL 8 HG13 VAL 8 -10.754 7.089 -0.915 655 HG21 VAL 8 HG21 VAL 8 -12.089 10.307 1.547 656 HG22 VAL 8 HG22 VAL 8 -12.841 9.937 -0.017 657 HG23 VAL 8 HG23 VAL 8 -13.096 8.842 1.371 658 H GLY 9 H GLY 9 -8.122 8.991 1.929 659 HA2 GLY 9 HA2 GLY 9 -7.441 10.938 3.081 660 HA3 GLY 9 HA3 GLY 9 -8.926 10.897 4.048 661 H GLU 10 H GLU 10 -8.116 7.758 4.236 662 HA GLU 10 HA GLU 10 -6.729 8.141 6.808 663 HB2 GLU 10 HB2 GLU 10 -7.853 5.677 5.432 664 HB3 GLU 10 HB3 GLU 10 -7.219 5.728 7.091 665 HG2 GLU 10 HG2 GLU 10 -9.625 7.271 6.036 666 HG3 GLU 10 HG3 GLU 10 -9.667 5.843 7.081 667 H SER 11 H SER 11 -5.143 6.118 7.276 668 HA SER 11 HA SER 11 -3.265 5.756 5.020 669 HB2 SER 11 HB2 SER 11 -2.541 7.054 7.676 670 HB3 SER 11 HB3 SER 11 -1.373 6.551 6.437 671 HG SER 11 HG SER 11 -2.282 8.045 5.035 672 H ILE 12 H ILE 12 -1.478 4.321 5.577 673 HA ILE 12 HA ILE 12 -1.845 2.452 7.849 674 HB ILE 12 HB ILE 12 -1.668 1.676 4.902 675 HG12 ILE 12 HG12 ILE 12 -3.945 2.324 5.607 676 HG13 ILE 12 HG13 ILE 12 -3.804 0.619 5.163 677 HG21 ILE 12 HG21 ILE 12 -1.631 -0.062 7.392 678 HG22 ILE 12 HG22 ILE 12 -1.942 -0.678 5.757 679 HG23 ILE 12 HG23 ILE 12 -0.376 0.045 6.125 680 HD11 ILE 12 HD11 ILE 12 -3.775 -0.031 7.545 681 HD12 ILE 12 HD12 ILE 12 -3.890 1.696 8.004 682 HD13 ILE 12 HD13 ILE 12 -5.224 0.900 7.153 683 H ASN 13 H ASN 13 0.209 0.989 7.941 684 HA ASN 13 HA ASN 13 2.581 2.438 6.866 685 HB2 ASN 13 HB2 ASN 13 1.977 1.714 9.751 686 HB3 ASN 13 HB3 ASN 13 3.611 2.050 9.165 687 HD21 ASN 13 HD22 ASN 13 4.097 4.174 8.239 688 HD22 ASN 13 HD21 ASN 13 3.162 5.551 8.768 689 H ILE 14 H ILE 14 4.464 1.250 6.710 690 HA ILE 14 HA ILE 14 4.357 -1.667 7.231 691 HB ILE 14 HB ILE 14 5.227 -0.411 4.594 692 HG12 ILE 14 HG12 ILE 14 2.803 -2.139 5.271 693 HG13 ILE 14 HG13 ILE 14 2.774 -0.421 4.844 694 HG21 ILE 14 HG21 ILE 14 5.529 -2.758 3.856 695 HG22 ILE 14 HG22 ILE 14 6.563 -2.407 5.237 696 HG23 ILE 14 HG23 ILE 14 5.062 -3.327 5.478 697 HD11 ILE 14 HD11 ILE 14 3.594 -2.708 3.024 698 HD12 ILE 14 HD12 ILE 14 2.151 -1.693 2.900 699 HD13 ILE 14 HD13 ILE 14 3.753 -0.980 2.614 700 H GLY 15 H GLY 15 6.422 -2.572 7.628 701 HA2 GLY 15 HA2 GLY 15 8.511 -2.521 8.611 702 HA3 GLY 15 HA3 GLY 15 8.908 -1.330 7.361 703 H ASP 16 H ASP 16 10.100 0.105 8.585 704 HA ASP 16 HA ASP 16 8.552 1.665 10.573 705 HB2 ASP 16 HB2 ASP 16 10.510 1.906 11.969 706 HB3 ASP 16 HB3 ASP 16 10.139 0.191 11.761 707 H ASP 17 H ASP 17 9.514 1.747 7.582 708 HA ASP 17 HA ASP 17 10.225 4.616 7.648 709 HB2 ASP 17 HB2 ASP 17 11.685 2.463 6.071 710 HB3 ASP 17 HB3 ASP 17 11.881 4.197 5.807 711 H ILE 18 H ILE 18 7.866 2.561 6.751 712 HA ILE 18 HA ILE 18 7.485 4.002 4.170 713 HB ILE 18 HB ILE 18 6.721 1.111 4.697 714 HG12 ILE 18 HG12 ILE 18 8.405 0.906 2.636 715 HG13 ILE 18 HG13 ILE 18 9.125 2.349 3.370 716 HG21 ILE 18 HG21 ILE 18 6.550 2.878 2.224 717 HG22 ILE 18 HG22 ILE 18 6.240 1.130 2.250 718 HG23 ILE 18 HG23 ILE 18 5.182 2.223 3.158 719 HD11 ILE 18 HD11 ILE 18 8.584 -0.324 4.755 720 HD12 ILE 18 HD12 ILE 18 10.168 0.221 4.165 721 HD13 ILE 18 HD13 ILE 18 9.383 1.071 5.514 722 H THR 19 H THR 19 5.434 4.657 3.671 723 HA THR 19 HA THR 19 3.228 4.113 5.580 724 HB THR 19 HB THR 19 4.091 6.886 4.651 725 HG1 THR 19 HG1 THR 19 4.621 7.163 6.826 726 HG21 THR 19 HG21 THR 19 2.404 7.643 6.337 727 HG22 THR 19 HG22 THR 19 1.668 6.776 4.984 728 HG23 THR 19 HG23 THR 19 1.889 5.949 6.543 729 H ILE 20 H ILE 20 1.159 4.457 4.645 730 HA ILE 20 HA ILE 20 1.071 4.828 1.681 731 HB ILE 20 HB ILE 20 -0.337 2.701 3.340 732 HG12 ILE 20 HG12 ILE 20 2.056 2.186 2.922 733 HG13 ILE 20 HG13 ILE 20 0.937 1.042 2.166 734 HG21 ILE 20 HG21 ILE 20 -1.136 1.857 1.119 735 HG22 ILE 20 HG22 ILE 20 -1.803 3.442 1.558 736 HG23 ILE 20 HG23 ILE 20 -0.493 3.329 0.365 737 HD11 ILE 20 HD11 ILE 20 2.845 1.661 0.691 738 HD12 ILE 20 HD12 ILE 20 1.269 2.064 -0.016 739 HD13 ILE 20 HD13 ILE 20 2.279 3.345 0.697 740 H THR 21 H THR 21 -0.788 5.896 0.961 741 HA THR 21 HA THR 21 -2.835 6.620 2.994 742 HB THR 21 HB THR 21 -1.432 8.613 1.173 743 HG1 THR 21 HG1 THR 21 -0.552 9.365 3.121 744 HG21 THR 21 HG21 THR 21 -3.789 9.211 1.698 745 HG22 THR 21 HG22 THR 21 -3.453 8.995 3.428 746 HG23 THR 21 HG23 THR 21 -2.649 10.293 2.525 747 H ILE 22 H ILE 22 -4.872 7.036 2.139 748 HA ILE 22 HA ILE 22 -5.242 6.238 -0.713 749 HB ILE 22 HB ILE 22 -6.305 4.700 0.708 750 HG12 ILE 22 HG12 ILE 22 -8.667 4.894 0.256 751 HG13 ILE 22 HG13 ILE 22 -8.493 6.628 -0.113 752 HG21 ILE 22 HG21 ILE 22 -6.326 6.064 2.813 753 HG22 ILE 22 HG22 ILE 22 -7.696 6.983 2.169 754 HG23 ILE 22 HG23 ILE 22 -7.862 5.240 2.482 755 HD11 ILE 22 HD11 ILE 22 -7.191 4.389 -1.673 756 HD12 ILE 22 HD12 ILE 22 -8.627 5.345 -2.148 757 HD13 ILE 22 HD13 ILE 22 -7.049 6.146 -1.993 758 H LEU 23 H LEU 23 -5.084 8.109 -1.859 759 HA LEU 23 HA LEU 23 -5.822 10.637 -0.740 760 HB2 LEU 23 HB2 LEU 23 -5.382 9.993 -3.669 761 HB3 LEU 23 HB3 LEU 23 -5.213 11.559 -2.866 762 HG LEU 23 HG LEU 23 -3.397 9.138 -2.615 763 HD11 LEU 23 HD11 LEU 23 -1.709 10.819 -3.328 764 HD12 LEU 23 HD12 LEU 23 -3.027 10.675 -4.520 765 HD13 LEU 23 HD13 LEU 23 -2.985 12.053 -3.399 766 HD21 LEU 23 HD21 LEU 23 -3.357 11.684 -0.951 767 HD22 LEU 23 HD22 LEU 23 -3.636 10.032 -0.349 768 HD23 LEU 23 HD23 LEU 23 -2.053 10.479 -1.027 769 H GLY 24 H GLY 24 -7.604 8.269 -2.704 770 HA2 GLY 24 HA2 GLY 24 -10.099 8.961 -1.942 771 HA3 GLY 24 HA3 GLY 24 -9.828 10.156 -3.192 772 H VAL 25 H VAL 25 -11.819 8.858 -4.009 773 HA VAL 25 HA VAL 25 -10.814 6.762 -5.862 774 HB VAL 25 HB VAL 25 -12.714 5.366 -5.513 775 HG11 VAL 25 HG11 VAL 25 -12.466 4.649 -3.214 776 HG12 VAL 25 HG12 VAL 25 -10.876 5.108 -3.861 777 HG13 VAL 25 HG13 VAL 25 -11.750 6.207 -2.755 778 HG21 VAL 25 HG21 VAL 25 -13.778 7.497 -3.633 779 HG22 VAL 25 HG22 VAL 25 -14.461 7.017 -5.207 780 HG23 VAL 25 HG23 VAL 25 -14.476 5.872 -3.858 781 H SER 26 H SER 26 -12.235 6.386 -7.706 782 HA SER 26 HA SER 26 -14.303 8.369 -8.286 783 HB2 SER 26 HB2 SER 26 -12.193 9.468 -9.032 784 HB3 SER 26 HB3 SER 26 -11.853 8.083 -10.085 785 HG SER 26 HG SER 26 -12.928 9.793 -11.174 786 H GLY 27 H GLY 27 -15.716 6.552 -8.273 787 HA2 GLY 27 HA2 GLY 27 -16.949 4.959 -9.433 788 HA3 GLY 27 HA3 GLY 27 -15.811 5.118 -10.788 789 H GLN 28 H GLN 28 -14.048 3.722 -10.953 790 HA GLN 28 HA GLN 28 -13.821 1.587 -8.859 791 HB2 GLN 28 HB2 GLN 28 -13.042 1.530 -11.800 792 HB3 GLN 28 HB3 GLN 28 -12.760 0.232 -10.634 793 HG2 GLN 28 HG2 GLN 28 -15.475 1.258 -11.492 794 HG3 GLN 28 HG3 GLN 28 -14.638 -0.198 -12.088 795 HE21 GLN 28 HE22 GLN 28 -15.905 1.285 -9.024 796 HE22 GLN 28 HE21 GLN 28 -16.270 -0.240 -8.263 797 H GLN 29 H GLN 29 -12.259 4.253 -10.509 798 HA GLN 29 HA GLN 29 -9.563 3.378 -9.965 799 HB2 GLN 29 HB2 GLN 29 -10.765 6.122 -10.537 800 HB3 GLN 29 HB3 GLN 29 -9.060 5.853 -10.154 801 HG2 GLN 29 HG2 GLN 29 -9.171 5.893 -12.513 802 HG3 GLN 29 HG3 GLN 29 -8.923 4.212 -12.047 803 HE21 GLN 29 HE22 GLN 29 -10.491 2.677 -12.535 804 HE22 GLN 29 HE21 GLN 29 -11.975 3.069 -13.394 805 H VAL 30 H VAL 30 -8.222 3.925 -8.327 806 HA VAL 30 HA VAL 30 -9.304 5.172 -5.867 807 HB VAL 30 HB VAL 30 -7.834 2.496 -6.079 808 HG11 VAL 30 HG11 VAL 30 -7.217 3.920 -4.085 809 HG12 VAL 30 HG12 VAL 30 -8.936 3.887 -3.611 810 HG13 VAL 30 HG13 VAL 30 -7.994 2.378 -3.680 811 HG21 VAL 30 HG21 VAL 30 -9.896 1.574 -5.033 812 HG22 VAL 30 HG22 VAL 30 -10.672 3.168 -5.188 813 HG23 VAL 30 HG23 VAL 30 -10.210 2.261 -6.641 814 H ARG 31 H ARG 31 -8.027 6.947 -5.857 815 HA ARG 31 HA ARG 31 -5.305 6.823 -6.928 816 HB2 ARG 31 HB2 ARG 31 -6.860 8.748 -7.293 817 HB3 ARG 31 HB3 ARG 31 -6.783 9.106 -5.551 818 HG2 ARG 31 HG2 ARG 31 -4.373 9.486 -5.706 819 HG3 ARG 31 HG3 ARG 31 -4.357 8.956 -7.405 820 HD2 ARG 31 HD2 ARG 31 -5.992 11.309 -6.404 821 HD3 ARG 31 HD3 ARG 31 -4.345 11.476 -7.043 822 HE ARG 31 HE ARG 31 -6.799 10.912 -8.557 823 HH11 ARG 31 HH11 ARG 31 -3.272 10.956 -8.562 824 HH12 ARG 31 HH12 ARG 31 -3.153 10.907 -10.310 825 HH21 ARG 31 HH21 ARG 31 -6.617 10.860 -10.831 826 HH22 ARG 31 HH22 ARG 31 -5.037 10.884 -11.584 827 H ILE 32 H ILE 32 -3.524 6.485 -5.764 828 HA ILE 32 HA ILE 32 -3.799 6.385 -2.792 829 HB ILE 32 HB ILE 32 -2.209 4.351 -4.376 830 HG12 ILE 32 HG12 ILE 32 -5.167 4.233 -3.686 831 HG13 ILE 32 HG13 ILE 32 -4.394 4.111 -5.277 832 HG21 ILE 32 HG21 ILE 32 -3.508 4.271 -1.620 833 HG22 ILE 32 HG22 ILE 32 -2.457 3.022 -2.323 834 HG23 ILE 32 HG23 ILE 32 -1.784 4.598 -1.924 835 HD11 ILE 32 HD11 ILE 32 -4.232 2.065 -3.031 836 HD12 ILE 32 HD12 ILE 32 -5.070 1.909 -4.580 837 HD13 ILE 32 HD13 ILE 32 -3.296 1.987 -4.551 838 H GLY 33 H GLY 33 -1.794 6.623 -1.638 839 HA2 GLY 33 HA2 GLY 33 0.453 7.736 -3.259 840 HA3 GLY 33 HA3 GLY 33 -0.107 8.528 -1.776 841 H ILE 34 H ILE 34 2.537 7.507 -2.277 842 HA ILE 34 HA ILE 34 2.768 5.464 -0.132 843 HB ILE 34 HB ILE 34 4.160 5.346 -2.842 844 HG12 ILE 34 HG12 ILE 34 1.986 3.477 -1.812 845 HG13 ILE 34 HG13 ILE 34 1.700 4.789 -2.973 846 HG21 ILE 34 HG21 ILE 34 5.514 4.423 -1.029 847 HG22 ILE 34 HG22 ILE 34 4.149 3.433 -0.465 848 HG23 ILE 34 HG23 ILE 34 4.925 3.098 -2.028 849 HD11 ILE 34 HD11 ILE 34 3.511 2.391 -3.411 850 HD12 ILE 34 HD12 ILE 34 1.970 2.749 -4.213 851 HD13 ILE 34 HD13 ILE 34 3.377 3.798 -4.502 852 H ASN 35 H ASN 35 4.687 5.628 1.037 853 HA ASN 35 HA ASN 35 6.514 7.824 0.249 854 HB2 ASN 35 HB2 ASN 35 4.578 8.633 1.672 855 HB3 ASN 35 HB3 ASN 35 5.196 7.627 2.980 856 HD21 ASN 35 HD22 ASN 35 4.899 10.639 2.521 857 HD22 ASN 35 HD21 ASN 35 6.483 11.308 2.839 858 H ALA 36 H ALA 36 8.353 6.748 0.064 859 HA ALA 36 HA ALA 36 9.430 5.286 2.394 860 HB1 ALA 36 HB1 ALA 36 8.321 3.538 1.034 861 HB2 ALA 36 HB2 ALA 36 9.195 4.103 -0.410 862 HB3 ALA 36 HB3 ALA 36 10.097 3.383 0.936 863 HA PRO 37 HA PRO 37 13.177 7.197 1.038 864 HB2 PRO 37 HB2 PRO 37 15.015 5.230 1.716 865 HB3 PRO 37 HB3 PRO 37 14.259 6.363 2.897 866 HG2 PRO 37 HG2 PRO 37 13.526 3.508 2.231 867 HG3 PRO 37 HG3 PRO 37 13.616 4.291 3.842 868 HD2 PRO 37 HD2 PRO 37 11.257 3.923 2.528 869 HD3 PRO 37 HD3 PRO 37 11.556 5.385 3.520 870 H LYS 38 H LYS 38 14.840 7.053 -0.616 871 HA LYS 38 HA LYS 38 14.128 5.364 -2.859 872 HB2 LYS 38 HB2 LYS 38 16.495 7.211 -2.319 873 HB3 LYS 38 HB3 LYS 38 16.237 6.382 -3.856 874 HG2 LYS 38 HG2 LYS 38 14.201 8.247 -2.560 875 HG3 LYS 38 HG3 LYS 38 15.363 8.767 -3.782 876 HD2 LYS 38 HD2 LYS 38 13.641 6.385 -4.457 877 HD3 LYS 38 HD3 LYS 38 12.860 7.960 -4.336 878 HE2 LYS 38 HE2 LYS 38 13.547 7.553 -6.638 879 HE3 LYS 38 HE3 LYS 38 14.466 8.902 -5.967 880 HZ1 LYS 38 HZ1 LYS 38 15.442 6.122 -6.162 881 HZ2 LYS 38 HZ2 LYS 38 15.839 7.335 -7.197 882 HZ3 LYS 38 HZ3 LYS 38 16.308 7.413 -5.625 883 H ASP 39 H ASP 39 15.653 4.683 -0.035 884 HA ASP 39 HA ASP 39 17.667 2.803 -0.879 885 HB2 ASP 39 HB2 ASP 39 16.029 3.159 1.650 886 HB3 ASP 39 HB3 ASP 39 17.272 1.917 1.478 887 H VAL 40 H VAL 40 14.313 2.794 -1.269 888 HA VAL 40 HA VAL 40 14.311 -0.125 -1.778 889 HB VAL 40 HB VAL 40 12.116 -0.361 -0.756 890 HG11 VAL 40 HG11 VAL 40 13.987 1.039 1.210 891 HG12 VAL 40 HG12 VAL 40 12.688 -0.104 1.607 892 HG13 VAL 40 HG13 VAL 40 14.126 -0.664 0.714 893 HG21 VAL 40 HG21 VAL 40 11.345 1.998 -1.136 894 HG22 VAL 40 HG22 VAL 40 11.041 1.386 0.504 895 HG23 VAL 40 HG23 VAL 40 12.405 2.491 0.216 896 H ALA 41 H ALA 41 12.246 -0.684 -3.102 897 HA ALA 41 HA ALA 41 11.990 1.483 -5.129 898 HB1 ALA 41 HB1 ALA 41 11.718 -0.337 -6.760 899 HB2 ALA 41 HB2 ALA 41 13.233 -0.542 -5.855 900 HB3 ALA 41 HB3 ALA 41 11.814 -1.544 -5.464 901 H VAL 42 H VAL 42 9.970 1.717 -6.244 902 HA VAL 42 HA VAL 42 7.668 0.159 -5.356 903 HB VAL 42 HB VAL 42 7.484 1.658 -3.585 904 HG11 VAL 42 HG11 VAL 42 8.384 3.860 -5.474 905 HG12 VAL 42 HG12 VAL 42 7.736 4.149 -3.838 906 HG13 VAL 42 HG13 VAL 42 9.231 3.224 -4.043 907 HG21 VAL 42 HG21 VAL 42 5.603 3.141 -4.103 908 HG22 VAL 42 HG22 VAL 42 5.920 3.008 -5.831 909 HG23 VAL 42 HG23 VAL 42 5.399 1.564 -4.909 910 H HIS 43 H HIS 43 6.402 -0.185 -7.048 911 HA HIS 43 HA HIS 43 5.898 1.863 -9.061 912 HB2 HIS 43 HB2 HIS 43 6.915 -0.806 -10.071 913 HB3 HIS 43 HB3 HIS 43 6.772 0.731 -10.923 914 HD2 HIS 43 HD2 HIS 43 9.022 -1.071 -8.332 915 HE1 HIS 43 HE1 HIS 43 11.317 2.103 -9.980 916 HE2 HIS 43 HE2 HIS 43 11.375 0.084 -8.439 917 H ARG 44 H ARG 44 4.241 0.839 -10.767 918 HA ARG 44 HA ARG 44 2.397 -0.795 -9.186 919 HB2 ARG 44 HB2 ARG 44 0.808 -0.464 -10.913 920 HB3 ARG 44 HB3 ARG 44 1.558 1.090 -10.538 921 HG2 ARG 44 HG2 ARG 44 2.940 0.942 -12.572 922 HG3 ARG 44 HG3 ARG 44 2.254 -0.670 -12.929 923 HD2 ARG 44 HD2 ARG 44 -0.035 0.382 -12.885 924 HD3 ARG 44 HD3 ARG 44 0.742 1.969 -12.752 925 HE ARG 44 HE ARG 44 1.893 0.786 -14.995 926 HH11 ARG 44 HH11 ARG 44 -1.379 1.626 -13.944 927 HH12 ARG 44 HH12 ARG 44 -1.942 1.927 -15.576 928 HH21 ARG 44 HH21 ARG 44 1.092 1.083 -17.098 929 HH22 ARG 44 HH22 ARG 44 -0.549 1.640 -17.353 930 H GLU 45 H GLU 45 1.334 -2.731 -10.365 931 HA GLU 45 HA GLU 45 3.354 -4.666 -10.403 932 HB2 GLU 45 HB2 GLU 45 0.872 -4.837 -9.876 933 HB3 GLU 45 HB3 GLU 45 0.571 -4.986 -11.611 934 HG2 GLU 45 HG2 GLU 45 2.415 -6.817 -10.008 935 HG3 GLU 45 HG3 GLU 45 0.695 -7.138 -10.250 936 H GLU 46 H GLU 46 2.158 -2.704 -13.056 937 HA GLU 46 HA GLU 46 2.939 -4.438 -15.214 938 HB2 GLU 46 HB2 GLU 46 1.356 -2.514 -15.409 939 HB3 GLU 46 HB3 GLU 46 2.681 -1.402 -15.048 940 HG2 GLU 46 HG2 GLU 46 3.893 -2.183 -17.071 941 HG3 GLU 46 HG3 GLU 46 2.570 -3.300 -17.427 942 H ILE 47 H ILE 47 4.566 -1.725 -13.495 943 HA ILE 47 HA ILE 47 6.824 -1.770 -15.326 944 HB ILE 47 HB ILE 47 6.609 -0.420 -12.618 945 HG12 ILE 47 HG12 ILE 47 4.622 0.253 -13.750 946 HG13 ILE 47 HG13 ILE 47 5.773 1.588 -13.847 947 HG21 ILE 47 HG21 ILE 47 8.121 1.247 -13.675 948 HG22 ILE 47 HG22 ILE 47 8.838 -0.371 -13.640 949 HG23 ILE 47 HG23 ILE 47 8.159 0.259 -15.155 950 HD11 ILE 47 HD11 ILE 47 5.138 -0.408 -16.061 951 HD12 ILE 47 HD12 ILE 47 4.606 1.283 -15.980 952 HD13 ILE 47 HD13 ILE 47 6.332 0.911 -16.184 953 H TYR 48 H TYR 48 5.972 -3.270 -12.270 954 HA TYR 48 HA TYR 48 8.553 -3.789 -11.233 955 HB2 TYR 48 HB2 TYR 48 6.396 -4.010 -10.044 956 HB3 TYR 48 HB3 TYR 48 5.985 -5.397 -11.055 957 HD1 TYR 48 HD1 TYR 48 8.393 -4.170 -8.470 958 HD2 TYR 48 HD2 TYR 48 6.801 -7.578 -10.565 959 HE1 TYR 48 HE1 TYR 48 9.451 -5.666 -6.822 960 HE2 TYR 48 HE2 TYR 48 7.828 -9.088 -8.909 961 HH TYR 48 HH TYR 48 9.759 -7.856 -6.135 962 H GLN 49 H GLN 49 6.721 -5.374 -13.831 963 HA GLN 49 HA GLN 49 8.297 -7.791 -13.848 964 HB2 GLN 49 HB2 GLN 49 6.480 -6.469 -15.903 965 HB3 GLN 49 HB3 GLN 49 7.171 -8.096 -16.080 966 HG2 GLN 49 HG2 GLN 49 6.008 -8.883 -14.095 967 HG3 GLN 49 HG3 GLN 49 5.473 -7.252 -13.694 968 HE21 GLN 49 HE22 GLN 49 3.278 -8.043 -13.700 969 HE22 GLN 49 HE21 GLN 49 2.415 -8.292 -15.191 970 H ARG 50 H ARG 50 8.753 -4.566 -15.153 971 HA ARG 50 HA ARG 50 10.757 -5.377 -17.142 972 HB2 ARG 50 HB2 ARG 50 9.670 -2.744 -16.066 973 HB3 ARG 50 HB3 ARG 50 11.147 -2.791 -17.022 974 HG2 ARG 50 HG2 ARG 50 9.316 -2.325 -18.513 975 HG3 ARG 50 HG3 ARG 50 9.911 -3.958 -18.854 976 HD2 ARG 50 HD2 ARG 50 8.028 -4.910 -17.552 977 HD3 ARG 50 HD3 ARG 50 7.475 -3.266 -17.161 978 HE ARG 50 HE ARG 50 7.717 -3.512 -19.985 979 HH11 ARG 50 HH11 ARG 50 5.656 -4.661 -17.345 980 HH12 ARG 50 HH12 ARG 50 4.300 -4.979 -18.400 981 HH21 ARG 50 HH21 ARG 50 5.910 -3.879 -21.312 982 HH22 ARG 50 HH22 ARG 50 4.420 -4.487 -20.620 983 H ILE 51 H ILE 51 10.622 -4.822 -13.754 984 HA ILE 51 HA ILE 51 13.454 -3.971 -13.588 985 HB ILE 51 HB ILE 51 11.137 -4.041 -11.631 986 HG12 ILE 51 HG12 ILE 51 12.625 -1.689 -12.874 987 HG13 ILE 51 HG13 ILE 51 11.145 -2.364 -13.570 988 HG21 ILE 51 HG21 ILE 51 13.286 -4.378 -10.448 989 HG22 ILE 51 HG22 ILE 51 13.943 -2.918 -11.242 990 HG23 ILE 51 HG23 ILE 51 12.598 -2.791 -10.089 991 HD11 ILE 51 HD11 ILE 51 9.916 -1.934 -11.498 992 HD12 ILE 51 HD12 ILE 51 11.385 -1.220 -10.769 993 HD13 ILE 51 HD13 ILE 51 10.622 -0.446 -12.180 994 H GLN 52 H GLN 52 11.203 -6.573 -12.619 995 HA GLN 52 HA GLN 52 13.356 -8.082 -11.329 996 HB2 GLN 52 HB2 GLN 52 10.473 -8.810 -12.024 997 HB3 GLN 52 HB3 GLN 52 11.575 -9.822 -11.079 998 HG2 GLN 52 HG2 GLN 52 10.468 -7.104 -10.321 999 HG3 GLN 52 HG3 GLN 52 10.249 -8.661 -9.500 1000 HE21 GLN 52 HE22 GLN 52 11.943 -5.759 -9.465 1001 HE22 GLN 52 HE21 GLN 52 13.307 -6.245 -8.477 1002 H ALA 53 H ALA 53 12.830 -7.357 -14.472 1003 HA ALA 53 HA ALA 53 12.912 -9.870 -15.786 1004 HB1 ALA 53 HB1 ALA 53 13.987 -7.152 -16.648 1005 HB2 ALA 53 HB2 ALA 53 13.674 -8.541 -17.715 1006 HB3 ALA 53 HB3 ALA 53 12.321 -7.743 -16.878 1007 H GLY 54 H GLY 54 15.417 -8.149 -14.012 1008 HA2 GLY 54 HA2 GLY 54 17.197 -10.090 -13.681 1009 HA3 GLY 54 HA3 GLY 54 17.547 -9.701 -15.373 1010 H LEU 55 H LEU 55 16.658 -7.171 -12.948 1011 HA LEU 55 HA LEU 55 19.495 -6.359 -12.857 1012 HB2 LEU 55 HB2 LEU 55 18.718 -4.047 -13.759 1013 HB3 LEU 55 HB3 LEU 55 19.101 -5.377 -14.874 1014 HG LEU 55 HG LEU 55 16.506 -5.828 -14.855 1015 HD11 LEU 55 HD11 LEU 55 15.814 -4.249 -13.102 1016 HD12 LEU 55 HD12 LEU 55 16.633 -2.916 -13.959 1017 HD13 LEU 55 HD13 LEU 55 15.219 -3.719 -14.673 1018 HD21 LEU 55 HD21 LEU 55 17.834 -5.090 -16.764 1019 HD22 LEU 55 HD22 LEU 55 16.276 -4.251 -16.710 1020 HD23 LEU 55 HD23 LEU 55 17.753 -3.402 -16.190 1021 H THR 56 H THR 56 16.185 -5.871 -11.721 1022 HA THR 56 HA THR 56 15.345 -4.255 -10.384 1023 HB THR 56 HB THR 56 17.338 -5.404 -8.395 1024 HG1 THR 56 HG1 THR 56 15.933 -7.150 -8.289 1025 HG21 THR 56 HG21 THR 56 14.416 -4.510 -8.263 1026 HG22 THR 56 HG22 THR 56 15.280 -5.318 -6.935 1027 HG23 THR 56 HG23 THR 56 15.795 -3.714 -7.486 1028 H ALA 57 H ALA 57 16.917 -2.821 -11.955 1029 HA ALA 57 HA ALA 57 17.976 -0.749 -10.132 1030 HB1 ALA 57 HB1 ALA 57 19.543 -1.939 -12.456 1031 HB2 ALA 57 HB2 ALA 57 20.034 -0.542 -11.473 1032 HB3 ALA 57 HB3 ALA 57 19.910 -2.156 -10.731 1033 HA PRO 58 HA PRO 58 15.062 0.735 -13.498 1034 HB2 PRO 58 HB2 PRO 58 14.575 2.543 -11.134 1035 HB3 PRO 58 HB3 PRO 58 13.411 1.964 -12.371 1036 HG2 PRO 58 HG2 PRO 58 13.524 0.780 -9.916 1037 HG3 PRO 58 HG3 PRO 58 13.396 -0.231 -11.394 1038 HD2 PRO 58 HD2 PRO 58 15.851 0.383 -9.746 1039 HD3 PRO 58 HD3 PRO 58 15.327 -1.160 -10.492 1040 H ASP 59 H ASP 59 14.764 3.010 -14.269 1041 HA ASP 59 HA ASP 59 17.245 4.064 -15.077 1042 HB2 ASP 59 HB2 ASP 59 14.949 4.159 -16.187 1043 HB3 ASP 59 HB3 ASP 59 14.534 5.435 -15.056 1044 H5' U 36 H5' U 36 -16.641 -5.074 10.402 1045 H5'' U 36 H5'' U 36 -16.391 -4.515 8.738 1046 H4' U 36 H4' U 36 -15.269 -7.116 9.889 1047 H3' U 36 H3' U 36 -14.330 -4.398 10.266 1048 H2' U 36 H2' U 36 -12.557 -4.223 8.740 1049 HO2' U 36 HO2' U 36 -11.600 -6.197 9.652 1050 H1' U 36 H1' U 36 -13.286 -5.861 6.725 1051 H3 U 36 H3 U 36 -16.842 -3.539 4.734 1052 H5 U 36 H5 U 36 -15.132 -1.021 7.625 1053 H6 U 36 H6 U 36 -13.862 -2.881 8.442 1054 HO5' U 36 HO5' U 36 -17.360 -6.469 8.033 1055 H5' C 37 H5' C 37 -12.359 -3.690 11.897 1056 H5'' C 37 H5'' C 37 -11.668 -4.871 12.999 1057 H4' C 37 H4' C 37 -11.094 -3.028 14.176 1058 H3' C 37 H3' C 37 -13.197 -4.123 15.472 1059 H2' C 37 H2' C 37 -14.882 -3.043 14.207 1060 HO2' C 37 HO2' C 37 -14.329 -1.355 16.436 1061 H1' C 37 H1' C 37 -13.582 -0.349 14.402 1062 H41 C 37 H41 C 37 -17.384 0.608 9.400 1063 H42 C 37 H42 C 37 -17.258 -1.063 8.885 1064 H5 C 37 H5 C 37 -15.881 -2.737 10.125 1065 H6 C 37 H6 C 37 -14.503 -3.056 12.031 1066 H5' A 38 H5' A 38 -11.024 -5.303 15.334 1067 H5'' A 38 H5'' A 38 -9.942 -5.603 16.701 1068 H4' A 38 H4' A 38 -8.773 -6.442 14.874 1069 H3' A 38 H3' A 38 -7.573 -4.383 16.242 1070 H2' A 38 H2' A 38 -8.496 -2.700 14.782 1071 HO2' A 38 HO2' A 38 -5.921 -3.374 13.772 1072 H1' A 38 H1' A 38 -7.601 -4.463 12.472 1073 H8 A 38 H8 A 38 -9.574 -1.445 13.620 1074 H61 A 38 H61 A 38 -11.285 -0.832 7.683 1075 H62 A 38 H62 A 38 -11.262 -0.057 9.251 1076 H2 A 38 H2 A 38 -9.252 -4.776 8.167 1077 H5' G 39 H5' G 39 -7.937 -7.603 13.447 1078 H5'' G 39 H5'' G 39 -7.709 -8.969 14.544 1079 H4' G 39 H4' G 39 -7.849 -9.946 12.418 1080 H3' G 39 H3' G 39 -5.581 -10.481 13.721 1081 H2' G 39 H2' G 39 -4.325 -8.573 13.061 1082 HO2' G 39 HO2' G 39 -3.814 -10.585 11.153 1083 H1' G 39 H1' G 39 -5.108 -8.600 10.197 1084 H8 G 39 H8 G 39 -7.028 -5.957 11.004 1085 H1 G 39 H1 G 39 -1.104 -4.177 12.699 1086 H21 G 39 H21 G 39 0.214 -5.918 12.813 1087 H22 G 39 H22 G 39 -0.352 -7.542 12.457 1088 H5' G 40 H5' G 40 -4.555 -11.631 9.143 1089 H5'' G 40 H5'' G 40 -4.377 -13.386 9.297 1090 H4' G 40 H4' G 40 -2.708 -12.491 7.734 1091 H3' G 40 H3' G 40 -2.046 -14.003 10.164 1092 H2' G 40 H2' G 40 -0.532 -12.411 10.864 1093 HO2' G 40 HO2' G 40 0.790 -13.690 8.695 1094 H1' G 40 H1' G 40 -0.151 -11.440 8.012 1095 H8 G 40 H8 G 40 -1.020 -9.894 11.476 1096 H1 G 40 H1 G 40 4.625 -8.056 9.032 1097 H21 G 40 H21 G 40 4.984 -9.086 7.091 1098 H22 G 40 H22 G 40 3.812 -10.183 6.404 1099 H5' A 41 H5' A 41 -2.978 -14.835 4.757 1100 H5'' A 41 H5'' A 41 -2.824 -13.747 6.140 1101 H4' A 41 H4' A 41 -4.796 -15.981 6.451 1102 H3' A 41 H3' A 41 -4.948 -13.891 4.284 1103 H2' A 41 H2' A 41 -7.125 -13.339 4.840 1104 HO2' A 41 HO2' A 41 -8.579 -14.830 5.395 1105 H1' A 41 H1' A 41 -7.048 -14.293 7.557 1106 H8 A 41 H8 A 41 -5.261 -11.407 5.645 1107 H61 A 41 H61 A 41 -8.807 -7.713 9.169 1108 H62 A 41 H62 A 41 -7.622 -7.734 7.876 1109 H2 A 41 H2 A 41 -9.647 -11.901 10.293 1110 H5' C 42 H5' C 42 -6.548 -13.730 0.582 1111 H5'' C 42 H5'' C 42 -5.857 -13.121 2.096 1112 H4' C 42 H4' C 42 -7.890 -12.248 2.858 1113 H3' C 42 H3' C 42 -9.233 -14.369 1.894 1114 H2' C 42 H2' C 42 -8.644 -13.922 -0.393 1115 HO2' C 42 HO2' C 42 -10.573 -13.296 -1.413 1116 H1' C 42 H1' C 42 -9.577 -11.063 0.034 1117 H41 C 42 H41 C 42 -7.337 -10.954 -5.959 1118 H42 C 42 H42 C 42 -5.781 -11.565 -5.426 1119 H5 C 42 H5 C 42 -5.336 -12.198 -3.096 1120 H6 C 42 H6 C 42 -6.354 -12.386 -0.866 1121 H5' A 43 H5' A 43 -12.009 -10.851 2.659 1122 H5'' A 43 H5'' A 43 -12.848 -10.521 4.177 1123 H4' A 43 H4' A 43 -14.297 -10.989 2.157 1124 H3' A 43 H3' A 43 -14.982 -11.604 4.682 1125 H2' A 43 H2' A 43 -13.686 -13.634 4.786 1126 HO2' A 43 HO2' A 43 -15.234 -15.329 4.759 1127 H1' A 43 H1' A 43 -14.924 -14.538 2.197 1128 H8 A 43 H8 A 43 -11.591 -14.371 1.218 1129 H61 A 43 H61 A 43 -10.148 -19.584 4.254 1130 H62 A 43 H62 A 43 -9.634 -18.460 3.010 1131 H2 A 43 H2 A 43 -14.014 -18.112 5.840 1132 H5' U 44 H5' U 44 -17.516 -11.460 -0.284 1133 H5'' U 44 H5'' U 44 -16.506 -12.676 0.510 1134 H4' U 44 H4' U 44 -15.440 -10.498 -1.353 1135 H3' U 44 H3' U 44 -16.172 -13.402 -1.825 1136 HO3' U 44 HO3' U 44 -16.970 -12.477 -3.774 1137 H2' U 44 H2' U 44 -14.432 -13.462 -3.496 1138 HO2' U 44 HO2' U 44 -14.754 -11.272 -4.281 1139 H1' U 44 H1' U 44 -12.593 -12.374 -1.855 1140 H3 U 44 H3 U 44 -12.005 -16.918 -2.051 1141 H5 U 44 H5 U 44 -14.985 -16.324 0.858 1142 H6 U 44 H6 U 44 -15.057 -14.002 0.231 Start of MODEL 8 1 H1 MET 1 H1 MET 1 8.502 10.047 -1.061 2 H2 MET 1 H2 MET 1 8.598 10.607 -2.600 3 H3 MET 1 H3 MET 1 8.615 8.983 -2.317 4 HA MET 1 HA MET 1 6.384 9.043 -1.474 5 HB2 MET 1 HB2 MET 1 6.467 11.393 -0.648 6 HB3 MET 1 HB3 MET 1 6.561 11.977 -2.312 7 HG2 MET 1 HG2 MET 1 4.294 12.242 -1.606 8 HG3 MET 1 HG3 MET 1 4.311 10.922 -2.753 9 HE1 MET 1 HE1 MET 1 1.408 10.012 -0.370 10 HE2 MET 1 HE2 MET 1 1.919 11.602 -1.012 11 HE3 MET 1 HE3 MET 1 1.950 10.172 -2.059 12 H LEU 2 H LEU 2 4.861 8.260 -2.917 13 HA LEU 2 HA LEU 2 5.024 9.191 -5.722 14 HB2 LEU 2 HB2 LEU 2 5.640 6.512 -4.647 15 HB3 LEU 2 HB3 LEU 2 4.401 6.489 -5.918 16 HG LEU 2 HG LEU 2 7.177 7.682 -6.161 17 HD11 LEU 2 HD11 LEU 2 7.104 5.214 -6.115 18 HD12 LEU 2 HD12 LEU 2 5.897 5.213 -7.416 19 HD13 LEU 2 HD13 LEU 2 7.553 5.815 -7.725 20 HD21 LEU 2 HD21 LEU 2 5.633 8.933 -7.606 21 HD22 LEU 2 HD22 LEU 2 6.590 7.830 -8.597 22 HD23 LEU 2 HD23 LEU 2 4.902 7.417 -8.188 23 H ILE 3 H ILE 3 3.063 9.020 -6.846 24 HA ILE 3 HA ILE 3 0.687 8.152 -5.274 25 HB ILE 3 HB ILE 3 0.978 10.759 -6.829 26 HG12 ILE 3 HG12 ILE 3 0.034 11.572 -4.527 27 HG13 ILE 3 HG13 ILE 3 0.703 10.058 -3.889 28 HG21 ILE 3 HG21 ILE 3 -1.446 9.513 -5.471 29 HG22 ILE 3 HG22 ILE 3 -1.357 11.160 -6.123 30 HG23 ILE 3 HG23 ILE 3 -1.247 9.776 -7.226 31 HD11 ILE 3 HD11 ILE 3 2.220 12.227 -5.399 32 HD12 ILE 3 HD12 ILE 3 2.228 11.985 -3.633 33 HD13 ILE 3 HD13 ILE 3 2.962 10.769 -4.690 34 H LEU 4 H LEU 4 -0.982 7.325 -6.548 35 HA LEU 4 HA LEU 4 -0.516 6.918 -9.443 36 HB2 LEU 4 HB2 LEU 4 -0.815 4.714 -7.359 37 HB3 LEU 4 HB3 LEU 4 -0.902 4.462 -9.105 38 HG LEU 4 HG LEU 4 1.562 5.482 -7.620 39 HD11 LEU 4 HD11 LEU 4 0.997 3.166 -7.048 40 HD12 LEU 4 HD12 LEU 4 0.800 2.765 -8.767 41 HD13 LEU 4 HD13 LEU 4 2.413 3.192 -8.121 42 HD21 LEU 4 HD21 LEU 4 1.485 6.226 -9.983 43 HD22 LEU 4 HD22 LEU 4 2.714 4.970 -9.744 44 HD23 LEU 4 HD23 LEU 4 1.156 4.555 -10.497 45 H THR 5 H THR 5 -2.420 5.851 -10.450 46 HA THR 5 HA THR 5 -4.847 5.946 -8.743 47 HB THR 5 HB THR 5 -5.017 6.759 -11.649 48 HG1 THR 5 HG1 THR 5 -3.641 8.243 -10.645 49 HG21 THR 5 HG21 THR 5 -7.091 7.785 -10.737 50 HG22 THR 5 HG22 THR 5 -7.016 6.030 -10.437 51 HG23 THR 5 HG23 THR 5 -6.651 7.168 -9.116 52 H ARG 6 H ARG 6 -4.967 3.810 -8.435 53 HA ARG 6 HA ARG 6 -4.836 1.966 -10.760 54 HB2 ARG 6 HB2 ARG 6 -3.410 1.845 -8.545 55 HB3 ARG 6 HB3 ARG 6 -4.910 1.330 -7.780 56 HG2 ARG 6 HG2 ARG 6 -3.717 -0.635 -8.251 57 HG3 ARG 6 HG3 ARG 6 -4.984 -0.565 -9.490 58 HD2 ARG 6 HD2 ARG 6 -2.150 0.484 -9.917 59 HD3 ARG 6 HD3 ARG 6 -2.602 -1.198 -10.246 60 HE ARG 6 HE ARG 6 -4.404 -0.163 -11.760 61 HH11 ARG 6 HH11 ARG 6 -1.184 1.220 -11.307 62 HH12 ARG 6 HH12 ARG 6 -1.161 1.980 -12.881 63 HH21 ARG 6 HH21 ARG 6 -4.359 0.817 -13.783 64 HH22 ARG 6 HH22 ARG 6 -2.978 1.745 -14.299 65 H LYS 7 H LYS 7 -6.599 0.183 -10.771 66 HA LYS 7 HA LYS 7 -8.996 1.072 -9.240 67 HB2 LYS 7 HB2 LYS 7 -10.446 0.292 -11.033 68 HB3 LYS 7 HB3 LYS 7 -9.470 1.660 -11.549 69 HG2 LYS 7 HG2 LYS 7 -7.993 0.189 -12.812 70 HG3 LYS 7 HG3 LYS 7 -8.797 -1.258 -12.137 71 HD2 LYS 7 HD2 LYS 7 -10.965 -0.396 -13.152 72 HD3 LYS 7 HD3 LYS 7 -10.009 0.833 -13.994 73 HE2 LYS 7 HE2 LYS 7 -9.721 -2.191 -14.235 74 HE3 LYS 7 HE3 LYS 7 -10.469 -1.119 -15.418 75 HZ1 LYS 7 HZ1 LYS 7 -8.301 -0.025 -15.643 76 HZ2 LYS 7 HZ2 LYS 7 -7.629 -1.122 -14.614 77 HZ3 LYS 7 HZ3 LYS 7 -8.233 -1.613 -16.051 78 H VAL 8 H VAL 8 -10.708 -0.711 -9.217 79 HA VAL 8 HA VAL 8 -9.563 -2.526 -7.415 80 HB VAL 8 HB VAL 8 -11.696 -3.534 -7.190 81 HG11 VAL 8 HG11 VAL 8 -11.991 -0.547 -7.784 82 HG12 VAL 8 HG12 VAL 8 -13.027 -1.509 -6.709 83 HG13 VAL 8 HG13 VAL 8 -11.322 -1.227 -6.286 84 HG21 VAL 8 HG21 VAL 8 -13.625 -2.964 -8.539 85 HG22 VAL 8 HG22 VAL 8 -12.593 -2.054 -9.683 86 HG23 VAL 8 HG23 VAL 8 -12.418 -3.819 -9.506 87 H GLY 9 H GLY 9 -8.820 -4.522 -7.431 88 HA2 GLY 9 HA2 GLY 9 -8.650 -6.743 -8.202 89 HA3 GLY 9 HA3 GLY 9 -9.247 -6.244 -9.798 90 H GLU 10 H GLU 10 -6.984 -3.932 -9.026 91 HA GLU 10 HA GLU 10 -4.856 -5.390 -10.520 92 HB2 GLU 10 HB2 GLU 10 -5.373 -2.435 -10.077 93 HB3 GLU 10 HB3 GLU 10 -4.039 -3.107 -11.036 94 HG2 GLU 10 HG2 GLU 10 -5.658 -4.160 -12.566 95 HG3 GLU 10 HG3 GLU 10 -7.014 -3.569 -11.593 96 H SER 11 H SER 11 -2.567 -4.156 -9.891 97 HA SER 11 HA SER 11 -2.320 -4.272 -6.936 98 HB2 SER 11 HB2 SER 11 -0.834 -6.090 -8.875 99 HB3 SER 11 HB3 SER 11 -0.496 -5.941 -7.141 100 HG SER 11 HG SER 11 -2.508 -6.753 -6.690 101 H ILE 12 H ILE 12 -0.085 -3.903 -6.220 102 HA ILE 12 HA ILE 12 1.622 -2.212 -7.937 103 HB ILE 12 HB ILE 12 0.554 -1.343 -5.213 104 HG12 ILE 12 HG12 ILE 12 -0.181 -0.278 -7.975 105 HG13 ILE 12 HG13 ILE 12 -1.229 -1.244 -6.927 106 HG21 ILE 12 HG21 ILE 12 2.828 -0.474 -5.716 107 HG22 ILE 12 HG22 ILE 12 2.221 0.175 -7.264 108 HG23 ILE 12 HG23 ILE 12 1.644 0.820 -5.719 109 HD11 ILE 12 HD11 ILE 12 -0.210 1.551 -6.324 110 HD12 ILE 12 HD12 ILE 12 -1.869 1.060 -6.692 111 HD13 ILE 12 HD13 ILE 12 -1.107 0.523 -5.179 112 H ASN 13 H ASN 13 3.797 -1.852 -6.631 113 HA ASN 13 HA ASN 13 4.261 -4.082 -4.716 114 HB2 ASN 13 HB2 ASN 13 5.725 -3.642 -7.344 115 HB3 ASN 13 HB3 ASN 13 6.322 -4.680 -6.048 116 HD21 ASN 13 HD22 ASN 13 5.319 -6.678 -5.619 117 HD22 ASN 13 HD21 ASN 13 4.163 -7.381 -6.725 118 H ILE 14 H ILE 14 6.210 -3.944 -3.535 119 HA ILE 14 HA ILE 14 7.727 -1.410 -3.674 120 HB ILE 14 HB ILE 14 6.539 -2.506 -1.092 121 HG12 ILE 14 HG12 ILE 14 5.750 -0.058 -2.729 122 HG13 ILE 14 HG13 ILE 14 4.779 -1.517 -2.511 123 HG21 ILE 14 HG21 ILE 14 7.434 -0.443 -0.090 124 HG22 ILE 14 HG22 ILE 14 8.740 -1.359 -0.833 125 HG23 ILE 14 HG23 ILE 14 8.081 0.061 -1.671 126 HD11 ILE 14 HD11 ILE 14 5.555 0.471 -0.344 127 HD12 ILE 14 HD12 ILE 14 3.947 0.187 -1.033 128 HD13 ILE 14 HD13 ILE 14 4.715 -1.080 -0.051 129 H GLY 15 H GLY 15 9.847 -1.609 -2.803 130 HA2 GLY 15 HA2 GLY 15 11.845 -2.718 -2.507 131 HA3 GLY 15 HA3 GLY 15 10.939 -3.774 -1.412 132 H ASP 16 H ASP 16 11.839 -5.711 -1.956 133 HA ASP 16 HA ASP 16 11.196 -6.722 -4.664 134 HB2 ASP 16 HB2 ASP 16 13.275 -7.963 -4.736 135 HB3 ASP 16 HB3 ASP 16 13.615 -6.246 -4.523 136 H ASP 17 H ASP 17 10.181 -6.805 -1.681 137 HA ASP 17 HA ASP 17 9.455 -9.672 -1.774 138 HB2 ASP 17 HB2 ASP 17 10.584 -8.242 0.665 139 HB3 ASP 17 HB3 ASP 17 9.821 -9.834 0.695 140 H ILE 18 H ILE 18 8.190 -6.667 -1.978 141 HA ILE 18 HA ILE 18 5.890 -7.431 -0.244 142 HB ILE 18 HB ILE 18 6.921 -4.600 -0.657 143 HG12 ILE 18 HG12 ILE 18 7.080 -4.902 1.982 144 HG13 ILE 18 HG13 ILE 18 7.328 -6.601 1.565 145 HG21 ILE 18 HG21 ILE 18 4.505 -4.661 -0.390 146 HG22 ILE 18 HG22 ILE 18 4.648 -5.754 1.010 147 HG23 ILE 18 HG23 ILE 18 5.245 -4.080 1.110 148 HD11 ILE 18 HD11 ILE 18 8.931 -4.234 0.501 149 HD12 ILE 18 HD12 ILE 18 9.465 -5.344 1.785 150 HD13 ILE 18 HD13 ILE 18 9.266 -5.937 0.126 151 H THR 19 H THR 19 3.862 -7.007 -0.990 152 HA THR 19 HA THR 19 3.523 -5.778 -3.672 153 HB THR 19 HB THR 19 2.410 -8.491 -2.843 154 HG1 THR 19 HG1 THR 19 4.604 -8.570 -3.388 155 HG21 THR 19 HG21 THR 19 2.166 -6.878 -5.416 156 HG22 THR 19 HG22 THR 19 1.720 -8.590 -5.256 157 HG23 THR 19 HG23 THR 19 0.851 -7.362 -4.318 158 H ILE 20 H ILE 20 1.339 -5.090 -4.034 159 HA ILE 20 HA ILE 20 -0.428 -4.891 -1.642 160 HB ILE 20 HB ILE 20 0.444 -2.641 -3.502 161 HG12 ILE 20 HG12 ILE 20 2.165 -3.219 -1.811 162 HG13 ILE 20 HG13 ILE 20 1.508 -1.586 -1.629 163 HG21 ILE 20 HG21 ILE 20 -1.535 -2.658 -1.196 164 HG22 ILE 20 HG22 ILE 20 -0.896 -1.186 -1.959 165 HG23 ILE 20 HG23 ILE 20 -1.873 -2.326 -2.908 166 HD11 ILE 20 HD11 ILE 20 1.793 -2.745 0.545 167 HD12 ILE 20 HD12 ILE 20 0.104 -2.300 0.236 168 HD13 ILE 20 HD13 ILE 20 0.637 -3.989 0.021 169 H THR 21 H THR 21 -2.639 -4.752 -2.198 170 HA THR 21 HA THR 21 -3.336 -4.835 -5.090 171 HB THR 21 HB THR 21 -4.284 -6.906 -3.074 172 HG1 THR 21 HG1 THR 21 -2.108 -7.221 -3.643 173 HG21 THR 21 HG21 THR 21 -5.880 -6.440 -4.928 174 HG22 THR 21 HG22 THR 21 -4.588 -6.751 -6.109 175 HG23 THR 21 HG23 THR 21 -5.166 -8.060 -5.062 176 H ILE 22 H ILE 22 -5.381 -4.093 -5.539 177 HA ILE 22 HA ILE 22 -6.860 -2.827 -3.288 178 HB ILE 22 HB ILE 22 -6.129 -1.171 -4.771 179 HG12 ILE 22 HG12 ILE 22 -8.085 -0.222 -5.788 180 HG13 ILE 22 HG13 ILE 22 -8.916 -1.791 -5.796 181 HG21 ILE 22 HG21 ILE 22 -5.355 -2.487 -6.647 182 HG22 ILE 22 HG22 ILE 22 -7.033 -2.898 -7.098 183 HG23 ILE 22 HG23 ILE 22 -6.454 -1.227 -7.223 184 HD11 ILE 22 HD11 ILE 22 -9.727 -0.403 -3.979 185 HD12 ILE 22 HD12 ILE 22 -8.924 -1.853 -3.365 186 HD13 ILE 22 HD13 ILE 22 -8.074 -0.283 -3.299 187 H LEU 23 H LEU 23 -8.103 -4.581 -2.589 188 HA LEU 23 HA LEU 23 -9.087 -6.550 -4.389 189 HB2 LEU 23 HB2 LEU 23 -10.221 -5.890 -1.652 190 HB3 LEU 23 HB3 LEU 23 -10.402 -7.385 -2.562 191 HG LEU 23 HG LEU 23 -8.064 -6.394 -0.970 192 HD11 LEU 23 HD11 LEU 23 -9.449 -9.075 -1.439 193 HD12 LEU 23 HD12 LEU 23 -8.090 -8.820 -0.311 194 HD13 LEU 23 HD13 LEU 23 -9.645 -8.021 -0.023 195 HD21 LEU 23 HD21 LEU 23 -6.903 -6.792 -3.036 196 HD22 LEU 23 HD22 LEU 23 -6.649 -8.202 -1.990 197 HD23 LEU 23 HD23 LEU 23 -7.823 -8.289 -3.330 198 H GLY 24 H GLY 24 -10.511 -3.460 -3.328 199 HA2 GLY 24 HA2 GLY 24 -12.240 -3.110 -5.399 200 HA3 GLY 24 HA3 GLY 24 -13.171 -4.180 -4.359 201 H VAL 25 H VAL 25 -14.596 -2.138 -4.474 202 HA VAL 25 HA VAL 25 -13.936 -0.485 -2.090 203 HB VAL 25 HB VAL 25 -14.682 1.532 -3.115 204 HG11 VAL 25 HG11 VAL 25 -13.043 1.908 -4.859 205 HG12 VAL 25 HG12 VAL 25 -12.335 0.889 -3.586 206 HG13 VAL 25 HG13 VAL 25 -12.855 0.161 -5.125 207 HG21 VAL 25 HG21 VAL 25 -15.384 -0.124 -5.558 208 HG22 VAL 25 HG22 VAL 25 -16.513 0.731 -4.468 209 HG23 VAL 25 HG23 VAL 25 -15.392 1.655 -5.474 210 H SER 26 H SER 26 -15.772 0.552 -1.116 211 HA SER 26 HA SER 26 -18.472 -0.416 -1.762 212 HB2 SER 26 HB2 SER 26 -17.103 -0.942 0.916 213 HB3 SER 26 HB3 SER 26 -18.832 -1.158 0.586 214 HG SER 26 HG SER 26 -17.656 -3.096 0.381 215 H GLY 27 H GLY 27 -18.923 1.810 -2.213 216 HA2 GLY 27 HA2 GLY 27 -19.460 4.003 -1.637 217 HA3 GLY 27 HA3 GLY 27 -19.361 3.507 0.070 218 H GLN 28 H GLN 28 -18.016 5.090 0.980 219 HA GLN 28 HA GLN 28 -15.634 5.987 -0.424 220 HB2 GLN 28 HB2 GLN 28 -16.390 6.233 2.528 221 HB3 GLN 28 HB3 GLN 28 -15.028 7.030 1.730 222 HG2 GLN 28 HG2 GLN 28 -17.970 7.546 1.344 223 HG3 GLN 28 HG3 GLN 28 -16.679 8.653 1.865 224 HE21 GLN 28 HE22 GLN 28 -14.757 8.691 0.080 225 HE22 GLN 28 HE21 GLN 28 -15.306 8.888 -1.570 226 H GLN 29 H GLN 29 -16.461 3.233 1.547 227 HA GLN 29 HA GLN 29 -13.804 2.771 2.562 228 HB2 GLN 29 HB2 GLN 29 -16.362 1.599 2.934 229 HB3 GLN 29 HB3 GLN 29 -15.389 0.355 2.168 230 HG2 GLN 29 HG2 GLN 29 -15.057 0.115 4.532 231 HG3 GLN 29 HG3 GLN 29 -13.575 0.881 3.919 232 HE21 GLN 29 HE22 GLN 29 -16.855 2.164 4.775 233 HE22 GLN 29 HE21 GLN 29 -16.257 3.341 5.929 234 H VAL 30 H VAL 30 -12.297 1.241 1.847 235 HA VAL 30 HA VAL 30 -12.447 0.321 -0.969 236 HB VAL 30 HB VAL 30 -10.206 1.950 0.321 237 HG11 VAL 30 HG11 VAL 30 -10.456 0.854 -2.499 238 HG12 VAL 30 HG12 VAL 30 -9.117 1.828 -1.861 239 HG13 VAL 30 HG13 VAL 30 -9.394 0.184 -1.232 240 HG21 VAL 30 HG21 VAL 30 -12.073 3.391 -0.363 241 HG22 VAL 30 HG22 VAL 30 -10.718 3.584 -1.492 242 HG23 VAL 30 HG23 VAL 30 -12.126 2.604 -1.956 243 H ARG 31 H ARG 31 -12.043 -1.844 -0.847 244 HA ARG 31 HA ARG 31 -10.744 -2.910 1.562 245 HB2 ARG 31 HB2 ARG 31 -12.796 -3.933 0.440 246 HB3 ARG 31 HB3 ARG 31 -11.733 -4.431 -0.887 247 HG2 ARG 31 HG2 ARG 31 -10.306 -5.664 0.760 248 HG3 ARG 31 HG3 ARG 31 -11.384 -5.130 2.066 249 HD2 ARG 31 HD2 ARG 31 -13.280 -6.290 0.909 250 HD3 ARG 31 HD3 ARG 31 -12.121 -6.906 -0.287 251 HE ARG 31 HE ARG 31 -11.592 -7.444 2.581 252 HH11 ARG 31 HH11 ARG 31 -12.662 -8.676 -0.566 253 HH12 ARG 31 HH12 ARG 31 -12.515 -10.349 -0.067 254 HH21 ARG 31 HH21 ARG 31 -11.369 -9.649 3.154 255 HH22 ARG 31 HH22 ARG 31 -11.786 -10.891 2.000 256 H ILE 32 H ILE 32 -8.662 -3.555 1.659 257 HA ILE 32 HA ILE 32 -7.041 -3.451 -0.848 258 HB ILE 32 HB ILE 32 -6.122 -2.229 1.766 259 HG12 ILE 32 HG12 ILE 32 -7.686 -0.853 -0.457 260 HG13 ILE 32 HG13 ILE 32 -8.137 -1.028 1.253 261 HG21 ILE 32 HG21 ILE 32 -5.308 -1.768 -1.134 262 HG22 ILE 32 HG22 ILE 32 -4.544 -1.047 0.300 263 HG23 ILE 32 HG23 ILE 32 -4.428 -2.784 0.022 264 HD11 ILE 32 HD11 ILE 32 -5.841 0.617 0.160 265 HD12 ILE 32 HD12 ILE 32 -7.344 1.205 0.905 266 HD13 ILE 32 HD13 ILE 32 -6.158 0.331 1.898 267 H GLY 33 H GLY 33 -5.024 -4.617 -0.698 268 HA2 GLY 33 HA2 GLY 33 -4.811 -6.485 1.614 269 HA3 GLY 33 HA3 GLY 33 -4.743 -7.084 -0.051 270 H ILE 34 H ILE 34 -2.718 -7.322 1.936 271 HA ILE 34 HA ILE 34 -0.455 -5.892 0.643 272 HB ILE 34 HB ILE 34 -0.909 -6.125 3.654 273 HG12 ILE 34 HG12 ILE 34 -1.019 -3.602 1.947 274 HG13 ILE 34 HG13 ILE 34 -2.438 -4.453 2.577 275 HG21 ILE 34 HG21 ILE 34 1.267 -4.724 2.044 276 HG22 ILE 34 HG22 ILE 34 1.112 -4.682 3.813 277 HG23 ILE 34 HG23 ILE 34 1.461 -6.209 3.000 278 HD11 ILE 34 HD11 ILE 34 -0.258 -3.149 4.248 279 HD12 ILE 34 HD12 ILE 34 -1.946 -2.634 4.064 280 HD13 ILE 34 HD13 ILE 34 -1.580 -4.162 4.888 281 H ASN 35 H ASN 35 1.442 -7.090 0.614 282 HA ASN 35 HA ASN 35 1.345 -9.752 1.914 283 HB2 ASN 35 HB2 ASN 35 0.350 -9.821 -0.399 284 HB3 ASN 35 HB3 ASN 35 1.913 -9.316 -1.039 285 HD21 ASN 35 HD22 ASN 35 0.364 -11.802 -1.497 286 HD22 ASN 35 HD21 ASN 35 1.387 -13.126 -0.984 287 H ALA 36 H ALA 36 3.042 -9.577 3.209 288 HA ALA 36 HA ALA 36 5.717 -9.201 2.005 289 HB1 ALA 36 HB1 ALA 36 6.360 -7.670 3.847 290 HB2 ALA 36 HB2 ALA 36 5.075 -6.951 2.843 291 HB3 ALA 36 HB3 ALA 36 4.684 -7.656 4.425 292 HA PRO 37 HA PRO 37 6.701 -12.476 4.826 293 HB2 PRO 37 HB2 PRO 37 9.271 -11.768 5.560 294 HB3 PRO 37 HB3 PRO 37 8.855 -12.526 3.980 295 HG2 PRO 37 HG2 PRO 37 9.294 -9.599 4.630 296 HG3 PRO 37 HG3 PRO 37 9.915 -10.541 3.234 297 HD2 PRO 37 HD2 PRO 37 7.731 -8.961 3.015 298 HD3 PRO 37 HD3 PRO 37 7.803 -10.558 2.202 299 H LYS 38 H LYS 38 7.030 -12.908 7.102 300 HA LYS 38 HA LYS 38 6.238 -10.773 8.887 301 HB2 LYS 38 HB2 LYS 38 7.321 -13.584 9.390 302 HB3 LYS 38 HB3 LYS 38 6.667 -12.533 10.659 303 HG2 LYS 38 HG2 LYS 38 5.108 -13.390 8.180 304 HG3 LYS 38 HG3 LYS 38 4.999 -14.208 9.736 305 HD2 LYS 38 HD2 LYS 38 4.482 -11.220 9.496 306 HD3 LYS 38 HD3 LYS 38 3.238 -12.397 9.108 307 HE2 LYS 38 HE2 LYS 38 4.740 -12.302 11.764 308 HE3 LYS 38 HE3 LYS 38 3.171 -11.526 11.480 309 HZ1 LYS 38 HZ1 LYS 38 3.707 -14.410 11.227 310 HZ2 LYS 38 HZ2 LYS 38 2.899 -13.686 12.460 311 HZ3 LYS 38 HZ3 LYS 38 2.265 -13.676 10.942 312 H ASP 39 H ASP 39 9.001 -11.298 7.311 313 HA ASP 39 HA ASP 39 11.035 -10.595 9.195 314 HB2 ASP 39 HB2 ASP 39 11.176 -11.556 6.789 315 HB3 ASP 39 HB3 ASP 39 10.940 -9.903 6.236 316 H VAL 40 H VAL 40 8.371 -8.860 7.970 317 HA VAL 40 HA VAL 40 9.492 -6.273 8.874 318 HB VAL 40 HB VAL 40 8.606 -5.109 6.942 319 HG11 VAL 40 HG11 VAL 40 10.203 -7.529 5.989 320 HG12 VAL 40 HG12 VAL 40 10.078 -5.961 5.175 321 HG13 VAL 40 HG13 VAL 40 10.897 -6.074 6.749 322 HG21 VAL 40 HG21 VAL 40 6.668 -6.601 6.502 323 HG22 VAL 40 HG22 VAL 40 7.605 -6.209 5.045 324 HG23 VAL 40 HG23 VAL 40 7.786 -7.805 5.816 325 H ALA 41 H ALA 41 7.604 -4.610 9.041 326 HA ALA 41 HA ALA 41 5.335 -6.089 10.289 327 HB1 ALA 41 HB1 ALA 41 6.803 -4.861 11.855 328 HB2 ALA 41 HB2 ALA 41 6.525 -3.363 10.934 329 HB3 ALA 41 HB3 ALA 41 5.178 -4.139 11.790 330 H VAL 42 H VAL 42 3.230 -5.131 10.190 331 HA VAL 42 HA VAL 42 2.785 -2.818 8.465 332 HB VAL 42 HB VAL 42 2.810 -4.278 6.663 333 HG11 VAL 42 HG11 VAL 42 3.132 -6.382 7.732 334 HG12 VAL 42 HG12 VAL 42 1.495 -6.356 8.442 335 HG13 VAL 42 HG13 VAL 42 1.713 -6.544 6.683 336 HG21 VAL 42 HG21 VAL 42 -0.083 -4.456 7.619 337 HG22 VAL 42 HG22 VAL 42 0.636 -3.079 6.745 338 HG23 VAL 42 HG23 VAL 42 0.491 -4.672 5.962 339 H HIS 43 H HIS 43 1.168 -1.662 9.296 340 HA HIS 43 HA HIS 43 -1.126 -2.957 10.574 341 HB2 HIS 43 HB2 HIS 43 0.386 -0.912 12.203 342 HB3 HIS 43 HB3 HIS 43 -0.880 -2.027 12.713 343 HD2 HIS 43 HD2 HIS 43 2.902 -1.943 11.934 344 HE1 HIS 43 HE1 HIS 43 2.149 -5.518 14.106 345 HE2 HIS 43 HE2 HIS 43 3.954 -4.030 13.122 346 H ARG 44 H ARG 44 -2.666 -1.148 11.431 347 HA ARG 44 HA ARG 44 -3.038 0.852 9.389 348 HB2 ARG 44 HB2 ARG 44 -4.850 -0.262 10.743 349 HB3 ARG 44 HB3 ARG 44 -4.262 0.594 12.174 350 HG2 ARG 44 HG2 ARG 44 -4.757 2.776 11.037 351 HG3 ARG 44 HG3 ARG 44 -5.412 1.865 9.656 352 HD2 ARG 44 HD2 ARG 44 -7.057 0.794 11.181 353 HD3 ARG 44 HD3 ARG 44 -6.384 1.716 12.539 354 HE ARG 44 HE ARG 44 -7.280 3.378 10.300 355 HH11 ARG 44 HH11 ARG 44 -8.222 1.779 13.311 356 HH12 ARG 44 HH12 ARG 44 -9.618 2.807 13.551 357 HH21 ARG 44 HH21 ARG 44 -9.159 4.662 10.622 358 HH22 ARG 44 HH22 ARG 44 -10.121 4.435 12.059 359 H GLU 45 H GLU 45 -2.955 3.223 9.783 360 HA GLU 45 HA GLU 45 -0.504 3.994 10.914 361 HB2 GLU 45 HB2 GLU 45 -1.931 5.143 9.160 362 HB3 GLU 45 HB3 GLU 45 -2.951 5.765 10.460 363 HG2 GLU 45 HG2 GLU 45 0.050 6.260 10.244 364 HG3 GLU 45 HG3 GLU 45 -1.175 7.335 9.551 365 H GLU 46 H GLU 46 -3.602 3.450 12.399 366 HA GLU 46 HA GLU 46 -3.268 5.040 14.765 367 HB2 GLU 46 HB2 GLU 46 -5.413 4.031 13.849 368 HB3 GLU 46 HB3 GLU 46 -4.803 2.444 14.312 369 HG2 GLU 46 HG2 GLU 46 -6.335 3.246 16.023 370 HG3 GLU 46 HG3 GLU 46 -4.706 3.198 16.691 371 H ILE 47 H ILE 47 -2.612 1.583 13.984 372 HA ILE 47 HA ILE 47 -1.789 0.972 16.696 373 HB ILE 47 HB ILE 47 -1.266 -0.630 14.175 374 HG12 ILE 47 HG12 ILE 47 -3.585 -0.095 14.004 375 HG13 ILE 47 HG13 ILE 47 -3.448 -1.763 14.557 376 HG21 ILE 47 HG21 ILE 47 -1.524 -2.559 15.722 377 HG22 ILE 47 HG22 ILE 47 -0.206 -1.484 16.214 378 HG23 ILE 47 HG23 ILE 47 -1.757 -1.425 17.078 379 HD11 ILE 47 HD11 ILE 47 -5.229 -0.578 15.747 380 HD12 ILE 47 HD12 ILE 47 -3.939 -1.044 16.876 381 HD13 ILE 47 HD13 ILE 47 -4.078 0.647 16.313 382 H TYR 48 H TYR 48 -0.245 2.083 13.754 383 HA TYR 48 HA TYR 48 2.392 1.143 14.151 384 HB2 TYR 48 HB2 TYR 48 1.418 2.074 12.070 385 HB3 TYR 48 HB3 TYR 48 1.330 3.663 12.825 386 HD1 TYR 48 HD2 TYR 48 3.676 1.012 11.657 387 HD2 TYR 48 HD1 TYR 48 3.230 5.112 12.892 388 HE1 TYR 48 HE2 TYR 48 5.952 1.508 10.810 389 HE2 TYR 48 HE1 TYR 48 5.459 5.636 12.015 390 HH TYR 48 HH TYR 48 7.348 4.815 10.944 391 H GLN 49 H GLN 49 0.634 3.836 15.635 392 HA GLN 49 HA GLN 49 2.980 5.268 16.512 393 HB2 GLN 49 HB2 GLN 49 0.061 5.315 17.367 394 HB3 GLN 49 HB3 GLN 49 1.285 6.477 17.933 395 HG2 GLN 49 HG2 GLN 49 1.679 7.275 15.673 396 HG3 GLN 49 HG3 GLN 49 0.689 5.997 14.987 397 HE21 GLN 49 HE22 GLN 49 -0.607 7.592 13.919 398 HE22 GLN 49 HE21 GLN 49 -1.829 8.490 14.770 399 H ARG 50 H ARG 50 1.242 2.481 17.739 400 HA ARG 50 HA ARG 50 2.209 2.704 20.491 401 HB2 ARG 50 HB2 ARG 50 0.870 0.543 18.811 402 HB3 ARG 50 HB3 ARG 50 1.587 0.156 20.366 403 HG2 ARG 50 HG2 ARG 50 -0.750 0.563 20.694 404 HG3 ARG 50 HG3 ARG 50 0.159 1.885 21.450 405 HD2 ARG 50 HD2 ARG 50 -0.328 3.341 19.515 406 HD3 ARG 50 HD3 ARG 50 -1.159 1.994 18.709 407 HE ARG 50 HE ARG 50 -2.315 2.373 21.283 408 HH11 ARG 50 HH11 ARG 50 -2.167 3.990 18.132 409 HH12 ARG 50 HH12 ARG 50 -3.677 4.826 18.369 410 HH21 ARG 50 HH21 ARG 50 -4.285 3.479 21.550 411 HH22 ARG 50 HH22 ARG 50 -4.886 4.511 20.273 412 H ILE 51 H ILE 51 3.527 1.798 17.455 413 HA ILE 51 HA ILE 51 5.438 -0.108 18.671 414 HB ILE 51 HB ILE 51 4.672 0.545 15.802 415 HG12 ILE 51 HG12 ILE 51 4.101 -1.874 17.581 416 HG13 ILE 51 HG13 ILE 51 2.938 -0.576 17.246 417 HG21 ILE 51 HG21 ILE 51 6.447 -1.662 16.903 418 HG22 ILE 51 HG22 ILE 51 5.994 -1.432 15.195 419 HG23 ILE 51 HG23 ILE 51 7.025 -0.237 16.001 420 HD11 ILE 51 HD11 ILE 51 4.153 -2.458 15.200 421 HD12 ILE 51 HD12 ILE 51 2.471 -2.448 15.804 422 HD13 ILE 51 HD13 ILE 51 3.066 -1.087 14.832 423 H GLN 52 H GLN 52 5.358 2.862 16.599 424 HA GLN 52 HA GLN 52 8.226 3.094 16.588 425 HB2 GLN 52 HB2 GLN 52 6.037 5.119 15.966 426 HB3 GLN 52 HB3 GLN 52 7.760 5.355 15.636 427 HG2 GLN 52 HG2 GLN 52 5.898 3.300 14.413 428 HG3 GLN 52 HG3 GLN 52 6.833 4.582 13.612 429 HE21 GLN 52 HE22 GLN 52 6.719 1.286 14.271 430 HE22 GLN 52 HE21 GLN 52 8.410 0.897 14.023 431 H ALA 53 H ALA 53 6.204 3.339 19.174 432 HA ALA 53 HA ALA 53 7.225 5.631 20.528 433 HB1 ALA 53 HB1 ALA 53 5.173 4.430 21.157 434 HB2 ALA 53 HB2 ALA 53 6.131 2.997 21.589 435 HB3 ALA 53 HB3 ALA 53 6.313 4.497 22.525 436 H GLY 54 H GLY 54 8.725 2.578 19.723 437 HA2 GLY 54 HA2 GLY 54 11.272 3.193 20.218 438 HA3 GLY 54 HA3 GLY 54 10.741 2.861 21.869 439 H LEU 55 H LEU 55 9.342 0.942 19.201 440 HA LEU 55 HA LEU 55 11.152 -1.300 19.700 441 HB2 LEU 55 HB2 LEU 55 9.325 -2.668 20.808 442 HB3 LEU 55 HB3 LEU 55 10.006 -1.356 21.770 443 HG LEU 55 HG LEU 55 8.018 0.090 21.058 444 HD11 LEU 55 HD11 LEU 55 6.934 -2.619 20.176 445 HD12 LEU 55 HD12 LEU 55 5.976 -1.139 20.412 446 HD13 LEU 55 HD13 LEU 55 7.198 -1.194 19.129 447 HD21 LEU 55 HD21 LEU 55 6.573 -0.917 22.734 448 HD22 LEU 55 HD22 LEU 55 7.518 -2.431 22.661 449 HD23 LEU 55 HD23 LEU 55 8.273 -0.923 23.247 450 H THR 56 H THR 56 9.904 -3.418 18.960 451 HA THR 56 HA THR 56 8.048 -2.952 16.723 452 HB THR 56 HB THR 56 9.441 -4.588 15.329 453 HG1 THR 56 HG1 THR 56 11.667 -4.534 15.813 454 HG21 THR 56 HG21 THR 56 10.626 -1.831 15.817 455 HG22 THR 56 HG22 THR 56 10.735 -2.801 14.331 456 HG23 THR 56 HG23 THR 56 9.162 -2.169 14.855 457 H ALA 57 H ALA 57 8.356 -4.300 19.545 458 HA ALA 57 HA ALA 57 6.677 -6.586 18.754 459 HB1 ALA 57 HB1 ALA 57 7.923 -8.110 20.249 460 HB2 ALA 57 HB2 ALA 57 8.966 -7.509 18.945 461 HB3 ALA 57 HB3 ALA 57 9.105 -6.828 20.584 462 HA PRO 58 HA PRO 58 4.206 -4.671 21.994 463 HB2 PRO 58 HB2 PRO 58 3.303 -7.564 22.068 464 HB3 PRO 58 HB3 PRO 58 2.302 -6.085 22.194 465 HG2 PRO 58 HG2 PRO 58 2.461 -7.377 19.832 466 HG3 PRO 58 HG3 PRO 58 2.652 -5.590 19.855 467 HD2 PRO 58 HD2 PRO 58 4.797 -7.705 19.677 468 HD3 PRO 58 HD3 PRO 58 4.671 -6.143 18.810 469 H ASP 59 H ASP 59 6.109 -7.644 22.452 470 HA ASP 59 HA ASP 59 6.795 -6.859 25.154 471 HB2 ASP 59 HB2 ASP 59 4.594 -7.622 25.594 472 HB3 ASP 59 HB3 ASP 59 4.798 -9.084 24.618 473 H5' U 36 H5' U 36 -5.295 9.451 -17.853 474 H5'' U 36 H5'' U 36 -6.347 9.370 -16.425 475 H4' U 36 H4' U 36 -3.973 11.267 -16.685 476 H3' U 36 H3' U 36 -3.533 8.605 -16.545 477 H2' U 36 H2' U 36 -5.216 8.133 -14.946 478 HO2' U 36 HO2' U 36 -2.778 8.538 -13.548 479 H1' U 36 H1' U 36 -4.268 10.366 -13.165 480 H3 U 36 H3 U 36 -7.966 11.034 -10.708 481 H5 U 36 H5 U 36 -9.189 8.171 -13.520 482 H6 U 36 H6 U 36 -7.055 8.394 -14.618 483 HO5' U 36 HO5' U 36 -6.793 11.603 -16.764 484 H5' C 37 H5' C 37 -0.680 8.579 -18.766 485 H5'' C 37 H5'' C 37 -2.055 7.960 -17.834 486 H4' C 37 H4' C 37 0.745 6.817 -17.549 487 H3' C 37 H3' C 37 -0.530 6.641 -19.965 488 H2' C 37 H2' C 37 -2.597 5.882 -19.192 489 HO2' C 37 HO2' C 37 -1.803 4.249 -20.614 490 H1' C 37 H1' C 37 -1.347 3.949 -17.265 491 H41 C 37 H41 C 37 -7.125 4.178 -14.660 492 H42 C 37 H42 C 37 -7.527 5.671 -15.494 493 H5 C 37 H5 C 37 -5.923 6.849 -16.915 494 H6 C 37 H6 C 37 -3.653 6.791 -17.809 495 H5' A 38 H5' A 38 2.520 7.894 -18.289 496 H5'' A 38 H5'' A 38 4.076 7.393 -18.959 497 H4' A 38 H4' A 38 4.460 8.214 -16.729 498 H3' A 38 H3' A 38 5.415 5.743 -17.459 499 H2' A 38 H2' A 38 3.457 4.558 -16.714 500 HO2' A 38 HO2' A 38 5.328 4.607 -14.572 501 H1' A 38 H1' A 38 3.604 6.188 -14.170 502 H8 A 38 H8 A 38 1.646 3.798 -16.342 503 H61 A 38 H61 A 38 -3.052 4.574 -12.375 504 H62 A 38 H62 A 38 -2.467 3.661 -13.752 505 H2 A 38 H2 A 38 0.096 7.567 -11.396 506 H5' G 39 H5' G 39 5.261 9.212 -14.754 507 H5'' G 39 H5'' G 39 6.604 10.294 -15.157 508 H4' G 39 H4' G 39 5.899 11.103 -13.097 509 H3' G 39 H3' G 39 8.412 10.114 -13.078 510 H2' G 39 H2' G 39 7.839 7.888 -12.465 511 HO2' G 39 HO2' G 39 8.338 7.604 -10.287 512 H1' G 39 H1' G 39 5.907 8.794 -10.355 513 H8 G 39 H8 G 39 3.610 7.357 -12.332 514 H1 G 39 H1 G 39 7.491 2.524 -10.678 515 H21 G 39 H21 G 39 9.379 3.287 -9.930 516 H22 G 39 H22 G 39 9.723 5.000 -9.783 517 H5' G 40 H5' G 40 7.233 11.286 -8.569 518 H5'' G 40 H5'' G 40 8.418 12.531 -8.140 519 H4' G 40 H4' G 40 7.787 11.007 -6.261 520 H3' G 40 H3' G 40 10.392 11.967 -6.781 521 H2' G 40 H2' G 40 10.839 9.844 -7.924 522 HO2' G 40 HO2' G 40 12.400 8.918 -6.625 523 H1' G 40 H1' G 40 9.440 8.773 -5.438 524 H8 G 40 H8 G 40 10.107 7.623 -9.117 525 H1 G 40 H1 G 40 11.528 3.404 -4.495 526 H21 G 40 H21 G 40 11.160 4.331 -2.492 527 H22 G 40 H22 G 40 10.492 5.937 -2.340 528 H5' A 41 H5' A 41 7.551 13.541 -3.447 529 H5'' A 41 H5'' A 41 7.286 12.426 -4.803 530 H4' A 41 H4' A 41 7.435 15.439 -5.188 531 H3' A 41 H3' A 41 5.201 13.709 -4.183 532 H2' A 41 H2' A 41 3.645 14.533 -5.733 533 HO2' A 41 HO2' A 41 4.166 16.772 -5.271 534 H1' A 41 H1' A 41 5.355 15.064 -7.855 535 H8 A 41 H8 A 41 4.534 11.959 -5.636 536 H61 A 41 H61 A 41 2.758 9.467 -11.062 537 H62 A 41 H62 A 41 2.791 9.201 -9.325 538 H2 A 41 H2 A 41 4.447 13.467 -11.866 539 H5' C 42 H5' C 42 1.643 15.058 -1.760 540 H5'' C 42 H5'' C 42 2.611 13.692 -2.315 541 H4' C 42 H4' C 42 1.471 13.744 -4.510 542 H3' C 42 H3' C 42 0.684 16.228 -4.385 543 H2' C 42 H2' C 42 -0.163 16.008 -2.072 544 HO2' C 42 HO2' C 42 -2.327 15.858 -3.921 545 H1' C 42 H1' C 42 -1.835 13.743 -3.159 546 H41 C 42 H41 C 42 -3.101 13.568 3.129 547 H42 C 42 H42 C 42 -1.432 13.155 3.470 548 H5 C 42 H5 C 42 0.290 13.056 1.737 549 H6 C 42 H6 C 42 0.716 13.358 -0.636 550 H5' A 43 H5' A 43 0.155 17.889 -6.573 551 H5'' A 43 H5'' A 43 -0.817 17.223 -5.258 552 H4' A 43 H4' A 43 -2.892 17.932 -6.633 553 H3' A 43 H3' A 43 -1.345 19.041 -8.497 554 H2' A 43 H2' A 43 0.288 20.054 -7.126 555 HO2' A 43 HO2' A 43 -1.784 21.974 -7.429 556 H1' A 43 H1' A 43 -1.469 21.253 -5.092 557 H8 A 43 H8 A 43 -0.640 18.286 -3.419 558 H61 A 43 H61 A 43 5.257 20.121 -2.704 559 H62 A 43 H62 A 43 4.081 18.910 -2.236 560 H2 A 43 H2 A 43 3.368 22.731 -5.733 561 H5' U 44 H5' U 44 -6.337 19.862 -6.397 562 H5'' U 44 H5'' U 44 -4.693 20.169 -5.807 563 H4' U 44 H4' U 44 -6.256 17.598 -5.263 564 H3' U 44 H3' U 44 -5.873 20.135 -3.647 565 HO3' U 44 HO3' U 44 -7.928 19.839 -4.621 566 H2' U 44 H2' U 44 -5.925 18.791 -1.665 567 HO2' U 44 HO2' U 44 -7.600 17.315 -2.428 568 H1' U 44 H1' U 44 -4.216 16.921 -2.611 569 H3 U 44 H3 U 44 -1.763 19.452 0.263 570 H5 U 44 H5 U 44 -2.172 21.875 -3.156 571 H6 U 44 H6 U 44 -3.672 20.239 -4.070 572 H1 MET 1 H1 MET 1 -0.111 -12.971 5.151 573 H2 MET 1 H2 MET 1 0.811 -11.613 5.032 574 H3 MET 1 H3 MET 1 0.880 -12.758 3.853 575 HA MET 1 HA MET 1 -0.399 -10.884 3.106 576 HB2 MET 1 HB2 MET 1 -0.984 -13.182 2.308 577 HB3 MET 1 HB3 MET 1 -2.109 -13.340 3.675 578 HG2 MET 1 HG2 MET 1 -3.359 -12.724 1.713 579 HG3 MET 1 HG3 MET 1 -3.368 -11.373 2.841 580 HE1 MET 1 HE1 MET 1 -4.163 -9.646 1.205 581 HE2 MET 1 HE2 MET 1 -3.615 -9.544 -0.494 582 HE3 MET 1 HE3 MET 1 -4.408 -11.028 0.114 583 H LEU 2 H LEU 2 -1.810 -9.211 3.617 584 HA LEU 2 HA LEU 2 -3.634 -9.626 5.919 585 HB2 LEU 2 HB2 LEU 2 -1.391 -7.710 5.638 586 HB3 LEU 2 HB3 LEU 2 -2.935 -6.957 6.095 587 HG LEU 2 HG LEU 2 -1.613 -9.272 7.546 588 HD11 LEU 2 HD11 LEU 2 -1.141 -7.606 9.293 589 HD12 LEU 2 HD12 LEU 2 -0.385 -7.143 7.753 590 HD13 LEU 2 HD13 LEU 2 -1.867 -6.323 8.291 591 HD21 LEU 2 HD21 LEU 2 -3.295 -8.721 9.307 592 HD22 LEU 2 HD22 LEU 2 -4.067 -7.551 8.197 593 HD23 LEU 2 HD23 LEU 2 -4.083 -9.286 7.826 594 H ILE 3 H ILE 3 -5.522 -8.325 5.839 595 HA ILE 3 HA ILE 3 -5.982 -6.781 3.355 596 HB ILE 3 HB ILE 3 -7.788 -9.006 4.414 597 HG12 ILE 3 HG12 ILE 3 -7.523 -9.534 1.805 598 HG13 ILE 3 HG13 ILE 3 -6.002 -8.664 2.000 599 HG21 ILE 3 HG21 ILE 3 -8.235 -7.085 2.101 600 HG22 ILE 3 HG22 ILE 3 -9.244 -8.478 2.516 601 HG23 ILE 3 HG23 ILE 3 -9.154 -7.099 3.638 602 HD11 ILE 3 HD11 ILE 3 -6.945 -11.134 3.515 603 HD12 ILE 3 HD12 ILE 3 -5.673 -11.049 2.277 604 HD13 ILE 3 HD13 ILE 3 -5.410 -10.289 3.861 605 H LEU 4 H LEU 4 -7.485 -5.123 3.605 606 HA LEU 4 HA LEU 4 -8.590 -4.567 6.304 607 HB2 LEU 4 HB2 LEU 4 -6.712 -2.742 4.751 608 HB3 LEU 4 HB3 LEU 4 -7.602 -2.285 6.203 609 HG LEU 4 HG LEU 4 -5.450 -4.441 6.076 610 HD11 LEU 4 HD11 LEU 4 -5.476 -1.614 7.190 611 HD12 LEU 4 HD12 LEU 4 -4.114 -2.762 7.297 612 HD13 LEU 4 HD13 LEU 4 -4.633 -2.132 5.713 613 HD21 LEU 4 HD21 LEU 4 -6.908 -3.148 8.434 614 HD22 LEU 4 HD22 LEU 4 -7.110 -4.834 7.900 615 HD23 LEU 4 HD23 LEU 4 -5.551 -4.296 8.550 616 H THR 5 H THR 5 -10.025 -2.612 6.216 617 HA THR 5 HA THR 5 -10.873 -1.896 3.469 618 HB THR 5 HB THR 5 -13.004 -2.336 5.553 619 HG1 THR 5 HG1 THR 5 -11.884 -4.297 5.421 620 HG21 THR 5 HG21 THR 5 -13.514 -1.180 3.397 621 HG22 THR 5 HG22 THR 5 -12.869 -2.581 2.517 622 HG23 THR 5 HG23 THR 5 -14.340 -2.747 3.507 623 H ARG 6 H ARG 6 -9.873 0.052 3.645 624 HA ARG 6 HA ARG 6 -10.530 1.866 5.916 625 HB2 ARG 6 HB2 ARG 6 -8.355 1.840 3.773 626 HB3 ARG 6 HB3 ARG 6 -8.500 3.107 4.994 627 HG2 ARG 6 HG2 ARG 6 -8.322 0.228 5.903 628 HG3 ARG 6 HG3 ARG 6 -6.863 1.021 5.309 629 HD2 ARG 6 HD2 ARG 6 -7.243 1.172 7.808 630 HD3 ARG 6 HD3 ARG 6 -6.954 2.712 6.976 631 HE ARG 6 HE ARG 6 -9.291 3.229 7.105 632 HH11 ARG 6 HH11 ARG 6 -8.314 0.477 9.111 633 HH12 ARG 6 HH12 ARG 6 -9.704 0.621 10.166 634 HH21 ARG 6 HH21 ARG 6 -11.058 3.365 8.462 635 HH22 ARG 6 HH22 ARG 6 -11.293 2.198 9.756 636 H LYS 7 H LYS 7 -10.785 4.253 5.241 637 HA LYS 7 HA LYS 7 -11.908 4.393 2.486 638 HB2 LYS 7 HB2 LYS 7 -13.628 5.954 3.198 639 HB3 LYS 7 HB3 LYS 7 -13.835 4.389 3.955 640 HG2 LYS 7 HG2 LYS 7 -12.883 5.247 6.057 641 HG3 LYS 7 HG3 LYS 7 -12.546 6.819 5.280 642 HD2 LYS 7 HD2 LYS 7 -15.028 6.949 4.713 643 HD3 LYS 7 HD3 LYS 7 -15.264 5.533 5.758 644 HE2 LYS 7 HE2 LYS 7 -14.179 6.844 7.627 645 HE3 LYS 7 HE3 LYS 7 -14.137 8.250 6.535 646 HZ1 LYS 7 HZ1 LYS 7 -16.056 8.306 7.955 647 HZ2 LYS 7 HZ2 LYS 7 -16.525 8.132 6.389 648 HZ3 LYS 7 HZ3 LYS 7 -16.564 6.845 7.421 649 H VAL 8 H VAL 8 -12.296 6.780 1.856 650 HA VAL 8 HA VAL 8 -9.670 7.598 1.304 651 HB VAL 8 HB VAL 8 -10.582 9.430 0.114 652 HG11 VAL 8 HG11 VAL 8 -10.912 7.122 -0.768 653 HG12 VAL 8 HG12 VAL 8 -12.512 7.061 -0.001 654 HG13 VAL 8 HG13 VAL 8 -12.203 8.227 -1.297 655 HG21 VAL 8 HG21 VAL 8 -12.209 10.356 1.700 656 HG22 VAL 8 HG22 VAL 8 -12.946 10.026 0.125 657 HG23 VAL 8 HG23 VAL 8 -13.247 8.916 1.489 658 H GLY 9 H GLY 9 -8.237 8.911 2.101 659 HA2 GLY 9 HA2 GLY 9 -7.553 10.911 3.222 660 HA3 GLY 9 HA3 GLY 9 -8.998 10.823 4.245 661 H GLU 10 H GLU 10 -8.250 7.710 4.389 662 HA GLU 10 HA GLU 10 -6.701 8.027 6.867 663 HB2 GLU 10 HB2 GLU 10 -7.972 5.603 5.537 664 HB3 GLU 10 HB3 GLU 10 -7.167 5.608 7.122 665 HG2 GLU 10 HG2 GLU 10 -8.761 7.423 7.846 666 HG3 GLU 10 HG3 GLU 10 -9.668 7.147 6.350 667 H SER 11 H SER 11 -5.136 6.028 7.247 668 HA SER 11 HA SER 11 -3.310 5.675 4.948 669 HB2 SER 11 HB2 SER 11 -2.525 6.970 7.590 670 HB3 SER 11 HB3 SER 11 -1.387 6.460 6.326 671 HG SER 11 HG SER 11 -1.931 8.676 6.174 672 H ILE 12 H ILE 12 -1.530 4.227 5.478 673 HA ILE 12 HA ILE 12 -1.934 2.295 7.686 674 HB ILE 12 HB ILE 12 -1.815 1.635 4.706 675 HG12 ILE 12 HG12 ILE 12 -4.060 2.366 5.438 676 HG13 ILE 12 HG13 ILE 12 -4.038 0.673 4.961 677 HG21 ILE 12 HG21 ILE 12 -1.812 -0.226 7.122 678 HG22 ILE 12 HG22 ILE 12 -2.155 -0.748 5.467 679 HG23 ILE 12 HG23 ILE 12 -0.567 -0.074 5.855 680 HD11 ILE 12 HD11 ILE 12 -4.027 1.715 7.812 681 HD12 ILE 12 HD12 ILE 12 -5.366 0.922 6.961 682 HD13 ILE 12 HD13 ILE 12 -3.908 -0.007 7.353 683 H ASN 13 H ASN 13 0.129 0.795 7.722 684 HA ASN 13 HA ASN 13 2.478 2.280 6.659 685 HB2 ASN 13 HB2 ASN 13 1.883 1.596 9.558 686 HB3 ASN 13 HB3 ASN 13 3.517 1.918 8.969 687 HD21 ASN 13 HD22 ASN 13 4.153 4.013 8.414 688 HD22 ASN 13 HD21 ASN 13 3.156 5.412 8.727 689 H ILE 14 H ILE 14 4.423 1.147 6.590 690 HA ILE 14 HA ILE 14 4.348 -1.770 7.056 691 HB ILE 14 HB ILE 14 5.226 -0.487 4.435 692 HG12 ILE 14 HG12 ILE 14 2.783 -2.195 5.082 693 HG13 ILE 14 HG13 ILE 14 2.769 -0.473 4.659 694 HG21 ILE 14 HG21 ILE 14 5.041 -3.409 5.295 695 HG22 ILE 14 HG22 ILE 14 5.502 -2.835 3.679 696 HG23 ILE 14 HG23 ILE 14 6.544 -2.493 5.057 697 HD11 ILE 14 HD11 ILE 14 2.154 -1.737 2.706 698 HD12 ILE 14 HD12 ILE 14 3.772 -1.051 2.435 699 HD13 ILE 14 HD13 ILE 14 3.579 -2.774 2.838 700 H GLY 15 H GLY 15 6.437 -2.640 7.435 701 HA2 GLY 15 HA2 GLY 15 8.572 -2.585 8.303 702 HA3 GLY 15 HA3 GLY 15 8.898 -1.341 7.095 703 H ASP 16 H ASP 16 10.135 0.018 8.310 704 HA ASP 16 HA ASP 16 8.722 1.508 10.463 705 HB2 ASP 16 HB2 ASP 16 11.648 0.670 10.419 706 HB3 ASP 16 HB3 ASP 16 10.908 1.747 11.615 707 H ASP 17 H ASP 17 9.524 1.676 7.400 708 HA ASP 17 HA ASP 17 10.244 4.540 7.525 709 HB2 ASP 17 HB2 ASP 17 11.703 2.517 5.765 710 HB3 ASP 17 HB3 ASP 17 11.939 4.260 5.762 711 H ILE 18 H ILE 18 7.897 2.483 6.608 712 HA ILE 18 HA ILE 18 7.443 3.993 4.084 713 HB ILE 18 HB ILE 18 6.738 1.069 4.536 714 HG12 ILE 18 HG12 ILE 18 8.385 1.015 2.414 715 HG13 ILE 18 HG13 ILE 18 9.100 2.404 3.239 716 HG21 ILE 18 HG21 ILE 18 6.453 2.922 2.144 717 HG22 ILE 18 HG22 ILE 18 6.194 1.163 2.104 718 HG23 ILE 18 HG23 ILE 18 5.136 2.186 3.084 719 HD11 ILE 18 HD11 ILE 18 8.582 -0.343 4.468 720 HD12 ILE 18 HD12 ILE 18 10.161 0.241 3.888 721 HD13 ILE 18 HD13 ILE 18 9.390 1.009 5.290 722 H THR 19 H THR 19 5.364 4.589 3.637 723 HA THR 19 HA THR 19 3.203 3.920 5.551 724 HB THR 19 HB THR 19 3.907 6.752 4.676 725 HG1 THR 19 HG1 THR 19 5.367 5.969 6.212 726 HG21 THR 19 HG21 THR 19 1.517 6.512 5.069 727 HG22 THR 19 HG22 THR 19 1.816 5.668 6.608 728 HG23 THR 19 HG23 THR 19 2.248 7.386 6.426 729 H ILE 20 H ILE 20 1.090 4.348 4.609 730 HA ILE 20 HA ILE 20 1.028 4.636 1.640 731 HB ILE 20 HB ILE 20 -0.388 2.540 3.337 732 HG12 ILE 20 HG12 ILE 20 2.022 2.022 2.965 733 HG13 ILE 20 HG13 ILE 20 0.917 0.853 2.238 734 HG21 ILE 20 HG21 ILE 20 -1.833 3.226 1.521 735 HG22 ILE 20 HG22 ILE 20 -0.508 3.112 0.351 736 HG23 ILE 20 HG23 ILE 20 -1.149 1.642 1.124 737 HD11 ILE 20 HD11 ILE 20 2.829 1.429 0.760 738 HD12 ILE 20 HD12 ILE 20 1.262 1.819 0.018 739 HD13 ILE 20 HD13 ILE 20 2.264 3.113 0.714 740 H THR 21 H THR 21 -0.936 5.588 0.892 741 HA THR 21 HA THR 21 -2.892 6.427 2.955 742 HB THR 21 HB THR 21 -1.528 8.382 1.064 743 HG1 THR 21 HG1 THR 21 -1.232 8.014 3.854 744 HG21 THR 21 HG21 THR 21 -3.402 8.829 3.431 745 HG22 THR 21 HG22 THR 21 -2.645 10.088 2.431 746 HG23 THR 21 HG23 THR 21 -3.850 8.994 1.721 747 H ILE 22 H ILE 22 -4.931 6.773 2.158 748 HA ILE 22 HA ILE 22 -5.375 6.124 -0.715 749 HB ILE 22 HB ILE 22 -6.415 4.496 0.607 750 HG12 ILE 22 HG12 ILE 22 -8.802 4.770 0.262 751 HG13 ILE 22 HG13 ILE 22 -8.622 6.529 0.108 752 HG21 ILE 22 HG21 ILE 22 -7.952 4.983 2.486 753 HG22 ILE 22 HG22 ILE 22 -6.290 5.494 2.821 754 HG23 ILE 22 HG23 ILE 22 -7.526 6.702 2.384 755 HD11 ILE 22 HD11 ILE 22 -7.311 6.271 -1.913 756 HD12 ILE 22 HD12 ILE 22 -7.395 4.490 -1.772 757 HD13 ILE 22 HD13 ILE 22 -8.876 5.443 -2.065 758 H LEU 23 H LEU 23 -5.211 8.106 -1.722 759 HA LEU 23 HA LEU 23 -5.968 10.526 -0.380 760 HB2 LEU 23 HB2 LEU 23 -5.650 10.223 -3.367 761 HB3 LEU 23 HB3 LEU 23 -5.378 11.654 -2.385 762 HG LEU 23 HG LEU 23 -3.640 9.156 -2.549 763 HD11 LEU 23 HD11 LEU 23 -1.960 10.797 -3.339 764 HD12 LEU 23 HD12 LEU 23 -3.411 10.789 -4.372 765 HD13 LEU 23 HD13 LEU 23 -3.157 12.094 -3.189 766 HD21 LEU 23 HD21 LEU 23 -2.094 10.302 -1.008 767 HD22 LEU 23 HD22 LEU 23 -3.300 11.584 -0.741 768 HD23 LEU 23 HD23 LEU 23 -3.628 9.919 -0.201 769 H GLY 24 H GLY 24 -7.714 8.298 -2.530 770 HA2 GLY 24 HA2 GLY 24 -10.246 8.984 -1.778 771 HA3 GLY 24 HA3 GLY 24 -9.901 10.205 -2.994 772 H VAL 25 H VAL 25 -11.905 8.962 -3.869 773 HA VAL 25 HA VAL 25 -10.899 6.870 -5.739 774 HB VAL 25 HB VAL 25 -12.827 5.519 -5.470 775 HG11 VAL 25 HG11 VAL 25 -11.958 6.331 -2.675 776 HG12 VAL 25 HG12 VAL 25 -12.714 4.796 -3.160 777 HG13 VAL 25 HG13 VAL 25 -11.084 5.212 -3.745 778 HG21 VAL 25 HG21 VAL 25 -13.933 7.668 -3.627 779 HG22 VAL 25 HG22 VAL 25 -14.554 7.204 -5.231 780 HG23 VAL 25 HG23 VAL 25 -14.659 6.061 -3.886 781 H SER 26 H SER 26 -12.212 6.571 -7.636 782 HA SER 26 HA SER 26 -14.176 8.635 -8.361 783 HB2 SER 26 HB2 SER 26 -11.590 8.171 -9.915 784 HB3 SER 26 HB3 SER 26 -12.965 9.135 -10.477 785 HG SER 26 HG SER 26 -11.299 10.392 -9.496 786 H GLY 27 H GLY 27 -15.647 6.862 -8.401 787 HA2 GLY 27 HA2 GLY 27 -16.821 5.200 -9.513 788 HA3 GLY 27 HA3 GLY 27 -15.669 5.357 -10.857 789 H GLN 28 H GLN 28 -14.109 3.767 -11.120 790 HA GLN 28 HA GLN 28 -13.802 1.792 -8.891 791 HB2 GLN 28 HB2 GLN 28 -12.999 1.531 -11.822 792 HB3 GLN 28 HB3 GLN 28 -12.833 0.306 -10.565 793 HG2 GLN 28 HG2 GLN 28 -15.358 1.339 -11.848 794 HG3 GLN 28 HG3 GLN 28 -14.699 -0.310 -11.804 795 HE21 GLN 28 HE22 GLN 28 -14.270 -0.997 -9.277 796 HE22 GLN 28 HE21 GLN 28 -15.663 -0.745 -8.246 797 H GLN 29 H GLN 29 -12.247 4.331 -10.718 798 HA GLN 29 HA GLN 29 -9.537 3.496 -10.157 799 HB2 GLN 29 HB2 GLN 29 -10.782 6.189 -10.892 800 HB3 GLN 29 HB3 GLN 29 -9.069 5.967 -10.549 801 HG2 GLN 29 HG2 GLN 29 -9.235 5.834 -12.893 802 HG3 GLN 29 HG3 GLN 29 -8.981 4.182 -12.327 803 HE21 GLN 29 HE22 GLN 29 -10.566 2.637 -12.702 804 HE22 GLN 29 HE21 GLN 29 -12.073 2.992 -13.534 805 H VAL 30 H VAL 30 -8.171 4.173 -8.536 806 HA VAL 30 HA VAL 30 -9.384 5.496 -6.178 807 HB VAL 30 HB VAL 30 -7.752 2.912 -6.198 808 HG11 VAL 30 HG11 VAL 30 -7.373 4.415 -4.230 809 HG12 VAL 30 HG12 VAL 30 -9.120 4.351 -3.898 810 HG13 VAL 30 HG13 VAL 30 -8.145 2.870 -3.810 811 HG21 VAL 30 HG21 VAL 30 -10.687 3.412 -5.527 812 HG22 VAL 30 HG22 VAL 30 -10.070 2.478 -6.912 813 HG23 VAL 30 HG23 VAL 30 -9.821 1.884 -5.259 814 H ARG 31 H ARG 31 -8.148 7.262 -5.840 815 HA ARG 31 HA ARG 31 -5.402 7.421 -6.852 816 HB2 ARG 31 HB2 ARG 31 -7.407 9.225 -5.526 817 HB3 ARG 31 HB3 ARG 31 -5.693 9.595 -5.259 818 HG2 ARG 31 HG2 ARG 31 -6.788 9.199 -8.058 819 HG3 ARG 31 HG3 ARG 31 -6.776 10.767 -7.231 820 HD2 ARG 31 HD2 ARG 31 -4.322 10.461 -6.786 821 HD3 ARG 31 HD3 ARG 31 -4.352 9.021 -7.818 822 HE ARG 31 HE ARG 31 -5.213 10.616 -9.636 823 HH11 ARG 31 HH11 ARG 31 -3.090 11.674 -7.016 824 HH12 ARG 31 HH12 ARG 31 -2.388 12.971 -7.951 825 HH21 ARG 31 HH21 ARG 31 -4.332 12.335 -10.806 826 HH22 ARG 31 HH22 ARG 31 -3.099 13.355 -10.091 827 H ILE 32 H ILE 32 -3.748 6.585 -5.806 828 HA ILE 32 HA ILE 32 -3.931 6.264 -2.836 829 HB ILE 32 HB ILE 32 -2.520 4.321 -4.696 830 HG12 ILE 32 HG12 ILE 32 -5.394 4.261 -3.711 831 HG13 ILE 32 HG13 ILE 32 -4.801 4.226 -5.384 832 HG21 ILE 32 HG21 ILE 32 -3.529 4.072 -1.830 833 HG22 ILE 32 HG22 ILE 32 -2.621 2.840 -2.739 834 HG23 ILE 32 HG23 ILE 32 -1.840 4.362 -2.307 835 HD11 ILE 32 HD11 ILE 32 -5.505 2.004 -4.762 836 HD12 ILE 32 HD12 ILE 32 -3.739 2.012 -4.918 837 HD13 ILE 32 HD13 ILE 32 -4.503 2.030 -3.302 838 H GLY 33 H GLY 33 -1.921 6.399 -1.707 839 HA2 GLY 33 HA2 GLY 33 0.345 7.499 -3.295 840 HA3 GLY 33 HA3 GLY 33 -0.199 8.282 -1.799 841 H ILE 34 H ILE 34 2.403 7.249 -2.265 842 HA ILE 34 HA ILE 34 2.621 5.182 -0.147 843 HB ILE 34 HB ILE 34 4.001 5.116 -2.871 844 HG12 ILE 34 HG12 ILE 34 1.945 3.153 -1.775 845 HG13 ILE 34 HG13 ILE 34 1.575 4.444 -2.941 846 HG21 ILE 34 HG21 ILE 34 4.132 3.205 -0.497 847 HG22 ILE 34 HG22 ILE 34 4.919 2.945 -2.066 848 HG23 ILE 34 HG23 ILE 34 5.433 4.291 -1.046 849 HD11 ILE 34 HD11 ILE 34 3.264 3.549 -4.497 850 HD12 ILE 34 HD12 ILE 34 3.502 2.154 -3.414 851 HD13 ILE 34 HD13 ILE 34 1.924 2.415 -4.180 852 H ASN 35 H ASN 35 4.439 5.497 1.124 853 HA ASN 35 HA ASN 35 6.175 7.781 0.341 854 HB2 ASN 35 HB2 ASN 35 4.227 8.521 1.735 855 HB3 ASN 35 HB3 ASN 35 4.800 7.477 3.030 856 HD21 ASN 35 HD22 ASN 35 4.478 10.231 3.382 857 HD22 ASN 35 HD21 ASN 35 6.048 10.996 3.543 858 H ALA 36 H ALA 36 7.923 6.580 -0.006 859 HA ALA 36 HA ALA 36 9.261 5.450 2.381 860 HB1 ALA 36 HB1 ALA 36 9.030 4.075 -0.330 861 HB2 ALA 36 HB2 ALA 36 10.071 3.557 1.006 862 HB3 ALA 36 HB3 ALA 36 8.299 3.498 1.194 863 HA PRO 37 HA PRO 37 12.626 7.752 0.685 864 HB2 PRO 37 HB2 PRO 37 14.749 6.077 1.334 865 HB3 PRO 37 HB3 PRO 37 13.959 7.213 2.481 866 HG2 PRO 37 HG2 PRO 37 13.547 4.237 2.150 867 HG3 PRO 37 HG3 PRO 37 13.620 5.193 3.659 868 HD2 PRO 37 HD2 PRO 37 11.272 4.385 2.535 869 HD3 PRO 37 HD3 PRO 37 11.413 5.955 3.383 870 H LYS 38 H LYS 38 14.006 7.770 -1.167 871 HA LYS 38 HA LYS 38 13.328 5.937 -3.273 872 HB2 LYS 38 HB2 LYS 38 15.320 8.167 -2.858 873 HB3 LYS 38 HB3 LYS 38 15.500 7.086 -4.248 874 HG2 LYS 38 HG2 LYS 38 14.239 8.947 -4.927 875 HG3 LYS 38 HG3 LYS 38 13.197 7.510 -4.946 876 HD2 LYS 38 HD2 LYS 38 11.822 9.284 -4.083 877 HD3 LYS 38 HD3 LYS 38 12.203 8.307 -2.730 878 HE2 LYS 38 HE2 LYS 38 12.463 10.640 -2.137 879 HE3 LYS 38 HE3 LYS 38 14.096 9.931 -2.177 880 HZ1 LYS 38 HZ1 LYS 38 12.839 11.547 -4.292 881 HZ2 LYS 38 HZ2 LYS 38 14.059 12.018 -3.307 882 HZ3 LYS 38 HZ3 LYS 38 14.315 10.828 -4.415 883 H ASP 39 H ASP 39 15.270 5.625 -0.657 884 HA ASP 39 HA ASP 39 17.392 3.900 -1.514 885 HB2 ASP 39 HB2 ASP 39 15.894 4.228 1.108 886 HB3 ASP 39 HB3 ASP 39 17.254 3.122 0.924 887 H VAL 40 H VAL 40 14.029 3.370 -1.538 888 HA VAL 40 HA VAL 40 14.468 0.451 -1.897 889 HB VAL 40 HB VAL 40 12.376 -0.034 -0.741 890 HG11 VAL 40 HG11 VAL 40 14.129 1.821 0.939 891 HG12 VAL 40 HG12 VAL 40 13.037 0.566 1.561 892 HG13 VAL 40 HG13 VAL 40 14.475 0.104 0.613 893 HG21 VAL 40 HG21 VAL 40 11.251 2.138 -1.305 894 HG22 VAL 40 HG22 VAL 40 11.064 1.602 0.374 895 HG23 VAL 40 HG23 VAL 40 12.231 2.892 -0.009 896 H ALA 41 H ALA 41 12.463 -0.495 -3.124 897 HA ALA 41 HA ALA 41 11.983 1.466 -5.303 898 HB1 ALA 41 HB1 ALA 41 11.684 -0.525 -6.730 899 HB2 ALA 41 HB2 ALA 41 13.251 -0.571 -5.892 900 HB3 ALA 41 HB3 ALA 41 11.899 -1.583 -5.319 901 H VAL 42 H VAL 42 9.948 1.608 -6.332 902 HA VAL 42 HA VAL 42 7.698 0.025 -5.412 903 HB VAL 42 HB VAL 42 7.405 1.490 -3.643 904 HG11 VAL 42 HG11 VAL 42 8.412 3.718 -5.435 905 HG12 VAL 42 HG12 VAL 42 7.683 3.984 -3.830 906 HG13 VAL 42 HG13 VAL 42 9.174 3.041 -3.975 907 HG21 VAL 42 HG21 VAL 42 5.564 3.010 -4.190 908 HG22 VAL 42 HG22 VAL 42 5.947 2.914 -5.910 909 HG23 VAL 42 HG23 VAL 42 5.366 1.461 -5.047 910 H HIS 43 H HIS 43 6.376 -0.304 -7.068 911 HA HIS 43 HA HIS 43 5.963 1.719 -9.144 912 HB2 HIS 43 HB2 HIS 43 6.885 -1.011 -10.048 913 HB3 HIS 43 HB3 HIS 43 6.792 0.500 -10.956 914 HD2 HIS 43 HD2 HIS 43 9.003 -1.294 -8.330 915 HE1 HIS 43 HE1 HIS 43 11.390 1.747 -10.094 916 HE2 HIS 43 HE2 HIS 43 11.392 -0.236 -8.510 917 H ARG 44 H ARG 44 4.346 0.723 -10.865 918 HA ARG 44 HA ARG 44 2.277 -0.737 -9.414 919 HB2 ARG 44 HB2 ARG 44 1.038 -0.619 -11.532 920 HB3 ARG 44 HB3 ARG 44 1.620 0.972 -11.024 921 HG2 ARG 44 HG2 ARG 44 3.456 0.883 -12.614 922 HG3 ARG 44 HG3 ARG 44 3.041 -0.783 -13.075 923 HD2 ARG 44 HD2 ARG 44 1.194 1.613 -13.420 924 HD3 ARG 44 HD3 ARG 44 2.226 0.946 -14.697 925 HE ARG 44 HE ARG 44 0.701 -1.196 -13.692 926 HH11 ARG 44 HH11 ARG 44 0.129 1.866 -15.386 927 HH12 ARG 44 HH12 ARG 44 -1.290 1.277 -16.204 928 HH21 ARG 44 HH21 ARG 44 -1.145 -1.938 -14.780 929 HH22 ARG 44 HH22 ARG 44 -2.015 -0.878 -15.863 930 H GLU 45 H GLU 45 1.319 -2.771 -10.519 931 HA GLU 45 HA GLU 45 3.313 -4.738 -10.253 932 HB2 GLU 45 HB2 GLU 45 0.838 -4.908 -9.852 933 HB3 GLU 45 HB3 GLU 45 0.587 -5.039 -11.593 934 HG2 GLU 45 HG2 GLU 45 2.326 -6.928 -9.941 935 HG3 GLU 45 HG3 GLU 45 0.609 -7.206 -10.273 936 H GLU 46 H GLU 46 2.307 -2.946 -13.109 937 HA GLU 46 HA GLU 46 3.196 -4.811 -15.096 938 HB2 GLU 46 HB2 GLU 46 1.731 -2.866 -15.574 939 HB3 GLU 46 HB3 GLU 46 3.032 -1.767 -15.089 940 HG2 GLU 46 HG2 GLU 46 2.840 -1.967 -17.543 941 HG3 GLU 46 HG3 GLU 46 4.414 -2.519 -16.961 942 H ILE 47 H ILE 47 4.785 -1.946 -13.581 943 HA ILE 47 HA ILE 47 7.182 -2.294 -15.148 944 HB ILE 47 HB ILE 47 6.795 -0.711 -12.594 945 HG12 ILE 47 HG12 ILE 47 4.994 -0.007 -13.978 946 HG13 ILE 47 HG13 ILE 47 6.238 1.234 -14.080 947 HG21 ILE 47 HG21 ILE 47 9.118 -0.865 -13.343 948 HG22 ILE 47 HG22 ILE 47 8.656 -0.348 -14.983 949 HG23 ILE 47 HG23 ILE 47 8.513 0.775 -13.609 950 HD11 ILE 47 HD11 ILE 47 5.268 0.796 -16.281 951 HD12 ILE 47 HD12 ILE 47 6.970 0.277 -16.271 952 HD13 ILE 47 HD13 ILE 47 5.654 -0.928 -16.150 953 H TYR 48 H TYR 48 6.065 -3.411 -11.980 954 HA TYR 48 HA TYR 48 8.512 -3.886 -10.704 955 HB2 TYR 48 HB2 TYR 48 6.297 -4.035 -9.633 956 HB3 TYR 48 HB3 TYR 48 5.920 -5.462 -10.607 957 HD1 TYR 48 HD1 TYR 48 8.355 -4.213 -8.044 958 HD2 TYR 48 HD2 TYR 48 6.488 -7.604 -9.916 959 HE1 TYR 48 HE1 TYR 48 9.365 -5.700 -6.344 960 HE2 TYR 48 HE2 TYR 48 7.470 -9.103 -8.215 961 HH TYR 48 HH TYR 48 9.555 -7.860 -5.565 962 H GLN 49 H GLN 49 6.959 -5.676 -13.318 963 HA GLN 49 HA GLN 49 8.230 -8.185 -12.931 964 HB2 GLN 49 HB2 GLN 49 7.042 -6.814 -15.361 965 HB3 GLN 49 HB3 GLN 49 7.576 -8.514 -15.351 966 HG2 GLN 49 HG2 GLN 49 6.005 -9.099 -13.624 967 HG3 GLN 49 HG3 GLN 49 5.639 -7.410 -13.281 968 HE21 GLN 49 HE22 GLN 49 3.385 -7.913 -13.580 969 HE22 GLN 49 HE21 GLN 49 2.698 -8.031 -15.178 970 H ARG 50 H ARG 50 9.569 -5.175 -14.000 971 HA ARG 50 HA ARG 50 11.853 -6.453 -15.368 972 HB2 ARG 50 HB2 ARG 50 11.162 -3.600 -14.533 973 HB3 ARG 50 HB3 ARG 50 12.710 -4.050 -15.249 974 HG2 ARG 50 HG2 ARG 50 11.329 -3.171 -16.986 975 HG3 ARG 50 HG3 ARG 50 11.602 -4.891 -17.270 976 HD2 ARG 50 HD2 ARG 50 9.327 -5.396 -16.449 977 HD3 ARG 50 HD3 ARG 50 9.075 -3.673 -16.076 978 HE ARG 50 HE ARG 50 9.843 -3.909 -18.793 979 HH11 ARG 50 HH11 ARG 50 7.082 -4.699 -16.713 980 HH12 ARG 50 HH12 ARG 50 5.935 -4.614 -18.021 981 HH21 ARG 50 HH21 ARG 50 8.308 -3.787 -20.466 982 HH22 ARG 50 HH22 ARG 50 6.612 -4.082 -20.123 983 H ILE 51 H ILE 51 11.040 -4.952 -12.248 984 HA ILE 51 HA ILE 51 13.604 -4.347 -11.316 985 HB ILE 51 HB ILE 51 10.871 -4.772 -10.195 986 HG12 ILE 51 HG12 ILE 51 11.094 -2.434 -9.578 987 HG13 ILE 51 HG13 ILE 51 12.820 -2.432 -9.989 988 HG21 ILE 51 HG21 ILE 51 11.682 -4.007 -7.941 989 HG22 ILE 51 HG22 ILE 51 12.085 -5.679 -8.349 990 HG23 ILE 51 HG23 ILE 51 13.335 -4.413 -8.462 991 HD11 ILE 51 HD11 ILE 51 10.542 -2.869 -11.954 992 HD12 ILE 51 HD12 ILE 51 11.405 -1.334 -11.702 993 HD13 ILE 51 HD13 ILE 51 12.275 -2.739 -12.356 994 H GLN 52 H GLN 52 11.628 -7.137 -10.177 995 HA GLN 52 HA GLN 52 13.855 -8.227 -8.715 996 HB2 GLN 52 HB2 GLN 52 12.186 -10.219 -8.535 997 HB3 GLN 52 HB3 GLN 52 11.781 -8.688 -7.751 998 HG2 GLN 52 HG2 GLN 52 9.868 -9.762 -9.034 999 HG3 GLN 52 HG3 GLN 52 10.220 -8.082 -9.421 1000 HE21 GLN 52 HE22 GLN 52 10.544 -7.512 -11.472 1001 HE22 GLN 52 HE21 GLN 52 10.896 -8.588 -12.796 1002 H ALA 53 H ALA 53 13.483 -8.179 -12.030 1003 HA ALA 53 HA ALA 53 14.075 -10.924 -12.629 1004 HB1 ALA 53 HB1 ALA 53 14.539 -10.088 -14.864 1005 HB2 ALA 53 HB2 ALA 53 13.089 -9.282 -14.239 1006 HB3 ALA 53 HB3 ALA 53 14.651 -8.422 -14.254 1007 H GLY 54 H GLY 54 15.999 -8.326 -11.352 1008 HA2 GLY 54 HA2 GLY 54 18.123 -9.456 -10.416 1009 HA3 GLY 54 HA3 GLY 54 18.512 -9.755 -12.114 1010 H LEU 55 H LEU 55 16.947 -6.708 -11.011 1011 HA LEU 55 HA LEU 55 19.536 -5.319 -11.405 1012 HB2 LEU 55 HB2 LEU 55 18.242 -3.789 -13.048 1013 HB3 LEU 55 HB3 LEU 55 18.970 -5.310 -13.622 1014 HG LEU 55 HG LEU 55 16.507 -6.265 -13.171 1015 HD11 LEU 55 HD11 LEU 55 15.486 -4.227 -12.270 1016 HD12 LEU 55 HD12 LEU 55 16.104 -3.286 -13.668 1017 HD13 LEU 55 HD13 LEU 55 14.849 -4.516 -13.891 1018 HD21 LEU 55 HD21 LEU 55 17.713 -6.245 -15.291 1019 HD22 LEU 55 HD22 LEU 55 16.016 -5.774 -15.514 1020 HD23 LEU 55 HD23 LEU 55 17.289 -4.527 -15.531 1021 H THR 56 H THR 56 16.163 -5.175 -10.372 1022 HA THR 56 HA THR 56 14.927 -3.533 -9.504 1023 HB THR 56 HB THR 56 17.377 -3.098 -7.749 1024 HG1 THR 56 HG1 THR 56 16.619 -4.906 -6.639 1025 HG21 THR 56 HG21 THR 56 14.376 -2.942 -7.199 1026 HG22 THR 56 HG22 THR 56 15.623 -2.975 -5.928 1027 HG23 THR 56 HG23 THR 56 15.563 -1.623 -7.058 1028 H ALA 57 H ALA 57 16.619 -2.604 -11.781 1029 HA ALA 57 HA ALA 57 16.014 0.243 -11.479 1030 HB1 ALA 57 HB1 ALA 57 18.292 0.963 -12.073 1031 HB2 ALA 57 HB2 ALA 57 18.267 0.116 -10.515 1032 HB3 ALA 57 HB3 ALA 57 18.857 -0.724 -11.971 1033 HA PRO 58 HA PRO 58 14.873 -1.469 -15.590 1034 HB2 PRO 58 HB2 PRO 58 13.674 1.307 -15.497 1035 HB3 PRO 58 HB3 PRO 58 12.989 -0.184 -16.224 1036 HG2 PRO 58 HG2 PRO 58 12.155 0.647 -13.776 1037 HG3 PRO 58 HG3 PRO 58 12.562 -1.088 -14.020 1038 HD2 PRO 58 HD2 PRO 58 14.255 1.087 -12.772 1039 HD3 PRO 58 HD3 PRO 58 14.000 -0.596 -12.220 1040 H ASP 59 H ASP 59 15.550 -1.030 -17.656 1041 HA ASP 59 HA ASP 59 16.573 -0.135 -19.433 1042 HB2 ASP 59 HB2 ASP 59 14.983 1.690 -18.866 1043 HB3 ASP 59 HB3 ASP 59 16.261 2.499 -17.970 1044 H5' U 36 H5' U 36 -17.557 -3.509 10.297 1045 H5'' U 36 H5'' U 36 -17.430 -3.339 8.532 1046 H4' U 36 H4' U 36 -16.713 -5.883 10.055 1047 H3' U 36 H3' U 36 -15.195 -3.732 10.501 1048 H2' U 36 H2' U 36 -15.356 -2.846 8.348 1049 HO2' U 36 HO2' U 36 -12.953 -4.358 8.443 1050 H1' U 36 H1' U 36 -14.550 -5.408 6.988 1051 H3 U 36 H3 U 36 -17.594 -5.155 3.448 1052 H5 U 36 H5 U 36 -16.913 -1.242 4.801 1053 H6 U 36 H6 U 36 -15.761 -2.154 6.715 1054 HO5' U 36 HO5' U 36 -19.515 -4.013 9.230 1055 H5' C 37 H5' C 37 -14.254 -4.571 13.934 1056 H5'' C 37 H5'' C 37 -14.476 -3.580 12.479 1057 H4' C 37 H4' C 37 -11.790 -3.798 13.875 1058 H3' C 37 H3' C 37 -13.904 -2.777 15.268 1059 H2' C 37 H2' C 37 -14.718 -1.342 13.614 1060 HO2' C 37 HO2' C 37 -14.190 -0.041 15.463 1061 H1' C 37 H1' C 37 -11.952 -0.368 12.928 1062 H41 C 37 H41 C 37 -14.837 1.531 7.620 1063 H42 C 37 H42 C 37 -16.213 0.472 7.890 1064 H5 C 37 H5 C 37 -16.317 -1.089 9.786 1065 H6 C 37 H6 C 37 -15.129 -1.869 11.764 1066 H5' A 38 H5' A 38 -11.202 -5.419 15.268 1067 H5'' A 38 H5'' A 38 -10.115 -5.449 16.666 1068 H4' A 38 H4' A 38 -9.067 -6.660 14.882 1069 H3' A 38 H3' A 38 -7.709 -4.675 16.193 1070 H2' A 38 H2' A 38 -8.387 -2.955 14.646 1071 HO2' A 38 HO2' A 38 -5.895 -3.973 13.721 1072 H1' A 38 H1' A 38 -7.630 -4.892 12.436 1073 H8 A 38 H8 A 38 -9.211 -1.608 13.386 1074 H61 A 38 H61 A 38 -11.236 -1.261 7.523 1075 H62 A 38 H62 A 38 -11.031 -0.385 9.024 1076 H2 A 38 H2 A 38 -9.460 -5.289 8.144 1077 H5' G 39 H5' G 39 -8.010 -8.089 13.519 1078 H5'' G 39 H5'' G 39 -7.754 -9.503 14.546 1079 H4' G 39 H4' G 39 -7.703 -10.381 12.374 1080 H3' G 39 H3' G 39 -5.416 -10.730 13.758 1081 H2' G 39 H2' G 39 -4.360 -8.703 13.151 1082 HO2' G 39 HO2' G 39 -2.819 -9.113 11.550 1083 H1' G 39 H1' G 39 -5.095 -8.884 10.250 1084 H8 G 39 H8 G 39 -7.073 -6.259 10.879 1085 H1 G 39 H1 G 39 -1.209 -4.193 12.473 1086 H21 G 39 H21 G 39 0.151 -5.884 12.692 1087 H22 G 39 H22 G 39 -0.351 -7.548 12.441 1088 H5' G 40 H5' G 40 -4.465 -11.841 9.257 1089 H5'' G 40 H5'' G 40 -4.106 -13.577 9.302 1090 H4' G 40 H4' G 40 -2.749 -12.358 7.651 1091 H3' G 40 H3' G 40 -1.770 -14.285 9.475 1092 H2' G 40 H2' G 40 -0.623 -12.558 10.730 1093 HO2' G 40 HO2' G 40 1.095 -13.428 8.629 1094 H1' G 40 H1' G 40 -0.074 -11.327 8.001 1095 H8 G 40 H8 G 40 -0.940 -10.038 11.583 1096 H1 G 40 H1 G 40 4.577 -7.858 9.127 1097 H21 G 40 H21 G 40 4.971 -8.842 7.170 1098 H22 G 40 H22 G 40 3.844 -9.970 6.463 1099 H5' A 41 H5' A 41 -3.038 -15.127 4.917 1100 H5'' A 41 H5'' A 41 -3.142 -13.673 5.920 1101 H4' A 41 H4' A 41 -5.079 -15.999 6.262 1102 H3' A 41 H3' A 41 -5.083 -13.732 4.281 1103 H2' A 41 H2' A 41 -7.309 -13.211 4.755 1104 HO2' A 41 HO2' A 41 -8.387 -15.082 4.515 1105 H1' A 41 H1' A 41 -7.375 -14.217 7.414 1106 H8 A 41 H8 A 41 -5.330 -11.394 5.646 1107 H61 A 41 H61 A 41 -8.755 -7.605 9.183 1108 H62 A 41 H62 A 41 -7.553 -7.666 7.903 1109 H2 A 41 H2 A 41 -9.872 -11.781 10.154 1110 H5' C 42 H5' C 42 -5.681 -12.821 1.343 1111 H5'' C 42 H5'' C 42 -6.479 -13.058 2.923 1112 H4' C 42 H4' C 42 -8.246 -12.091 2.339 1113 H3' C 42 H3' C 42 -8.649 -14.484 1.038 1114 H2' C 42 H2' C 42 -7.927 -13.865 -1.058 1115 HO2' C 42 HO2' C 42 -9.653 -13.209 -2.331 1116 H1' C 42 H1' C 42 -8.931 -11.039 -0.880 1117 H41 C 42 H41 C 42 -4.522 -10.906 -5.527 1118 H42 C 42 H42 C 42 -3.371 -11.771 -4.525 1119 H5 C 42 H5 C 42 -3.940 -12.612 -2.282 1120 H6 C 42 H6 C 42 -5.742 -12.711 -0.611 1121 H5' A 43 H5' A 43 -9.864 -16.245 1.169 1122 H5'' A 43 H5'' A 43 -10.439 -14.975 0.106 1123 H4' A 43 H4' A 43 -11.365 -17.715 0.179 1124 H3' A 43 H3' A 43 -10.824 -15.655 -1.645 1125 H2' A 43 H2' A 43 -12.799 -14.550 -2.025 1126 HO2' A 43 HO2' A 43 -13.422 -16.332 -3.403 1127 H1' A 43 H1' A 43 -14.710 -15.806 -0.428 1128 H8 A 43 H8 A 43 -11.682 -13.337 -0.220 1129 H61 A 43 H61 A 43 -15.677 -9.852 3.004 1130 H62 A 43 H62 A 43 -14.115 -9.873 2.207 1131 H2 A 43 H2 A 43 -17.497 -13.855 2.454 1132 H5' U 44 H5' U 44 -12.114 -15.552 -6.353 1133 H5'' U 44 H5'' U 44 -10.435 -15.565 -5.793 1134 H4' U 44 H4' U 44 -10.908 -13.276 -6.179 1135 H3' U 44 H3' U 44 -11.195 -13.937 -3.248 1136 HO3' U 44 HO3' U 44 -9.122 -12.730 -4.783 1137 H2' U 44 H2' U 44 -11.420 -11.589 -2.859 1138 HO2' U 44 HO2' U 44 -9.779 -10.809 -4.204 1139 H1' U 44 H1' U 44 -12.875 -11.098 -5.150 1140 H3 U 44 H3 U 44 -15.439 -10.055 -1.496 1141 H5 U 44 H5 U 44 -16.015 -14.161 -2.164 1142 H6 U 44 H6 U 44 -14.205 -14.108 -3.750 Start of MODEL 9 1 H1 MET 1 H1 MET 1 8.676 10.413 -2.640 2 H2 MET 1 H2 MET 1 8.638 8.792 -2.376 3 H3 MET 1 H3 MET 1 8.597 9.839 -1.102 4 HA MET 1 HA MET 1 6.431 8.918 -1.475 5 HB2 MET 1 HB2 MET 1 6.622 11.271 -0.632 6 HB3 MET 1 HB3 MET 1 6.680 11.842 -2.310 7 HG2 MET 1 HG2 MET 1 4.447 12.166 -1.644 8 HG3 MET 1 HG3 MET 1 4.417 10.738 -2.661 9 HE1 MET 1 HE1 MET 1 2.275 9.476 -1.953 10 HE2 MET 1 HE2 MET 1 1.553 9.841 -0.366 11 HE3 MET 1 HE3 MET 1 2.017 11.164 -1.484 12 H LEU 2 H LEU 2 4.838 8.226 -2.911 13 HA LEU 2 HA LEU 2 4.998 9.190 -5.703 14 HB2 LEU 2 HB2 LEU 2 5.561 6.468 -4.684 15 HB3 LEU 2 HB3 LEU 2 4.356 6.507 -5.983 16 HG LEU 2 HG LEU 2 7.135 7.704 -6.130 17 HD11 LEU 2 HD11 LEU 2 5.897 5.248 -7.444 18 HD12 LEU 2 HD12 LEU 2 7.554 5.857 -7.702 19 HD13 LEU 2 HD13 LEU 2 7.079 5.243 -6.109 20 HD21 LEU 2 HD21 LEU 2 5.578 8.960 -7.573 21 HD22 LEU 2 HD22 LEU 2 6.573 7.884 -8.572 22 HD23 LEU 2 HD23 LEU 2 4.893 7.436 -8.190 23 H ILE 3 H ILE 3 3.005 9.073 -6.821 24 HA ILE 3 HA ILE 3 0.650 8.166 -5.238 25 HB ILE 3 HB ILE 3 0.873 10.764 -6.820 26 HG12 ILE 3 HG12 ILE 3 0.029 11.597 -4.483 27 HG13 ILE 3 HG13 ILE 3 0.743 10.093 -3.865 28 HG21 ILE 3 HG21 ILE 3 -1.475 9.536 -5.316 29 HG22 ILE 3 HG22 ILE 3 -1.449 11.140 -6.075 30 HG23 ILE 3 HG23 ILE 3 -1.347 9.696 -7.092 31 HD11 ILE 3 HD11 ILE 3 2.093 12.342 -5.396 32 HD12 ILE 3 HD12 ILE 3 2.338 11.938 -3.682 33 HD13 ILE 3 HD13 ILE 3 2.938 10.834 -4.914 34 H LEU 4 H LEU 4 -1.020 7.284 -6.507 35 HA LEU 4 HA LEU 4 -0.510 6.805 -9.393 36 HB2 LEU 4 HB2 LEU 4 -0.807 4.654 -7.258 37 HB3 LEU 4 HB3 LEU 4 -0.810 4.353 -8.995 38 HG LEU 4 HG LEU 4 1.555 5.505 -7.453 39 HD11 LEU 4 HD11 LEU 4 0.880 2.718 -8.474 40 HD12 LEU 4 HD12 LEU 4 2.477 3.210 -7.847 41 HD13 LEU 4 HD13 LEU 4 1.053 3.223 -6.780 42 HD21 LEU 4 HD21 LEU 4 1.270 4.448 -10.309 43 HD22 LEU 4 HD22 LEU 4 1.531 6.149 -9.850 44 HD23 LEU 4 HD23 LEU 4 2.791 4.944 -9.533 45 H THR 5 H THR 5 -2.391 5.662 -10.412 46 HA THR 5 HA THR 5 -4.829 5.715 -8.715 47 HB THR 5 HB THR 5 -5.116 6.484 -11.605 48 HG1 THR 5 HG1 THR 5 -3.546 7.904 -10.746 49 HG21 THR 5 HG21 THR 5 -7.049 5.969 -10.118 50 HG22 THR 5 HG22 THR 5 -6.516 7.266 -9.023 51 HG23 THR 5 HG23 THR 5 -7.055 7.657 -10.677 52 H ARG 6 H ARG 6 -4.919 3.646 -8.390 53 HA ARG 6 HA ARG 6 -4.781 1.640 -10.574 54 HB2 ARG 6 HB2 ARG 6 -3.479 1.599 -8.341 55 HB3 ARG 6 HB3 ARG 6 -5.036 1.420 -7.548 56 HG2 ARG 6 HG2 ARG 6 -4.219 -0.726 -7.593 57 HG3 ARG 6 HG3 ARG 6 -5.298 -0.730 -8.995 58 HD2 ARG 6 HD2 ARG 6 -2.306 -0.146 -9.177 59 HD3 ARG 6 HD3 ARG 6 -2.966 -1.787 -9.251 60 HE ARG 6 HE ARG 6 -4.322 -0.168 -11.163 61 HH11 ARG 6 HH11 ARG 6 -1.198 -1.730 -10.589 62 HH12 ARG 6 HH12 ARG 6 -0.840 -1.859 -12.298 63 HH21 ARG 6 HH21 ARG 6 -3.832 -0.365 -13.349 64 HH22 ARG 6 HH22 ARG 6 -2.331 -1.089 -13.865 65 H LYS 7 H LYS 7 -6.636 -0.050 -10.606 66 HA LYS 7 HA LYS 7 -9.044 0.905 -9.125 67 HB2 LYS 7 HB2 LYS 7 -10.492 0.085 -10.911 68 HB3 LYS 7 HB3 LYS 7 -9.539 1.468 -11.426 69 HG2 LYS 7 HG2 LYS 7 -8.033 -0.008 -12.682 70 HG3 LYS 7 HG3 LYS 7 -8.862 -1.447 -12.024 71 HD2 LYS 7 HD2 LYS 7 -10.996 -0.617 -13.063 72 HD3 LYS 7 HD3 LYS 7 -10.077 0.694 -13.821 73 HE2 LYS 7 HE2 LYS 7 -9.678 -2.300 -14.245 74 HE3 LYS 7 HE3 LYS 7 -10.434 -1.167 -15.374 75 HZ1 LYS 7 HZ1 LYS 7 -8.308 0.013 -15.450 76 HZ2 LYS 7 HZ2 LYS 7 -7.618 -1.142 -14.506 77 HZ3 LYS 7 HZ3 LYS 7 -8.187 -1.534 -15.992 78 H VAL 8 H VAL 8 -10.759 -0.905 -9.071 79 HA VAL 8 HA VAL 8 -9.580 -2.721 -7.281 80 HB VAL 8 HB VAL 8 -11.728 -3.699 -7.014 81 HG11 VAL 8 HG11 VAL 8 -12.035 -0.731 -7.655 82 HG12 VAL 8 HG12 VAL 8 -13.044 -1.676 -6.552 83 HG13 VAL 8 HG13 VAL 8 -11.324 -1.386 -6.167 84 HG21 VAL 8 HG21 VAL 8 -12.475 -4.015 -9.327 85 HG22 VAL 8 HG22 VAL 8 -13.661 -3.122 -8.360 86 HG23 VAL 8 HG23 VAL 8 -12.625 -2.250 -9.529 87 H GLY 9 H GLY 9 -8.807 -4.676 -7.336 88 HA2 GLY 9 HA2 GLY 9 -8.606 -6.900 -8.118 89 HA3 GLY 9 HA3 GLY 9 -9.241 -6.407 -9.699 90 H GLU 10 H GLU 10 -6.993 -4.069 -8.887 91 HA GLU 10 HA GLU 10 -4.853 -5.471 -10.423 92 HB2 GLU 10 HB2 GLU 10 -5.375 -2.518 -9.990 93 HB3 GLU 10 HB3 GLU 10 -4.091 -3.218 -10.996 94 HG2 GLU 10 HG2 GLU 10 -5.790 -4.254 -12.453 95 HG3 GLU 10 HG3 GLU 10 -7.085 -3.590 -11.444 96 H SER 11 H SER 11 -2.596 -4.196 -9.823 97 HA SER 11 HA SER 11 -2.321 -4.263 -6.870 98 HB2 SER 11 HB2 SER 11 -0.819 -6.072 -8.805 99 HB3 SER 11 HB3 SER 11 -0.481 -5.923 -7.069 100 HG SER 11 HG SER 11 -1.848 -7.693 -7.567 101 H ILE 12 H ILE 12 -0.076 -3.861 -6.180 102 HA ILE 12 HA ILE 12 1.597 -2.180 -7.941 103 HB ILE 12 HB ILE 12 0.598 -1.312 -5.186 104 HG12 ILE 12 HG12 ILE 12 -0.168 -0.204 -7.920 105 HG13 ILE 12 HG13 ILE 12 -1.207 -1.225 -6.907 106 HG21 ILE 12 HG21 ILE 12 1.675 0.854 -5.742 107 HG22 ILE 12 HG22 ILE 12 2.857 -0.441 -5.728 108 HG23 ILE 12 HG23 ILE 12 2.243 0.181 -7.280 109 HD11 ILE 12 HD11 ILE 12 -1.859 1.075 -6.610 110 HD12 ILE 12 HD12 ILE 12 -1.133 0.472 -5.105 111 HD13 ILE 12 HD13 ILE 12 -0.209 1.553 -6.180 112 H ASN 13 H ASN 13 3.812 -1.821 -6.681 113 HA ASN 13 HA ASN 13 4.308 -4.077 -4.805 114 HB2 ASN 13 HB2 ASN 13 5.771 -3.564 -7.423 115 HB3 ASN 13 HB3 ASN 13 6.329 -4.661 -6.156 116 HD21 ASN 13 HD22 ASN 13 5.397 -6.688 -5.905 117 HD22 ASN 13 HD21 ASN 13 4.194 -7.316 -7.012 118 H ILE 14 H ILE 14 6.225 -3.934 -3.602 119 HA ILE 14 HA ILE 14 7.736 -1.396 -3.710 120 HB ILE 14 HB ILE 14 6.536 -2.538 -1.152 121 HG12 ILE 14 HG12 ILE 14 5.794 -0.034 -2.726 122 HG13 ILE 14 HG13 ILE 14 4.800 -1.494 -2.545 123 HG21 ILE 14 HG21 ILE 14 8.116 0.021 -1.652 124 HG22 ILE 14 HG22 ILE 14 7.445 -0.517 -0.094 125 HG23 ILE 14 HG23 ILE 14 8.746 -1.434 -0.847 126 HD11 ILE 14 HD11 ILE 14 4.747 -1.122 -0.072 127 HD12 ILE 14 HD12 ILE 14 5.582 0.431 -0.328 128 HD13 ILE 14 HD13 ILE 14 3.973 0.164 -1.021 129 H GLY 15 H GLY 15 9.876 -1.603 -2.884 130 HA2 GLY 15 HA2 GLY 15 11.875 -2.724 -2.667 131 HA3 GLY 15 HA3 GLY 15 10.998 -3.765 -1.536 132 H ASP 16 H ASP 16 11.811 -5.752 -2.121 133 HA ASP 16 HA ASP 16 11.100 -6.719 -4.846 134 HB2 ASP 16 HB2 ASP 16 13.619 -7.335 -3.261 135 HB3 ASP 16 HB3 ASP 16 13.138 -8.122 -4.776 136 H ASP 17 H ASP 17 10.117 -6.796 -1.809 137 HA ASP 17 HA ASP 17 9.393 -9.660 -1.901 138 HB2 ASP 17 HB2 ASP 17 10.517 -8.290 0.574 139 HB3 ASP 17 HB3 ASP 17 9.913 -9.943 0.470 140 H ILE 18 H ILE 18 8.152 -6.660 -2.048 141 HA ILE 18 HA ILE 18 5.855 -7.427 -0.308 142 HB ILE 18 HB ILE 18 6.933 -4.609 -0.682 143 HG12 ILE 18 HG12 ILE 18 7.095 -4.973 1.962 144 HG13 ILE 18 HG13 ILE 18 7.350 -6.656 1.494 145 HG21 ILE 18 HG21 ILE 18 4.651 -5.748 0.983 146 HG22 ILE 18 HG22 ILE 18 5.260 -4.077 1.091 147 HG23 ILE 18 HG23 ILE 18 4.514 -4.649 -0.405 148 HD11 ILE 18 HD11 ILE 18 9.260 -5.944 0.046 149 HD12 ILE 18 HD12 ILE 18 8.923 -4.248 0.463 150 HD13 ILE 18 HD13 ILE 18 9.487 -5.388 1.714 151 H THR 19 H THR 19 3.849 -6.992 -1.071 152 HA THR 19 HA THR 19 3.532 -5.676 -3.708 153 HB THR 19 HB THR 19 2.420 -8.418 -2.972 154 HG1 THR 19 HG1 THR 19 3.825 -9.126 -4.588 155 HG21 THR 19 HG21 THR 19 2.203 -6.759 -5.518 156 HG22 THR 19 HG22 THR 19 1.739 -8.468 -5.376 157 HG23 THR 19 HG23 THR 19 0.874 -7.237 -4.438 158 H ILE 20 H ILE 20 1.327 -4.993 -4.059 159 HA ILE 20 HA ILE 20 -0.409 -4.852 -1.638 160 HB ILE 20 HB ILE 20 0.383 -2.580 -3.505 161 HG12 ILE 20 HG12 ILE 20 2.166 -3.130 -1.865 162 HG13 ILE 20 HG13 ILE 20 1.477 -1.518 -1.646 163 HG21 ILE 20 HG21 ILE 20 -1.529 -2.627 -1.138 164 HG22 ILE 20 HG22 ILE 20 -0.933 -1.149 -1.931 165 HG23 ILE 20 HG23 ILE 20 -1.922 -2.309 -2.839 166 HD11 ILE 20 HD11 ILE 20 0.707 -3.962 0.004 167 HD12 ILE 20 HD12 ILE 20 1.849 -2.687 0.506 168 HD13 ILE 20 HD13 ILE 20 0.143 -2.291 0.252 169 H THR 21 H THR 21 -2.650 -4.700 -2.173 170 HA THR 21 HA THR 21 -3.367 -4.844 -5.050 171 HB THR 21 HB THR 21 -4.285 -6.910 -3.004 172 HG1 THR 21 HG1 THR 21 -2.369 -7.144 -5.074 173 HG21 THR 21 HG21 THR 21 -5.831 -6.506 -4.919 174 HG22 THR 21 HG22 THR 21 -4.491 -6.827 -6.047 175 HG23 THR 21 HG23 THR 21 -5.098 -8.118 -4.989 176 H ILE 22 H ILE 22 -5.473 -4.180 -5.469 177 HA ILE 22 HA ILE 22 -6.937 -2.940 -3.184 178 HB ILE 22 HB ILE 22 -6.246 -1.261 -4.655 179 HG12 ILE 22 HG12 ILE 22 -8.230 -0.310 -5.596 180 HG13 ILE 22 HG13 ILE 22 -9.038 -1.890 -5.663 181 HG21 ILE 22 HG21 ILE 22 -6.623 -1.290 -7.099 182 HG22 ILE 22 HG22 ILE 22 -5.503 -2.551 -6.563 183 HG23 ILE 22 HG23 ILE 22 -7.176 -2.980 -6.986 184 HD11 ILE 22 HD11 ILE 22 -8.183 -0.518 -3.097 185 HD12 ILE 22 HD12 ILE 22 -9.830 -0.524 -3.780 186 HD13 ILE 22 HD13 ILE 22 -9.089 -2.054 -3.263 187 H LEU 23 H LEU 23 -8.143 -4.685 -2.475 188 HA LEU 23 HA LEU 23 -9.169 -6.649 -4.263 189 HB2 LEU 23 HB2 LEU 23 -10.243 -6.091 -1.481 190 HB3 LEU 23 HB3 LEU 23 -10.258 -7.603 -2.386 191 HG LEU 23 HG LEU 23 -7.880 -6.212 -1.108 192 HD11 LEU 23 HD11 LEU 23 -7.744 -8.326 0.150 193 HD12 LEU 23 HD12 LEU 23 -9.360 -7.598 0.341 194 HD13 LEU 23 HD13 LEU 23 -9.124 -8.976 -0.758 195 HD21 LEU 23 HD21 LEU 23 -7.853 -8.694 -2.872 196 HD22 LEU 23 HD22 LEU 23 -7.107 -7.128 -3.262 197 HD23 LEU 23 HD23 LEU 23 -6.494 -8.082 -1.899 198 H GLY 24 H GLY 24 -10.523 -3.567 -3.133 199 HA2 GLY 24 HA2 GLY 24 -12.249 -3.195 -5.198 200 HA3 GLY 24 HA3 GLY 24 -13.217 -4.209 -4.151 201 H VAL 25 H VAL 25 -14.546 -2.095 -4.354 202 HA VAL 25 HA VAL 25 -13.908 -0.404 -1.997 203 HB VAL 25 HB VAL 25 -14.457 1.618 -3.133 204 HG11 VAL 25 HG11 VAL 25 -12.618 0.057 -4.989 205 HG12 VAL 25 HG12 VAL 25 -12.691 1.819 -4.787 206 HG13 VAL 25 HG13 VAL 25 -12.128 0.795 -3.445 207 HG21 VAL 25 HG21 VAL 25 -15.023 1.704 -5.538 208 HG22 VAL 25 HG22 VAL 25 -15.115 -0.075 -5.566 209 HG23 VAL 25 HG23 VAL 25 -16.253 0.880 -4.573 210 H SER 26 H SER 26 -15.771 0.772 -1.178 211 HA SER 26 HA SER 26 -18.450 -0.038 -2.091 212 HB2 SER 26 HB2 SER 26 -17.385 -0.637 0.701 213 HB3 SER 26 HB3 SER 26 -19.104 -0.675 0.249 214 HG SER 26 HG SER 26 -17.060 -2.249 -0.931 215 H GLY 27 H GLY 27 -18.685 2.190 -2.637 216 HA2 GLY 27 HA2 GLY 27 -19.430 4.332 -2.136 217 HA3 GLY 27 HA3 GLY 27 -19.414 3.903 -0.413 218 H GLN 28 H GLN 28 -17.716 4.625 0.860 219 HA GLN 28 HA GLN 28 -15.438 5.942 -0.557 220 HB2 GLN 28 HB2 GLN 28 -16.335 6.182 2.347 221 HB3 GLN 28 HB3 GLN 28 -14.985 7.034 1.592 222 HG2 GLN 28 HG2 GLN 28 -17.938 7.404 1.137 223 HG3 GLN 28 HG3 GLN 28 -16.726 8.578 1.691 224 HE21 GLN 28 HE22 GLN 28 -14.721 8.548 -0.117 225 HE22 GLN 28 HE21 GLN 28 -15.294 8.829 -1.749 226 H GLN 29 H GLN 29 -16.393 3.172 1.291 227 HA GLN 29 HA GLN 29 -13.852 2.671 2.530 228 HB2 GLN 29 HB2 GLN 29 -16.161 0.812 1.792 229 HB3 GLN 29 HB3 GLN 29 -14.755 0.333 2.733 230 HG2 GLN 29 HG2 GLN 29 -16.567 2.649 3.539 231 HG3 GLN 29 HG3 GLN 29 -16.814 0.990 4.084 232 HE21 GLN 29 HE22 GLN 29 -15.982 3.621 5.460 233 HE22 GLN 29 HE21 GLN 29 -14.575 3.155 6.400 234 H VAL 30 H VAL 30 -12.233 1.265 1.878 235 HA VAL 30 HA VAL 30 -12.139 0.385 -0.947 236 HB VAL 30 HB VAL 30 -10.110 2.189 0.453 237 HG11 VAL 30 HG11 VAL 30 -10.067 1.081 -2.380 238 HG12 VAL 30 HG12 VAL 30 -8.867 2.162 -1.636 239 HG13 VAL 30 HG13 VAL 30 -9.040 0.493 -1.047 240 HG21 VAL 30 HG21 VAL 30 -11.923 2.651 -1.949 241 HG22 VAL 30 HG22 VAL 30 -12.029 3.455 -0.368 242 HG23 VAL 30 HG23 VAL 30 -10.629 3.758 -1.410 243 H ARG 31 H ARG 31 -11.868 -1.740 -0.636 244 HA ARG 31 HA ARG 31 -10.502 -2.745 1.759 245 HB2 ARG 31 HB2 ARG 31 -12.618 -3.738 0.824 246 HB3 ARG 31 HB3 ARG 31 -11.700 -4.259 -0.600 247 HG2 ARG 31 HG2 ARG 31 -10.218 -5.613 0.827 248 HG3 ARG 31 HG3 ARG 31 -11.031 -5.011 2.286 249 HD2 ARG 31 HD2 ARG 31 -12.417 -6.568 0.071 250 HD3 ARG 31 HD3 ARG 31 -11.815 -7.290 1.569 251 HE ARG 31 HE ARG 31 -14.186 -5.587 1.227 252 HH11 ARG 31 HH11 ARG 31 -11.898 -7.024 3.495 253 HH12 ARG 31 HH12 ARG 31 -12.942 -6.797 4.882 254 HH21 ARG 31 HH21 ARG 31 -15.546 -5.332 3.039 255 HH22 ARG 31 HH22 ARG 31 -15.015 -5.842 4.620 256 H ILE 32 H ILE 32 -8.412 -3.300 1.813 257 HA ILE 32 HA ILE 32 -6.926 -3.413 -0.772 258 HB ILE 32 HB ILE 32 -5.825 -2.111 1.732 259 HG12 ILE 32 HG12 ILE 32 -7.577 -0.828 -0.389 260 HG13 ILE 32 HG13 ILE 32 -7.813 -0.856 1.362 261 HG21 ILE 32 HG21 ILE 32 -5.210 -1.765 -1.230 262 HG22 ILE 32 HG22 ILE 32 -4.335 -1.008 0.122 263 HG23 ILE 32 HG23 ILE 32 -4.265 -2.756 -0.094 264 HD11 ILE 32 HD11 ILE 32 -5.644 0.660 -0.134 265 HD12 ILE 32 HD12 ILE 32 -7.038 1.339 0.714 266 HD13 ILE 32 HD13 ILE 32 -5.760 0.525 1.645 267 H GLY 33 H GLY 33 -4.945 -4.625 -0.665 268 HA2 GLY 33 HA2 GLY 33 -4.704 -6.431 1.700 269 HA3 GLY 33 HA3 GLY 33 -4.608 -7.047 0.039 270 H ILE 34 H ILE 34 -2.580 -7.268 2.035 271 HA ILE 34 HA ILE 34 -0.349 -5.783 0.745 272 HB ILE 34 HB ILE 34 -0.780 -6.039 3.755 273 HG12 ILE 34 HG12 ILE 34 -0.936 -3.502 2.076 274 HG13 ILE 34 HG13 ILE 34 -2.346 -4.401 2.667 275 HG21 ILE 34 HG21 ILE 34 1.354 -4.592 2.117 276 HG22 ILE 34 HG22 ILE 34 1.223 -4.559 3.885 277 HG23 ILE 34 HG23 ILE 34 1.592 -6.080 3.058 278 HD11 ILE 34 HD11 ILE 34 -1.528 -4.159 4.989 279 HD12 ILE 34 HD12 ILE 34 -0.217 -3.106 4.402 280 HD13 ILE 34 HD13 ILE 34 -1.914 -2.608 4.209 281 H ASN 35 H ASN 35 1.379 -7.069 0.421 282 HA ASN 35 HA ASN 35 1.304 -9.763 1.695 283 HB2 ASN 35 HB2 ASN 35 0.257 -9.732 -0.566 284 HB3 ASN 35 HB3 ASN 35 1.789 -9.167 -1.235 285 HD21 ASN 35 HD22 ASN 35 0.727 -11.473 -2.233 286 HD22 ASN 35 HD21 ASN 35 1.599 -12.877 -1.647 287 H ALA 36 H ALA 36 2.971 -9.468 3.035 288 HA ALA 36 HA ALA 36 5.664 -9.252 1.823 289 HB1 ALA 36 HB1 ALA 36 4.699 -7.704 4.270 290 HB2 ALA 36 HB2 ALA 36 6.372 -7.789 3.687 291 HB3 ALA 36 HB3 ALA 36 5.124 -6.986 2.698 292 HA PRO 37 HA PRO 37 6.420 -12.684 4.435 293 HB2 PRO 37 HB2 PRO 37 8.992 -12.125 5.357 294 HB3 PRO 37 HB3 PRO 37 8.607 -12.829 3.749 295 HG2 PRO 37 HG2 PRO 37 9.200 -9.943 4.459 296 HG3 PRO 37 HG3 PRO 37 9.774 -10.892 3.055 297 HD2 PRO 37 HD2 PRO 37 7.698 -9.162 2.864 298 HD3 PRO 37 HD3 PRO 37 7.688 -10.735 1.994 299 H LYS 38 H LYS 38 6.501 -13.279 6.665 300 HA LYS 38 HA LYS 38 5.487 -11.363 8.532 301 HB2 LYS 38 HB2 LYS 38 6.852 -14.033 9.033 302 HB3 LYS 38 HB3 LYS 38 5.757 -13.191 10.151 303 HG2 LYS 38 HG2 LYS 38 4.894 -14.108 7.362 304 HG3 LYS 38 HG3 LYS 38 4.789 -15.137 8.807 305 HD2 LYS 38 HD2 LYS 38 3.297 -13.455 9.844 306 HD3 LYS 38 HD3 LYS 38 3.399 -12.446 8.387 307 HE2 LYS 38 HE2 LYS 38 1.407 -13.729 8.147 308 HE3 LYS 38 HE3 LYS 38 2.591 -14.410 7.024 309 HZ1 LYS 38 HZ1 LYS 38 1.368 -16.069 8.307 310 HZ2 LYS 38 HZ2 LYS 38 2.992 -16.169 8.580 311 HZ3 LYS 38 HZ3 LYS 38 1.998 -15.478 9.699 312 H ASP 39 H ASP 39 8.457 -11.639 7.205 313 HA ASP 39 HA ASP 39 10.303 -11.142 9.318 314 HB2 ASP 39 HB2 ASP 39 10.609 -11.992 6.870 315 HB3 ASP 39 HB3 ASP 39 10.548 -10.299 6.411 316 H VAL 40 H VAL 40 7.906 -9.104 7.874 317 HA VAL 40 HA VAL 40 9.309 -6.682 8.909 318 HB VAL 40 HB VAL 40 8.514 -5.383 7.025 319 HG11 VAL 40 HG11 VAL 40 9.807 -7.943 6.004 320 HG12 VAL 40 HG12 VAL 40 9.838 -6.357 5.207 321 HG13 VAL 40 HG13 VAL 40 10.673 -6.575 6.756 322 HG21 VAL 40 HG21 VAL 40 6.401 -6.595 6.625 323 HG22 VAL 40 HG22 VAL 40 7.340 -6.352 5.137 324 HG23 VAL 40 HG23 VAL 40 7.317 -7.947 5.910 325 H ALA 41 H ALA 41 7.699 -4.829 9.195 326 HA ALA 41 HA ALA 41 5.327 -5.998 10.531 327 HB1 ALA 41 HB1 ALA 41 6.899 -4.686 11.908 328 HB2 ALA 41 HB2 ALA 41 6.678 -3.282 10.839 329 HB3 ALA 41 HB3 ALA 41 5.316 -3.886 11.808 330 H VAL 42 H VAL 42 3.257 -5.118 10.261 331 HA VAL 42 HA VAL 42 2.813 -2.853 8.476 332 HB VAL 42 HB VAL 42 2.861 -4.327 6.697 333 HG11 VAL 42 HG11 VAL 42 1.603 -6.431 8.490 334 HG12 VAL 42 HG12 VAL 42 1.837 -6.618 6.734 335 HG13 VAL 42 HG13 VAL 42 3.243 -6.409 7.791 336 HG21 VAL 42 HG21 VAL 42 0.571 -4.783 5.996 337 HG22 VAL 42 HG22 VAL 42 -0.019 -4.574 7.648 338 HG23 VAL 42 HG23 VAL 42 0.669 -3.181 6.772 339 H HIS 43 H HIS 43 1.149 -1.714 9.239 340 HA HIS 43 HA HIS 43 -1.109 -3.018 10.590 341 HB2 HIS 43 HB2 HIS 43 0.373 -0.845 12.100 342 HB3 HIS 43 HB3 HIS 43 -0.858 -1.960 12.675 343 HD2 HIS 43 HD2 HIS 43 2.915 -1.757 11.902 344 HE1 HIS 43 HE1 HIS 43 2.308 -5.317 14.148 345 HE2 HIS 43 HE2 HIS 43 4.054 -3.765 13.149 346 H ARG 44 H ARG 44 -2.724 -1.205 11.331 347 HA ARG 44 HA ARG 44 -3.021 0.747 9.188 348 HB2 ARG 44 HB2 ARG 44 -4.480 0.350 11.838 349 HB3 ARG 44 HB3 ARG 44 -4.981 1.467 10.553 350 HG2 ARG 44 HG2 ARG 44 -5.176 -0.450 8.976 351 HG3 ARG 44 HG3 ARG 44 -4.759 -1.568 10.290 352 HD2 ARG 44 HD2 ARG 44 -7.154 0.304 10.228 353 HD3 ARG 44 HD3 ARG 44 -7.200 -1.437 9.947 354 HE ARG 44 HE ARG 44 -6.525 -1.808 12.269 355 HH11 ARG 44 HH11 ARG 44 -7.625 1.479 11.490 356 HH12 ARG 44 HH12 ARG 44 -7.942 1.852 13.177 357 HH21 ARG 44 HH21 ARG 44 -7.047 -1.275 14.394 358 HH22 ARG 44 HH22 ARG 44 -7.638 0.337 14.775 359 H GLU 45 H GLU 45 -3.218 3.130 9.713 360 HA GLU 45 HA GLU 45 -0.817 4.009 10.927 361 HB2 GLU 45 HB2 GLU 45 -2.284 5.127 9.165 362 HB3 GLU 45 HB3 GLU 45 -3.340 5.662 10.475 363 HG2 GLU 45 HG2 GLU 45 -0.357 6.286 10.284 364 HG3 GLU 45 HG3 GLU 45 -1.625 7.336 9.642 365 H GLU 46 H GLU 46 -3.931 3.209 12.287 366 HA GLU 46 HA GLU 46 -3.726 4.791 14.678 367 HB2 GLU 46 HB2 GLU 46 -5.834 3.925 13.730 368 HB3 GLU 46 HB3 GLU 46 -5.283 2.260 14.030 369 HG2 GLU 46 HG2 GLU 46 -5.287 2.678 16.452 370 HG3 GLU 46 HG3 GLU 46 -5.605 4.398 16.184 371 H ILE 47 H ILE 47 -2.623 1.529 13.730 372 HA ILE 47 HA ILE 47 -1.903 0.864 16.529 373 HB ILE 47 HB ILE 47 -2.023 -0.624 13.893 374 HG12 ILE 47 HG12 ILE 47 -3.415 -2.175 15.158 375 HG13 ILE 47 HG13 ILE 47 -3.057 -1.313 16.665 376 HG21 ILE 47 HG21 ILE 47 -0.685 -1.588 16.462 377 HG22 ILE 47 HG22 ILE 47 -1.083 -2.607 15.067 378 HG23 ILE 47 HG23 ILE 47 0.122 -1.319 14.900 379 HD11 ILE 47 HD11 ILE 47 -4.567 -0.096 14.320 380 HD12 ILE 47 HD12 ILE 47 -5.326 -0.828 15.756 381 HD13 ILE 47 HD13 ILE 47 -4.324 0.619 15.942 382 H TYR 48 H TYR 48 -0.434 1.898 13.475 383 HA TYR 48 HA TYR 48 2.198 1.044 13.874 384 HB2 TYR 48 HB2 TYR 48 1.307 2.040 11.801 385 HB3 TYR 48 HB3 TYR 48 1.157 3.603 12.614 386 HD1 TYR 48 HD2 TYR 48 3.673 1.038 11.563 387 HD2 TYR 48 HD1 TYR 48 2.937 5.102 12.762 388 HE1 TYR 48 HE2 TYR 48 5.991 1.630 10.945 389 HE2 TYR 48 HE1 TYR 48 5.247 5.720 12.132 390 HH TYR 48 HH TYR 48 7.265 4.969 11.281 391 H GLN 49 H GLN 49 0.448 3.675 15.412 392 HA GLN 49 HA GLN 49 2.647 5.258 16.251 393 HB2 GLN 49 HB2 GLN 49 -0.180 4.891 17.294 394 HB3 GLN 49 HB3 GLN 49 0.929 6.143 17.897 395 HG2 GLN 49 HG2 GLN 49 1.110 7.168 15.720 396 HG3 GLN 49 HG3 GLN 49 0.321 5.806 14.934 397 HE21 GLN 49 HE22 GLN 49 -1.173 7.348 13.996 398 HE22 GLN 49 HE21 GLN 49 -2.522 7.952 14.915 399 H ARG 50 H ARG 50 1.666 2.128 17.360 400 HA ARG 50 HA ARG 50 2.977 2.441 19.987 401 HB2 ARG 50 HB2 ARG 50 1.736 0.126 18.450 402 HB3 ARG 50 HB3 ARG 50 2.688 -0.123 19.911 403 HG2 ARG 50 HG2 ARG 50 0.406 -0.084 20.578 404 HG3 ARG 50 HG3 ARG 50 1.185 1.382 21.179 405 HD2 ARG 50 HD2 ARG 50 0.160 2.660 19.288 406 HD3 ARG 50 HD3 ARG 50 -0.626 1.163 18.745 407 HE ARG 50 HE ARG 50 -1.279 1.495 21.466 408 HH11 ARG 50 HH11 ARG 50 -1.913 3.195 18.418 409 HH12 ARG 50 HH12 ARG 50 -3.390 3.908 19.007 410 HH21 ARG 50 HH21 ARG 50 -3.205 2.425 22.180 411 HH22 ARG 50 HH22 ARG 50 -4.125 3.469 21.121 412 H ILE 51 H ILE 51 3.689 1.164 16.744 413 HA ILE 51 HA ILE 51 5.801 -0.588 17.474 414 HB ILE 51 HB ILE 51 4.760 0.698 14.971 415 HG12 ILE 51 HG12 ILE 51 4.221 -1.588 14.356 416 HG13 ILE 51 HG13 ILE 51 5.139 -2.231 15.732 417 HG21 ILE 51 HG21 ILE 51 7.245 -1.034 15.157 418 HG22 ILE 51 HG22 ILE 51 6.350 -0.733 13.651 419 HG23 ILE 51 HG23 ILE 51 7.125 0.617 14.497 420 HD11 ILE 51 HD11 ILE 51 2.648 -0.508 15.957 421 HD12 ILE 51 HD12 ILE 51 2.659 -2.282 16.053 422 HD13 ILE 51 HD13 ILE 51 3.496 -1.341 17.297 423 H GLN 52 H GLN 52 6.125 2.551 15.700 424 HA GLN 52 HA GLN 52 8.963 2.475 15.931 425 HB2 GLN 52 HB2 GLN 52 8.683 4.975 15.214 426 HB3 GLN 52 HB3 GLN 52 8.211 3.698 14.093 427 HG2 GLN 52 HG2 GLN 52 6.562 5.640 14.319 428 HG3 GLN 52 HG3 GLN 52 5.905 4.012 14.479 429 HE21 GLN 52 HE22 GLN 52 4.794 3.449 16.262 430 HE22 GLN 52 HE21 GLN 52 4.709 4.374 17.731 431 H ALA 53 H ALA 53 6.796 3.012 18.411 432 HA ALA 53 HA ALA 53 8.165 5.120 19.787 433 HB1 ALA 53 HB1 ALA 53 6.499 2.837 20.915 434 HB2 ALA 53 HB2 ALA 53 6.838 4.393 21.701 435 HB3 ALA 53 HB3 ALA 53 5.821 4.341 20.243 436 H GLY 54 H GLY 54 8.973 1.832 19.111 437 HA2 GLY 54 HA2 GLY 54 11.463 1.562 19.563 438 HA3 GLY 54 HA3 GLY 54 11.038 1.810 21.271 439 H LEU 55 H LEU 55 8.868 -0.018 19.106 440 HA LEU 55 HA LEU 55 9.739 -2.578 20.253 441 HB2 LEU 55 HB2 LEU 55 7.569 -2.876 21.463 442 HB3 LEU 55 HB3 LEU 55 8.578 -1.579 22.111 443 HG LEU 55 HG LEU 55 7.171 0.030 20.621 444 HD11 LEU 55 HD11 LEU 55 5.389 -2.438 20.703 445 HD12 LEU 55 HD12 LEU 55 4.812 -0.792 20.338 446 HD13 LEU 55 HD13 LEU 55 5.960 -1.573 19.246 447 HD21 LEU 55 HD21 LEU 55 7.095 -0.075 23.069 448 HD22 LEU 55 HD22 LEU 55 5.464 0.160 22.401 449 HD23 LEU 55 HD23 LEU 55 5.959 -1.445 22.992 450 H THR 56 H THR 56 7.940 -4.281 19.811 451 HA THR 56 HA THR 56 6.368 -3.728 17.369 452 HB THR 56 HB THR 56 7.166 -5.876 16.352 453 HG1 THR 56 HG1 THR 56 9.123 -6.711 17.169 454 HG21 THR 56 HG21 THR 56 9.387 -3.854 16.803 455 HG22 THR 56 HG22 THR 56 9.228 -4.996 15.443 456 HG23 THR 56 HG23 THR 56 8.062 -3.672 15.628 457 H ALA 57 H ALA 57 6.440 -4.755 20.470 458 HA ALA 57 HA ALA 57 3.993 -6.338 20.204 459 HB1 ALA 57 HB1 ALA 57 6.528 -7.504 21.433 460 HB2 ALA 57 HB2 ALA 57 4.906 -8.231 21.506 461 HB3 ALA 57 HB3 ALA 57 5.731 -8.058 19.943 462 HA PRO 58 HA PRO 58 4.142 -3.112 23.569 463 HB2 PRO 58 HB2 PRO 58 1.230 -3.757 23.043 464 HB3 PRO 58 HB3 PRO 58 1.946 -2.188 23.514 465 HG2 PRO 58 HG2 PRO 58 1.360 -2.641 20.921 466 HG3 PRO 58 HG3 PRO 58 2.977 -1.966 21.330 467 HD2 PRO 58 HD2 PRO 58 2.239 -4.829 20.697 468 HD3 PRO 58 HD3 PRO 58 3.649 -3.871 20.130 469 H ASP 59 H ASP 59 2.270 -6.162 23.362 470 HA ASP 59 HA ASP 59 2.902 -6.898 26.082 471 HB2 ASP 59 HB2 ASP 59 1.200 -5.153 26.475 472 HB3 ASP 59 HB3 ASP 59 0.092 -5.956 25.367 473 H5' U 36 H5' U 36 -7.259 7.066 -18.009 474 H5'' U 36 H5'' U 36 -8.326 7.890 -16.860 475 H4' U 36 H4' U 36 -5.394 8.619 -17.337 476 H3' U 36 H3' U 36 -6.497 6.413 -15.849 477 H2' U 36 H2' U 36 -6.582 7.139 -13.661 478 HO2' U 36 HO2' U 36 -4.245 7.513 -13.747 479 H1' U 36 H1' U 36 -6.664 9.857 -13.845 480 H3 U 36 H3 U 36 -11.150 10.625 -14.469 481 H5 U 36 H5 U 36 -10.702 6.453 -14.346 482 H6 U 36 H6 U 36 -8.323 6.741 -14.483 483 HO5' U 36 HO5' U 36 -7.887 9.832 -18.018 484 H5' C 37 H5' C 37 -3.417 8.076 -18.514 485 H5'' C 37 H5'' C 37 -3.527 6.651 -19.541 486 H4' C 37 H4' C 37 -1.529 7.060 -20.440 487 H3' C 37 H3' C 37 -0.477 6.055 -18.221 488 H2' C 37 H2' C 37 -0.933 7.858 -16.739 489 HO2' C 37 HO2' C 37 1.378 7.570 -16.716 490 H1' C 37 H1' C 37 0.043 9.972 -18.587 491 H41 C 37 H41 C 37 -4.300 13.572 -15.698 492 H42 C 37 H42 C 37 -5.028 12.177 -14.921 493 H5 C 37 H5 C 37 -4.262 9.877 -15.338 494 H6 C 37 H6 C 37 -2.691 8.537 -16.544 495 H5' A 38 H5' A 38 3.173 8.104 -18.203 496 H5'' A 38 H5'' A 38 4.448 6.997 -18.724 497 H4' A 38 H4' A 38 4.890 8.031 -16.505 498 H3' A 38 H3' A 38 5.492 5.467 -17.163 499 H2' A 38 H2' A 38 3.327 4.572 -16.626 500 HO2' A 38 HO2' A 38 4.959 4.304 -14.316 501 H1' A 38 H1' A 38 3.390 6.043 -14.001 502 H8 A 38 H8 A 38 1.305 4.374 -16.744 503 H61 A 38 H61 A 38 -3.456 5.127 -12.823 504 H62 A 38 H62 A 38 -2.966 4.485 -14.377 505 H2 A 38 H2 A 38 0.035 7.393 -11.232 506 H5' G 39 H5' G 39 5.396 8.903 -14.640 507 H5'' G 39 H5'' G 39 6.852 9.814 -15.090 508 H4' G 39 H4' G 39 6.005 10.957 -13.230 509 H3' G 39 H3' G 39 8.500 10.008 -12.921 510 H2' G 39 H2' G 39 7.952 7.859 -12.092 511 HO2' G 39 HO2' G 39 8.164 9.567 -9.843 512 H1' G 39 H1' G 39 5.821 8.787 -10.225 513 H8 G 39 H8 G 39 3.612 7.362 -12.219 514 H1 G 39 H1 G 39 7.573 2.521 -10.803 515 H21 G 39 H21 G 39 9.476 3.290 -10.060 516 H22 G 39 H22 G 39 9.798 5.004 -9.887 517 H5' G 40 H5' G 40 7.184 11.349 -8.494 518 H5'' G 40 H5'' G 40 8.375 12.569 -8.042 519 H4' G 40 H4' G 40 7.796 10.984 -6.208 520 H3' G 40 H3' G 40 10.382 11.942 -6.777 521 H2' G 40 H2' G 40 10.860 9.824 -7.931 522 HO2' G 40 HO2' G 40 12.511 10.319 -6.411 523 H1' G 40 H1' G 40 9.425 8.757 -5.463 524 H8 G 40 H8 G 40 10.048 7.550 -9.134 525 H1 G 40 H1 G 40 11.548 3.425 -4.455 526 H21 G 40 H21 G 40 11.169 4.372 -2.466 527 H22 G 40 H22 G 40 10.482 5.973 -2.329 528 H5' A 41 H5' A 41 7.681 13.419 -3.292 529 H5'' A 41 H5'' A 41 7.395 12.369 -4.687 530 H4' A 41 H4' A 41 7.548 15.389 -4.941 531 H3' A 41 H3' A 41 5.279 13.661 -3.989 532 H2' A 41 H2' A 41 3.748 14.614 -5.477 533 HO2' A 41 HO2' A 41 4.289 16.806 -4.975 534 H1' A 41 H1' A 41 5.440 15.139 -7.614 535 H8 A 41 H8 A 41 4.536 12.041 -5.438 536 H61 A 41 H61 A 41 2.857 9.555 -10.894 537 H62 A 41 H62 A 41 2.863 9.288 -9.164 538 H2 A 41 H2 A 41 4.624 13.526 -11.671 539 H5' C 42 H5' C 42 1.770 15.108 -1.351 540 H5'' C 42 H5'' C 42 2.764 13.713 -1.797 541 H4' C 42 H4' C 42 1.834 13.892 -4.126 542 H3' C 42 H3' C 42 0.697 16.249 -3.599 543 H2' C 42 H2' C 42 -0.558 15.689 -1.650 544 HO2' C 42 HO2' C 42 -2.133 14.812 -3.855 545 H1' C 42 H1' C 42 -1.505 13.074 -2.530 546 H41 C 42 H41 C 42 -1.488 12.990 3.877 547 H42 C 42 H42 C 42 0.188 12.477 3.842 548 H5 C 42 H5 C 42 1.491 12.374 1.763 549 H6 C 42 H6 C 42 1.425 12.785 -0.618 550 H5' A 43 H5' A 43 -2.454 15.441 -5.463 551 H5'' A 43 H5'' A 43 -2.573 15.788 -7.170 552 H4' A 43 H4' A 43 -4.399 16.862 -5.868 553 H3' A 43 H3' A 43 -3.107 18.335 -7.701 554 H2' A 43 H2' A 43 -1.373 19.041 -6.316 555 HO2' A 43 HO2' A 43 -3.343 21.040 -5.852 556 H1' A 43 H1' A 43 -3.189 19.710 -4.024 557 H8 A 43 H8 A 43 -1.744 17.382 -2.292 558 H61 A 43 H61 A 43 3.858 20.041 -2.029 559 H62 A 43 H62 A 43 2.804 18.842 -1.306 560 H2 A 43 H2 A 43 1.632 21.880 -5.393 561 H5' U 44 H5' U 44 -6.882 19.511 -2.920 562 H5'' U 44 H5'' U 44 -5.177 19.827 -2.591 563 H4' U 44 H4' U 44 -6.052 18.287 -0.918 564 H3' U 44 H3' U 44 -4.055 17.132 -2.809 565 HO3' U 44 HO3' U 44 -4.073 17.651 -0.003 566 H2' U 44 H2' U 44 -4.279 15.008 -1.835 567 HO2' U 44 HO2' U 44 -4.254 15.503 0.345 568 H1' U 44 H1' U 44 -6.937 15.035 -1.427 569 H3 U 44 H3 U 44 -8.441 13.551 -5.438 570 H5 U 44 H5 U 44 -4.433 14.593 -6.140 571 H6 U 44 H6 U 44 -4.328 15.542 -3.942 572 H1 MET 1 H1 MET 1 1.087 -12.664 3.981 573 H2 MET 1 H2 MET 1 0.075 -12.925 5.256 574 H3 MET 1 H3 MET 1 0.991 -11.559 5.199 575 HA MET 1 HA MET 1 -0.182 -10.779 3.269 576 HB2 MET 1 HB2 MET 1 -0.763 -13.072 2.425 577 HB3 MET 1 HB3 MET 1 -1.908 -13.235 3.775 578 HG2 MET 1 HG2 MET 1 -3.046 -12.615 1.700 579 HG3 MET 1 HG3 MET 1 -3.239 -11.387 2.946 580 HE1 MET 1 HE1 MET 1 -4.254 -9.892 1.170 581 HE2 MET 1 HE2 MET 1 -3.465 -9.416 -0.358 582 HE3 MET 1 HE3 MET 1 -3.968 -11.106 -0.096 583 H LEU 2 H LEU 2 -1.728 -9.199 3.703 584 HA LEU 2 HA LEU 2 -3.512 -9.628 6.025 585 HB2 LEU 2 HB2 LEU 2 -1.272 -7.722 5.773 586 HB3 LEU 2 HB3 LEU 2 -2.810 -6.934 6.164 587 HG LEU 2 HG LEU 2 -1.521 -9.186 7.720 588 HD11 LEU 2 HD11 LEU 2 -1.877 -6.222 8.337 589 HD12 LEU 2 HD12 LEU 2 -1.164 -7.439 9.424 590 HD13 LEU 2 HD13 LEU 2 -0.356 -7.026 7.889 591 HD21 LEU 2 HD21 LEU 2 -3.265 -8.609 9.428 592 HD22 LEU 2 HD22 LEU 2 -4.041 -7.524 8.248 593 HD23 LEU 2 HD23 LEU 2 -3.978 -9.280 7.957 594 H ILE 3 H ILE 3 -5.399 -8.286 5.945 595 HA ILE 3 HA ILE 3 -5.863 -6.776 3.434 596 HB ILE 3 HB ILE 3 -7.739 -8.884 4.590 597 HG12 ILE 3 HG12 ILE 3 -7.554 -9.553 2.016 598 HG13 ILE 3 HG13 ILE 3 -5.981 -8.760 2.138 599 HG21 ILE 3 HG21 ILE 3 -8.096 -6.964 2.247 600 HG22 ILE 3 HG22 ILE 3 -9.208 -8.275 2.698 601 HG23 ILE 3 HG23 ILE 3 -8.979 -6.901 3.791 602 HD11 ILE 3 HD11 ILE 3 -5.447 -10.289 4.078 603 HD12 ILE 3 HD12 ILE 3 -7.028 -11.086 3.812 604 HD13 ILE 3 HD13 ILE 3 -5.762 -11.161 2.570 605 H LEU 4 H LEU 4 -7.348 -5.069 3.710 606 HA LEU 4 HA LEU 4 -8.317 -4.455 6.448 607 HB2 LEU 4 HB2 LEU 4 -6.471 -2.726 4.753 608 HB3 LEU 4 HB3 LEU 4 -7.312 -2.164 6.194 609 HG LEU 4 HG LEU 4 -5.231 -4.397 6.168 610 HD11 LEU 4 HD11 LEU 4 -3.831 -2.630 7.263 611 HD12 LEU 4 HD12 LEU 4 -4.285 -2.233 5.590 612 HD13 LEU 4 HD13 LEU 4 -5.139 -1.457 6.939 613 HD21 LEU 4 HD21 LEU 4 -6.617 -2.897 8.434 614 HD22 LEU 4 HD22 LEU 4 -6.831 -4.623 8.036 615 HD23 LEU 4 HD23 LEU 4 -5.266 -4.040 8.632 616 H THR 5 H THR 5 -9.792 -2.530 6.408 617 HA THR 5 HA THR 5 -10.658 -1.746 3.687 618 HB THR 5 HB THR 5 -12.842 -2.086 5.697 619 HG1 THR 5 HG1 THR 5 -13.066 -4.237 5.162 620 HG21 THR 5 HG21 THR 5 -12.587 -2.573 2.711 621 HG22 THR 5 HG22 THR 5 -14.094 -2.608 3.652 622 HG23 THR 5 HG23 THR 5 -13.196 -1.078 3.467 623 H ARG 6 H ARG 6 -9.748 0.209 3.808 624 HA ARG 6 HA ARG 6 -10.459 2.035 6.065 625 HB2 ARG 6 HB2 ARG 6 -8.344 2.141 3.864 626 HB3 ARG 6 HB3 ARG 6 -8.621 3.426 5.039 627 HG2 ARG 6 HG2 ARG 6 -8.367 0.966 6.509 628 HG3 ARG 6 HG3 ARG 6 -7.034 1.042 5.339 629 HD2 ARG 6 HD2 ARG 6 -6.385 2.134 7.423 630 HD3 ARG 6 HD3 ARG 6 -6.503 3.345 6.135 631 HE ARG 6 HE ARG 6 -8.924 3.651 7.095 632 HH11 ARG 6 HH11 ARG 6 -5.928 3.156 8.904 633 HH12 ARG 6 HH12 ARG 6 -6.543 3.901 10.365 634 HH21 ARG 6 HH21 ARG 6 -9.709 4.583 9.026 635 HH22 ARG 6 HH22 ARG 6 -8.680 4.712 10.434 636 H LYS 7 H LYS 7 -10.620 4.438 5.164 637 HA LYS 7 HA LYS 7 -12.000 4.356 2.548 638 HB2 LYS 7 HB2 LYS 7 -13.630 6.000 3.213 639 HB3 LYS 7 HB3 LYS 7 -13.790 4.563 4.205 640 HG2 LYS 7 HG2 LYS 7 -12.620 5.729 6.060 641 HG3 LYS 7 HG3 LYS 7 -12.355 7.142 5.006 642 HD2 LYS 7 HD2 LYS 7 -14.896 7.208 4.677 643 HD3 LYS 7 HD3 LYS 7 -15.012 6.011 5.982 644 HE2 LYS 7 HE2 LYS 7 -13.711 7.627 7.439 645 HE3 LYS 7 HE3 LYS 7 -13.828 8.803 6.113 646 HZ1 LYS 7 HZ1 LYS 7 -16.112 7.572 7.514 647 HZ2 LYS 7 HZ2 LYS 7 -15.572 9.111 7.740 648 HZ3 LYS 7 HZ3 LYS 7 -16.219 8.675 6.301 649 H VAL 8 H VAL 8 -12.343 6.767 1.750 650 HA VAL 8 HA VAL 8 -9.721 7.485 1.034 651 HB VAL 8 HB VAL 8 -10.663 9.360 -0.121 652 HG11 VAL 8 HG11 VAL 8 -12.529 6.940 -0.222 653 HG12 VAL 8 HG12 VAL 8 -12.287 8.131 -1.510 654 HG13 VAL 8 HG13 VAL 8 -10.951 7.058 -1.032 655 HG21 VAL 8 HG21 VAL 8 -13.016 9.905 -0.099 656 HG22 VAL 8 HG22 VAL 8 -13.298 8.801 1.282 657 HG23 VAL 8 HG23 VAL 8 -12.278 10.254 1.470 658 H GLY 9 H GLY 9 -8.216 8.731 1.784 659 HA2 GLY 9 HA2 GLY 9 -7.425 10.783 2.711 660 HA3 GLY 9 HA3 GLY 9 -8.887 10.892 3.706 661 H GLU 10 H GLU 10 -8.153 7.735 4.063 662 HA GLU 10 HA GLU 10 -6.737 8.253 6.602 663 HB2 GLU 10 HB2 GLU 10 -8.054 5.742 5.503 664 HB3 GLU 10 HB3 GLU 10 -7.396 5.968 7.145 665 HG2 GLU 10 HG2 GLU 10 -8.968 7.860 7.498 666 HG3 GLU 10 HG3 GLU 10 -9.679 7.559 5.902 667 H SER 11 H SER 11 -5.284 6.106 7.168 668 HA SER 11 HA SER 11 -3.356 5.752 4.938 669 HB2 SER 11 HB2 SER 11 -2.675 6.941 7.652 670 HB3 SER 11 HB3 SER 11 -1.502 6.505 6.386 671 HG SER 11 HG SER 11 -2.062 8.722 6.329 672 H ILE 12 H ILE 12 -1.564 4.338 5.518 673 HA ILE 12 HA ILE 12 -2.041 2.308 7.616 674 HB ILE 12 HB ILE 12 -1.689 1.633 4.663 675 HG12 ILE 12 HG12 ILE 12 -4.202 1.345 6.359 676 HG13 ILE 12 HG13 ILE 12 -3.940 2.607 5.141 677 HG21 ILE 12 HG21 ILE 12 -0.754 -0.086 6.175 678 HG22 ILE 12 HG22 ILE 12 -2.286 -0.135 7.084 679 HG23 ILE 12 HG23 ILE 12 -2.216 -0.685 5.400 680 HD11 ILE 12 HD11 ILE 12 -5.258 0.893 4.131 681 HD12 ILE 12 HD12 ILE 12 -3.644 0.875 3.392 682 HD13 ILE 12 HD13 ILE 12 -4.094 -0.370 4.579 683 H ASN 13 H ASN 13 0.051 0.813 7.647 684 HA ASN 13 HA ASN 13 2.415 2.309 6.653 685 HB2 ASN 13 HB2 ASN 13 1.877 1.583 9.555 686 HB3 ASN 13 HB3 ASN 13 3.448 2.086 8.923 687 HD21 ASN 13 HD22 ASN 13 3.889 4.243 8.550 688 HD22 ASN 13 HD21 ASN 13 2.747 5.522 8.893 689 H ILE 14 H ILE 14 4.384 1.163 6.689 690 HA ILE 14 HA ILE 14 4.303 -1.743 7.216 691 HB ILE 14 HB ILE 14 5.260 -0.551 4.577 692 HG12 ILE 14 HG12 ILE 14 2.751 -2.185 5.188 693 HG13 ILE 14 HG13 ILE 14 2.793 -0.478 4.719 694 HG21 ILE 14 HG21 ILE 14 6.508 -2.563 5.304 695 HG22 ILE 14 HG22 ILE 14 4.975 -3.431 5.521 696 HG23 ILE 14 HG23 ILE 14 5.502 -2.924 3.902 697 HD11 ILE 14 HD11 ILE 14 2.214 -1.782 2.785 698 HD12 ILE 14 HD12 ILE 14 3.859 -1.144 2.548 699 HD13 ILE 14 HD13 ILE 14 3.609 -2.850 3.006 700 H GLY 15 H GLY 15 6.391 -2.602 7.620 701 HA2 GLY 15 HA2 GLY 15 8.522 -2.553 8.495 702 HA3 GLY 15 HA3 GLY 15 8.860 -1.346 7.244 703 H ASP 16 H ASP 16 10.141 0.013 8.433 704 HA ASP 16 HA ASP 16 8.769 1.555 10.579 705 HB2 ASP 16 HB2 ASP 16 11.682 0.687 10.473 706 HB3 ASP 16 HB3 ASP 16 10.987 1.773 11.685 707 H ASP 17 H ASP 17 9.549 1.684 7.497 708 HA ASP 17 HA ASP 17 10.317 4.536 7.587 709 HB2 ASP 17 HB2 ASP 17 11.741 2.464 5.866 710 HB3 ASP 17 HB3 ASP 17 11.992 4.203 5.817 711 H ILE 18 H ILE 18 7.953 2.469 6.697 712 HA ILE 18 HA ILE 18 7.476 3.983 4.177 713 HB ILE 18 HB ILE 18 6.767 1.066 4.654 714 HG12 ILE 18 HG12 ILE 18 8.375 0.989 2.497 715 HG13 ILE 18 HG13 ILE 18 9.118 2.376 3.302 716 HG21 ILE 18 HG21 ILE 18 5.141 2.170 3.224 717 HG22 ILE 18 HG22 ILE 18 6.437 2.917 2.263 718 HG23 ILE 18 HG23 ILE 18 6.180 1.153 2.222 719 HD11 ILE 18 HD11 ILE 18 10.179 0.222 3.941 720 HD12 ILE 18 HD12 ILE 18 9.428 0.994 5.353 721 HD13 ILE 18 HD13 ILE 18 8.607 -0.360 4.546 722 H THR 19 H THR 19 5.433 4.629 3.772 723 HA THR 19 HA THR 19 3.253 3.963 5.667 724 HB THR 19 HB THR 19 4.090 6.779 4.858 725 HG1 THR 19 HG1 THR 19 4.547 6.981 7.048 726 HG21 THR 19 HG21 THR 19 1.667 6.671 5.084 727 HG22 THR 19 HG22 THR 19 1.813 5.771 6.614 728 HG23 THR 19 HG23 THR 19 2.339 7.468 6.509 729 H ILE 20 H ILE 20 1.154 4.439 4.714 730 HA ILE 20 HA ILE 20 1.125 4.688 1.749 731 HB ILE 20 HB ILE 20 -0.290 2.604 3.462 732 HG12 ILE 20 HG12 ILE 20 2.109 2.069 3.104 733 HG13 ILE 20 HG13 ILE 20 1.018 0.913 2.350 734 HG21 ILE 20 HG21 ILE 20 -0.419 3.137 0.470 735 HG22 ILE 20 HG22 ILE 20 -1.058 1.675 1.262 736 HG23 ILE 20 HG23 ILE 20 -1.743 3.264 1.647 737 HD11 ILE 20 HD11 ILE 20 2.938 1.500 0.893 738 HD12 ILE 20 HD12 ILE 20 1.385 1.909 0.143 739 HD13 ILE 20 HD13 ILE 20 2.383 3.191 0.860 740 H THR 21 H THR 21 -0.819 5.581 0.960 741 HA THR 21 HA THR 21 -2.791 6.543 2.958 742 HB THR 21 HB THR 21 -1.485 8.395 0.923 743 HG1 THR 21 HG1 THR 21 -0.368 9.236 2.696 744 HG21 THR 21 HG21 THR 21 -3.195 8.899 3.396 745 HG22 THR 21 HG22 THR 21 -2.490 10.155 2.345 746 HG23 THR 21 HG23 THR 21 -3.738 9.065 1.713 747 H ILE 22 H ILE 22 -4.817 7.122 1.975 748 HA ILE 22 HA ILE 22 -5.096 6.209 -0.846 749 HB ILE 22 HB ILE 22 -5.846 4.573 0.834 750 HG12 ILE 22 HG12 ILE 22 -6.766 4.363 -1.289 751 HG13 ILE 22 HG13 ILE 22 -8.081 4.123 -0.128 752 HG21 ILE 22 HG21 ILE 22 -8.071 6.497 1.559 753 HG22 ILE 22 HG22 ILE 22 -7.820 4.851 2.157 754 HG23 ILE 22 HG23 ILE 22 -6.655 6.124 2.576 755 HD11 ILE 22 HD11 ILE 22 -7.558 6.539 -1.884 756 HD12 ILE 22 HD12 ILE 22 -8.927 5.417 -1.958 757 HD13 ILE 22 HD13 ILE 22 -8.780 6.520 -0.575 758 H LEU 23 H LEU 23 -5.101 8.195 -1.880 759 HA LEU 23 HA LEU 23 -5.962 10.537 -0.494 760 HB2 LEU 23 HB2 LEU 23 -5.620 10.302 -3.490 761 HB3 LEU 23 HB3 LEU 23 -5.500 11.737 -2.485 762 HG LEU 23 HG LEU 23 -3.523 9.475 -2.784 763 HD11 LEU 23 HD11 LEU 23 -2.003 11.368 -3.212 764 HD12 LEU 23 HD12 LEU 23 -3.412 11.450 -4.302 765 HD13 LEU 23 HD13 LEU 23 -3.334 12.516 -2.885 766 HD21 LEU 23 HD21 LEU 23 -3.608 9.844 -0.354 767 HD22 LEU 23 HD22 LEU 23 -2.123 10.553 -1.044 768 HD23 LEU 23 HD23 LEU 23 -3.486 11.603 -0.603 769 H GLY 24 H GLY 24 -7.689 8.340 -2.730 770 HA2 GLY 24 HA2 GLY 24 -10.225 8.983 -1.950 771 HA3 GLY 24 HA3 GLY 24 -9.894 10.228 -3.153 772 H VAL 25 H VAL 25 -11.856 9.017 -4.092 773 HA VAL 25 HA VAL 25 -10.813 6.931 -5.951 774 HB VAL 25 HB VAL 25 -12.791 5.605 -5.757 775 HG11 VAL 25 HG11 VAL 25 -11.915 6.306 -2.936 776 HG12 VAL 25 HG12 VAL 25 -12.642 4.779 -3.479 777 HG13 VAL 25 HG13 VAL 25 -11.020 5.240 -4.038 778 HG21 VAL 25 HG21 VAL 25 -13.856 7.686 -3.821 779 HG22 VAL 25 HG22 VAL 25 -14.474 7.321 -5.457 780 HG23 VAL 25 HG23 VAL 25 -14.602 6.112 -4.168 781 H SER 26 H SER 26 -12.066 6.644 -7.879 782 HA SER 26 HA SER 26 -14.062 8.658 -8.612 783 HB2 SER 26 HB2 SER 26 -12.826 9.249 -10.692 784 HB3 SER 26 HB3 SER 26 -12.024 9.829 -9.222 785 HG SER 26 HG SER 26 -11.367 7.476 -10.671 786 H GLY 27 H GLY 27 -15.510 6.904 -8.713 787 HA2 GLY 27 HA2 GLY 27 -16.568 5.136 -9.795 788 HA3 GLY 27 HA3 GLY 27 -15.358 5.272 -11.091 789 H GLN 28 H GLN 28 -14.346 3.303 -11.323 790 HA GLN 28 HA GLN 28 -13.901 1.614 -8.945 791 HB2 GLN 28 HB2 GLN 28 -12.994 1.233 -11.835 792 HB3 GLN 28 HB3 GLN 28 -12.844 0.055 -10.528 793 HG2 GLN 28 HG2 GLN 28 -15.358 1.018 -11.879 794 HG3 GLN 28 HG3 GLN 28 -14.712 -0.634 -11.728 795 HE21 GLN 28 HE22 GLN 28 -14.318 -1.188 -9.177 796 HE22 GLN 28 HE21 GLN 28 -15.693 -0.823 -8.156 797 H GLN 29 H GLN 29 -12.265 4.117 -10.698 798 HA GLN 29 HA GLN 29 -9.581 3.251 -10.062 799 HB2 GLN 29 HB2 GLN 29 -10.883 5.548 -11.365 800 HB3 GLN 29 HB3 GLN 29 -9.597 6.047 -10.271 801 HG2 GLN 29 HG2 GLN 29 -8.639 5.706 -12.453 802 HG3 GLN 29 HG3 GLN 29 -8.054 4.412 -11.397 803 HE21 GLN 29 HE22 GLN 29 -11.277 4.679 -13.021 804 HE22 GLN 29 HE21 GLN 29 -11.067 3.248 -14.005 805 H VAL 30 H VAL 30 -8.251 3.947 -8.427 806 HA VAL 30 HA VAL 30 -9.438 5.339 -6.093 807 HB VAL 30 HB VAL 30 -7.921 2.687 -6.092 808 HG11 VAL 30 HG11 VAL 30 -9.131 4.225 -3.765 809 HG12 VAL 30 HG12 VAL 30 -8.230 2.690 -3.699 810 HG13 VAL 30 HG13 VAL 30 -7.398 4.197 -4.155 811 HG21 VAL 30 HG21 VAL 30 -10.807 3.347 -5.361 812 HG22 VAL 30 HG22 VAL 30 -10.266 2.354 -6.733 813 HG23 VAL 30 HG23 VAL 30 -10.010 1.785 -5.072 814 H ARG 31 H ARG 31 -8.112 7.080 -5.852 815 HA ARG 31 HA ARG 31 -5.376 6.914 -6.920 816 HB2 ARG 31 HB2 ARG 31 -6.746 8.908 -7.330 817 HB3 ARG 31 HB3 ARG 31 -6.860 9.225 -5.587 818 HG2 ARG 31 HG2 ARG 31 -4.595 9.828 -5.428 819 HG3 ARG 31 HG3 ARG 31 -4.126 8.850 -6.831 820 HD2 ARG 31 HD2 ARG 31 -5.888 11.296 -7.078 821 HD3 ARG 31 HD3 ARG 31 -4.112 11.363 -7.201 822 HE ARG 31 HE ARG 31 -4.735 9.396 -8.982 823 HH11 ARG 31 HH11 ARG 31 -6.022 12.678 -8.613 824 HH12 ARG 31 HH12 ARG 31 -6.311 12.867 -10.323 825 HH21 ARG 31 HH21 ARG 31 -5.151 9.658 -11.162 826 HH22 ARG 31 HH22 ARG 31 -5.848 11.148 -11.765 827 H ILE 32 H ILE 32 -3.654 6.484 -5.756 828 HA ILE 32 HA ILE 32 -3.982 6.248 -2.797 829 HB ILE 32 HB ILE 32 -2.465 4.291 -4.554 830 HG12 ILE 32 HG12 ILE 32 -5.368 4.183 -3.671 831 HG13 ILE 32 HG13 ILE 32 -4.720 4.160 -5.319 832 HG21 ILE 32 HG21 ILE 32 -2.611 2.827 -2.587 833 HG22 ILE 32 HG22 ILE 32 -1.875 4.363 -2.137 834 HG23 ILE 32 HG23 ILE 32 -3.574 4.054 -1.724 835 HD11 ILE 32 HD11 ILE 32 -5.398 1.921 -4.728 836 HD12 ILE 32 HD12 ILE 32 -3.626 1.963 -4.825 837 HD13 ILE 32 HD13 ILE 32 -4.434 1.962 -3.239 838 H GLY 33 H GLY 33 -1.973 6.412 -1.619 839 HA2 GLY 33 HA2 GLY 33 0.285 7.595 -3.165 840 HA3 GLY 33 HA3 GLY 33 -0.284 8.313 -1.648 841 H ILE 34 H ILE 34 2.332 7.316 -2.201 842 HA ILE 34 HA ILE 34 2.595 5.198 -0.133 843 HB ILE 34 HB ILE 34 3.937 5.183 -2.876 844 HG12 ILE 34 HG12 ILE 34 1.885 3.226 -1.760 845 HG13 ILE 34 HG13 ILE 34 1.524 4.500 -2.938 846 HG21 ILE 34 HG21 ILE 34 5.394 4.330 -1.071 847 HG22 ILE 34 HG22 ILE 34 4.104 3.232 -0.533 848 HG23 ILE 34 HG23 ILE 34 4.883 3.002 -2.108 849 HD11 ILE 34 HD11 ILE 34 1.856 2.428 -4.135 850 HD12 ILE 34 HD12 ILE 34 3.196 3.537 -4.496 851 HD13 ILE 34 HD13 ILE 34 3.435 2.176 -3.365 852 H ASN 35 H ASN 35 4.400 5.496 1.131 853 HA ASN 35 HA ASN 35 6.144 7.785 0.391 854 HB2 ASN 35 HB2 ASN 35 4.184 8.487 1.795 855 HB3 ASN 35 HB3 ASN 35 4.776 7.432 3.080 856 HD21 ASN 35 HD22 ASN 35 4.417 10.218 3.396 857 HD22 ASN 35 HD21 ASN 35 5.982 10.980 3.580 858 H ALA 36 H ALA 36 7.896 6.592 0.032 859 HA ALA 36 HA ALA 36 9.218 5.435 2.408 860 HB1 ALA 36 HB1 ALA 36 8.278 3.481 1.211 861 HB2 ALA 36 HB2 ALA 36 9.007 4.063 -0.312 862 HB3 ALA 36 HB3 ALA 36 10.047 3.541 1.018 863 HA PRO 37 HA PRO 37 12.590 7.754 0.747 864 HB2 PRO 37 HB2 PRO 37 14.712 6.083 1.409 865 HB3 PRO 37 HB3 PRO 37 13.893 7.215 2.545 866 HG2 PRO 37 HG2 PRO 37 13.496 4.236 2.211 867 HG3 PRO 37 HG3 PRO 37 13.552 5.202 3.721 868 HD2 PRO 37 HD2 PRO 37 11.219 4.383 2.561 869 HD3 PRO 37 HD3 PRO 37 11.341 5.951 3.411 870 H LYS 38 H LYS 38 14.005 7.787 -1.073 871 HA LYS 38 HA LYS 38 13.365 6.017 -3.238 872 HB2 LYS 38 HB2 LYS 38 15.429 8.162 -2.712 873 HB3 LYS 38 HB3 LYS 38 15.564 7.139 -4.144 874 HG2 LYS 38 HG2 LYS 38 14.405 9.163 -4.667 875 HG3 LYS 38 HG3 LYS 38 13.358 7.747 -4.905 876 HD2 LYS 38 HD2 LYS 38 12.028 9.539 -3.955 877 HD3 LYS 38 HD3 LYS 38 12.171 8.301 -2.754 878 HE2 LYS 38 HE2 LYS 38 14.093 9.646 -1.740 879 HE3 LYS 38 HE3 LYS 38 13.823 10.850 -3.020 880 HZ1 LYS 38 HZ1 LYS 38 11.861 10.082 -0.953 881 HZ2 LYS 38 HZ2 LYS 38 12.724 11.470 -0.985 882 HZ3 LYS 38 HZ3 LYS 38 11.606 11.178 -2.153 883 H ASP 39 H ASP 39 15.258 5.637 -0.566 884 HA ASP 39 HA ASP 39 17.388 3.916 -1.407 885 HB2 ASP 39 HB2 ASP 39 15.852 4.242 1.190 886 HB3 ASP 39 HB3 ASP 39 17.204 3.120 1.021 887 H VAL 40 H VAL 40 14.004 3.380 -1.490 888 HA VAL 40 HA VAL 40 14.481 0.462 -1.852 889 HB VAL 40 HB VAL 40 12.377 -0.044 -0.712 890 HG11 VAL 40 HG11 VAL 40 14.081 1.834 0.992 891 HG12 VAL 40 HG12 VAL 40 13.011 0.551 1.593 892 HG13 VAL 40 HG13 VAL 40 14.471 0.130 0.667 893 HG21 VAL 40 HG21 VAL 40 11.246 2.112 -1.301 894 HG22 VAL 40 HG22 VAL 40 11.047 1.597 0.395 895 HG23 VAL 40 HG23 VAL 40 12.207 2.883 -0.004 896 H ALA 41 H ALA 41 12.521 -0.509 -3.099 897 HA ALA 41 HA ALA 41 12.024 1.413 -5.293 898 HB1 ALA 41 HB1 ALA 41 11.647 -0.626 -6.650 899 HB2 ALA 41 HB2 ALA 41 13.218 -0.694 -5.817 900 HB3 ALA 41 HB3 ALA 41 11.842 -1.637 -5.204 901 H VAL 42 H VAL 42 9.978 1.594 -6.309 902 HA VAL 42 HA VAL 42 7.712 0.039 -5.394 903 HB VAL 42 HB VAL 42 7.425 1.516 -3.620 904 HG11 VAL 42 HG11 VAL 42 7.655 4.013 -3.832 905 HG12 VAL 42 HG12 VAL 42 9.168 3.094 -3.979 906 HG13 VAL 42 HG13 VAL 42 8.382 3.746 -5.439 907 HG21 VAL 42 HG21 VAL 42 5.390 1.443 -5.038 908 HG22 VAL 42 HG22 VAL 42 5.555 2.986 -4.168 909 HG23 VAL 42 HG23 VAL 42 5.951 2.910 -5.890 910 H HIS 43 H HIS 43 6.415 -0.281 -7.088 911 HA HIS 43 HA HIS 43 6.052 1.774 -9.146 912 HB2 HIS 43 HB2 HIS 43 6.966 -0.937 -10.106 913 HB3 HIS 43 HB3 HIS 43 6.921 0.610 -10.953 914 HD2 HIS 43 HD2 HIS 43 9.050 -1.316 -8.344 915 HE1 HIS 43 HE1 HIS 43 11.494 1.776 -9.937 916 HE2 HIS 43 HE2 HIS 43 11.451 -0.270 -8.423 917 H ARG 44 H ARG 44 4.485 0.846 -10.897 918 HA ARG 44 HA ARG 44 2.288 -0.522 -9.586 919 HB2 ARG 44 HB2 ARG 44 2.825 0.197 -12.498 920 HB3 ARG 44 HB3 ARG 44 1.290 -0.450 -11.877 921 HG2 ARG 44 HG2 ARG 44 1.082 1.490 -10.354 922 HG3 ARG 44 HG3 ARG 44 2.599 2.163 -10.985 923 HD2 ARG 44 HD2 ARG 44 0.076 1.644 -12.611 924 HD3 ARG 44 HD3 ARG 44 0.635 3.214 -12.042 925 HE ARG 44 HE ARG 44 2.557 3.056 -13.512 926 HH11 ARG 44 HH11 ARG 44 0.039 0.620 -14.082 927 HH12 ARG 44 HH12 ARG 44 0.634 0.264 -15.697 928 HH21 ARG 44 HH21 ARG 44 3.231 2.565 -15.626 929 HH22 ARG 44 HH22 ARG 44 2.376 1.337 -16.549 930 H GLU 45 H GLU 45 1.374 -2.611 -10.493 931 HA GLU 45 HA GLU 45 3.381 -4.603 -10.378 932 HB2 GLU 45 HB2 GLU 45 0.906 -4.717 -9.809 933 HB3 GLU 45 HB3 GLU 45 0.574 -4.911 -11.532 934 HG2 GLU 45 HG2 GLU 45 2.412 -6.742 -9.926 935 HG3 GLU 45 HG3 GLU 45 0.676 -7.032 -10.120 936 H GLU 46 H GLU 46 2.162 -2.716 -13.059 937 HA GLU 46 HA GLU 46 2.937 -4.467 -15.194 938 HB2 GLU 46 HB2 GLU 46 1.370 -2.528 -15.387 939 HB3 GLU 46 HB3 GLU 46 2.722 -1.429 -15.069 940 HG2 GLU 46 HG2 GLU 46 3.852 -2.171 -17.115 941 HG3 GLU 46 HG3 GLU 46 2.624 -3.415 -17.378 942 H ILE 47 H ILE 47 4.570 -1.716 -13.532 943 HA ILE 47 HA ILE 47 6.870 -1.862 -15.296 944 HB ILE 47 HB ILE 47 6.597 -0.444 -12.629 945 HG12 ILE 47 HG12 ILE 47 4.694 0.310 -13.846 946 HG13 ILE 47 HG13 ILE 47 5.922 1.569 -13.987 947 HG21 ILE 47 HG21 ILE 47 8.312 0.099 -15.096 948 HG22 ILE 47 HG22 ILE 47 8.210 1.159 -13.671 949 HG23 ILE 47 HG23 ILE 47 8.874 -0.474 -13.510 950 HD11 ILE 47 HD11 ILE 47 6.525 0.633 -16.255 951 HD12 ILE 47 HD12 ILE 47 5.153 -0.493 -16.080 952 HD13 ILE 47 HD13 ILE 47 4.867 1.259 -16.135 953 H TYR 48 H TYR 48 5.913 -3.304 -12.258 954 HA TYR 48 HA TYR 48 8.469 -3.862 -11.150 955 HB2 TYR 48 HB2 TYR 48 6.272 -3.986 -10.005 956 HB3 TYR 48 HB3 TYR 48 5.845 -5.390 -10.982 957 HD1 TYR 48 HD1 TYR 48 8.270 -4.167 -8.415 958 HD2 TYR 48 HD2 TYR 48 6.514 -7.568 -10.376 959 HE1 TYR 48 HE1 TYR 48 9.255 -5.655 -6.695 960 HE2 TYR 48 HE2 TYR 48 7.457 -9.062 -8.665 961 HH TYR 48 HH TYR 48 9.420 -7.813 -5.920 962 H GLN 49 H GLN 49 6.645 -5.445 -13.750 963 HA GLN 49 HA GLN 49 8.136 -7.913 -13.650 964 HB2 GLN 49 HB2 GLN 49 6.387 -6.623 -15.780 965 HB3 GLN 49 HB3 GLN 49 7.051 -8.268 -15.900 966 HG2 GLN 49 HG2 GLN 49 5.846 -8.974 -13.910 967 HG3 GLN 49 HG3 GLN 49 5.329 -7.321 -13.576 968 HE21 GLN 49 HE22 GLN 49 3.121 -7.997 -13.599 969 HE22 GLN 49 HE21 GLN 49 2.272 -8.289 -15.088 970 H ARG 50 H ARG 50 8.743 -4.754 -15.058 971 HA ARG 50 HA ARG 50 10.695 -5.669 -17.037 972 HB2 ARG 50 HB2 ARG 50 9.917 -2.990 -15.819 973 HB3 ARG 50 HB3 ARG 50 11.371 -3.163 -16.797 974 HG2 ARG 50 HG2 ARG 50 9.580 -2.392 -18.210 975 HG3 ARG 50 HG3 ARG 50 10.013 -4.044 -18.682 976 HD2 ARG 50 HD2 ARG 50 8.065 -4.921 -17.474 977 HD3 ARG 50 HD3 ARG 50 7.661 -3.275 -16.912 978 HE ARG 50 HE ARG 50 7.836 -3.144 -19.703 979 HH11 ARG 50 HH11 ARG 50 5.786 -4.777 -17.327 980 HH12 ARG 50 HH12 ARG 50 4.448 -4.958 -18.439 981 HH21 ARG 50 HH21 ARG 50 6.052 -3.317 -21.097 982 HH22 ARG 50 HH22 ARG 50 4.579 -4.079 -20.545 983 H ILE 51 H ILE 51 10.622 -5.242 -13.636 984 HA ILE 51 HA ILE 51 13.524 -4.688 -13.475 985 HB ILE 51 HB ILE 51 11.243 -4.559 -11.468 986 HG12 ILE 51 HG12 ILE 51 12.899 -2.373 -12.817 987 HG13 ILE 51 HG13 ILE 51 11.279 -2.862 -13.340 988 HG21 ILE 51 HG21 ILE 51 13.414 -5.118 -10.389 989 HG22 ILE 51 HG22 ILE 51 14.138 -3.688 -11.168 990 HG23 ILE 51 HG23 ILE 51 12.836 -3.503 -9.954 991 HD11 ILE 51 HD11 ILE 51 11.108 -0.892 -11.980 992 HD12 ILE 51 HD12 ILE 51 10.372 -2.265 -11.127 993 HD13 ILE 51 HD13 ILE 51 11.993 -1.676 -10.644 994 H GLN 52 H GLN 52 11.014 -6.978 -12.230 995 HA GLN 52 HA GLN 52 12.985 -8.611 -10.909 996 HB2 GLN 52 HB2 GLN 52 10.103 -9.183 -11.710 997 HB3 GLN 52 HB3 GLN 52 11.089 -10.216 -10.659 998 HG2 GLN 52 HG2 GLN 52 10.146 -7.392 -10.107 999 HG3 GLN 52 HG3 GLN 52 9.821 -8.884 -9.195 1000 HE21 GLN 52 HE22 GLN 52 11.681 -6.065 -9.279 1001 HE22 GLN 52 HE21 GLN 52 12.980 -6.564 -8.224 1002 H ALA 53 H ALA 53 12.672 -8.091 -14.134 1003 HA ALA 53 HA ALA 53 12.927 -10.718 -15.206 1004 HB1 ALA 53 HB1 ALA 53 14.008 -8.044 -16.178 1005 HB2 ALA 53 HB2 ALA 53 13.845 -9.516 -17.160 1006 HB3 ALA 53 HB3 ALA 53 12.393 -8.704 -16.530 1007 H GLY 54 H GLY 54 15.111 -8.802 -13.261 1008 HA2 GLY 54 HA2 GLY 54 16.865 -10.668 -12.551 1009 HA3 GLY 54 HA3 GLY 54 17.472 -10.326 -14.182 1010 H LEU 55 H LEU 55 16.097 -7.625 -12.298 1011 HA LEU 55 HA LEU 55 18.760 -6.693 -11.502 1012 HB2 LEU 55 HB2 LEU 55 18.650 -4.759 -13.132 1013 HB3 LEU 55 HB3 LEU 55 18.940 -6.341 -13.842 1014 HG LEU 55 HG LEU 55 16.436 -6.481 -14.351 1015 HD11 LEU 55 HD11 LEU 55 16.615 -3.509 -13.702 1016 HD12 LEU 55 HD12 LEU 55 15.286 -4.291 -14.580 1017 HD13 LEU 55 HD13 LEU 55 15.575 -4.708 -12.882 1018 HD21 LEU 55 HD21 LEU 55 18.144 -6.046 -16.015 1019 HD22 LEU 55 HD22 LEU 55 16.690 -5.079 -16.349 1020 HD23 LEU 55 HD23 LEU 55 18.119 -4.304 -15.627 1021 H THR 56 H THR 56 18.581 -4.189 -11.108 1022 HA THR 56 HA THR 56 15.910 -3.315 -10.207 1023 HB THR 56 HB THR 56 17.005 -2.404 -8.088 1024 HG1 THR 56 HG1 THR 56 18.825 -3.602 -7.410 1025 HG21 THR 56 HG21 THR 56 15.431 -4.327 -8.162 1026 HG22 THR 56 HG22 THR 56 16.813 -5.432 -8.326 1027 HG23 THR 56 HG23 THR 56 16.632 -4.465 -6.850 1028 H ALA 57 H ALA 57 18.410 -2.801 -12.149 1029 HA ALA 57 HA ALA 57 17.913 0.094 -12.244 1030 HB1 ALA 57 HB1 ALA 57 20.701 -1.100 -11.965 1031 HB2 ALA 57 HB2 ALA 57 20.327 0.598 -12.342 1032 HB3 ALA 57 HB3 ALA 57 19.872 -0.083 -10.767 1033 HA PRO 58 HA PRO 58 17.657 -1.306 -16.512 1034 HB2 PRO 58 HB2 PRO 58 17.964 1.670 -16.889 1035 HB3 PRO 58 HB3 PRO 58 16.857 0.535 -17.721 1036 HG2 PRO 58 HG2 PRO 58 15.942 2.088 -15.687 1037 HG3 PRO 58 HG3 PRO 58 15.486 0.351 -15.747 1038 HD2 PRO 58 HD2 PRO 58 17.647 1.665 -14.085 1039 HD3 PRO 58 HD3 PRO 58 16.448 0.418 -13.609 1040 H ASP 59 H ASP 59 18.802 -0.825 -18.600 1041 HA ASP 59 HA ASP 59 21.544 -1.456 -18.356 1042 HB2 ASP 59 HB2 ASP 59 19.868 -2.004 -20.198 1043 HB3 ASP 59 HB3 ASP 59 20.070 -0.354 -20.773 1044 H5' U 36 H5' U 36 -16.263 1.521 7.899 1045 H5'' U 36 H5'' U 36 -16.754 0.270 6.740 1046 H4' U 36 H4' U 36 -16.948 0.013 9.782 1047 H3' U 36 H3' U 36 -14.561 0.041 8.548 1048 H2' U 36 H2' U 36 -14.885 -1.279 6.754 1049 HO2' U 36 HO2' U 36 -13.448 -2.522 8.100 1050 H1' U 36 H1' U 36 -16.695 -3.355 7.793 1051 H3 U 36 H3 U 36 -20.287 -2.440 4.878 1052 H5 U 36 H5 U 36 -16.687 -1.362 3.011 1053 H6 U 36 H6 U 36 -15.566 -1.601 5.129 1054 HO5' U 36 HO5' U 36 -18.399 1.844 7.186 1055 H5' C 37 H5' C 37 -15.938 -2.106 12.900 1056 H5'' C 37 H5'' C 37 -15.494 -0.666 13.814 1057 H4' C 37 H4' C 37 -14.859 -1.963 15.526 1058 H3' C 37 H3' C 37 -12.547 -2.091 14.206 1059 H2' C 37 H2' C 37 -13.159 -3.652 12.521 1060 HO2' C 37 HO2' C 37 -11.378 -4.591 13.676 1061 H1' C 37 H1' C 37 -14.506 -5.565 14.357 1062 H41 C 37 H41 C 37 -18.247 -6.693 9.368 1063 H42 C 37 H42 C 37 -17.634 -5.293 8.504 1064 H5 C 37 H5 C 37 -15.961 -3.752 9.495 1065 H6 C 37 H6 C 37 -14.658 -3.303 11.430 1066 H5' A 38 H5' A 38 -10.983 -5.637 15.729 1067 H5'' A 38 H5'' A 38 -9.803 -5.234 16.988 1068 H4' A 38 H4' A 38 -8.837 -6.661 15.227 1069 H3' A 38 H3' A 38 -7.540 -4.594 16.417 1070 H2' A 38 H2' A 38 -8.378 -2.903 14.935 1071 HO2' A 38 HO2' A 38 -5.902 -3.804 13.866 1072 H1' A 38 H1' A 38 -7.655 -4.669 12.596 1073 H8 A 38 H8 A 38 -9.821 -1.808 13.939 1074 H61 A 38 H61 A 38 -11.442 -0.959 8.009 1075 H62 A 38 H62 A 38 -11.638 -0.378 9.649 1076 H2 A 38 H2 A 38 -9.113 -4.749 8.287 1077 H5' G 39 H5' G 39 -7.889 -7.935 13.758 1078 H5'' G 39 H5'' G 39 -7.544 -9.349 14.765 1079 H4' G 39 H4' G 39 -7.670 -10.185 12.575 1080 H3' G 39 H3' G 39 -5.341 -10.622 13.837 1081 H2' G 39 H2' G 39 -4.241 -8.617 13.211 1082 HO2' G 39 HO2' G 39 -2.797 -9.036 11.544 1083 H1' G 39 H1' G 39 -5.099 -8.699 10.360 1084 H8 G 39 H8 G 39 -7.026 -6.090 11.100 1085 H1 G 39 H1 G 39 -1.145 -4.095 12.706 1086 H21 G 39 H21 G 39 0.222 -5.796 12.843 1087 H22 G 39 H22 G 39 -0.292 -7.444 12.536 1088 H5' G 40 H5' G 40 -4.520 -11.829 9.242 1089 H5'' G 40 H5'' G 40 -4.149 -13.554 9.356 1090 H4' G 40 H4' G 40 -2.772 -12.389 7.678 1091 H3' G 40 H3' G 40 -1.803 -14.284 9.525 1092 H2' G 40 H2' G 40 -1.000 -12.418 10.895 1093 HO2' G 40 HO2' G 40 0.676 -13.900 10.731 1094 H1' G 40 H1' G 40 -0.055 -11.433 8.169 1095 H8 G 40 H8 G 40 -0.993 -9.922 11.651 1096 H1 G 40 H1 G 40 4.560 -7.987 9.078 1097 H21 G 40 H21 G 40 4.885 -8.995 7.123 1098 H22 G 40 H22 G 40 3.718 -10.093 6.437 1099 H5' A 41 H5' A 41 -2.802 -14.928 4.905 1100 H5'' A 41 H5'' A 41 -3.129 -13.528 5.951 1101 H4' A 41 H4' A 41 -4.840 -16.057 5.882 1102 H3' A 41 H3' A 41 -4.988 -13.522 4.260 1103 H2' A 41 H2' A 41 -7.221 -13.193 4.706 1104 HO2' A 41 HO2' A 41 -7.835 -15.390 4.166 1105 H1' A 41 H1' A 41 -7.372 -14.294 7.269 1106 H8 A 41 H8 A 41 -5.138 -11.613 5.543 1107 H61 A 41 H61 A 41 -8.058 -7.684 9.386 1108 H62 A 41 H62 A 41 -6.965 -7.782 8.017 1109 H2 A 41 H2 A 41 -9.361 -11.791 10.362 1110 H5' C 42 H5' C 42 -5.641 -13.153 -0.002 1111 H5'' C 42 H5'' C 42 -5.011 -12.889 1.642 1112 H4' C 42 H4' C 42 -7.093 -13.333 2.641 1113 H3' C 42 H3' C 42 -7.584 -15.008 0.374 1114 H2' C 42 H2' C 42 -9.083 -13.829 -0.890 1115 HO2' C 42 HO2' C 42 -10.669 -14.215 0.734 1116 H1' C 42 H1' C 42 -9.234 -11.263 0.222 1117 H41 C 42 H41 C 42 -6.246 -11.206 -5.505 1118 H42 C 42 H42 C 42 -4.824 -10.683 -4.619 1119 H5 C 42 H5 C 42 -4.746 -10.585 -2.178 1120 H6 C 42 H6 C 42 -6.026 -11.006 -0.142 1121 H5' A 43 H5' A 43 -12.073 -14.356 2.781 1122 H5'' A 43 H5'' A 43 -10.496 -13.693 3.216 1123 H4' A 43 H4' A 43 -11.912 -15.266 5.339 1124 H3' A 43 H3' A 43 -12.747 -12.511 4.408 1125 H2' A 43 H2' A 43 -13.185 -12.036 6.753 1126 HO2' A 43 HO2' A 43 -13.931 -14.143 7.363 1127 H1' A 43 H1' A 43 -10.751 -12.866 7.529 1128 H8 A 43 H8 A 43 -10.253 -11.533 3.953 1129 H61 A 43 H61 A 43 -10.496 -5.895 6.544 1130 H62 A 43 H62 A 43 -10.090 -6.774 5.082 1131 H2 A 43 H2 A 43 -11.652 -8.845 9.620 1132 H5' U 44 H5' U 44 -16.668 -12.444 2.165 1133 H5'' U 44 H5'' U 44 -15.286 -13.556 2.141 1134 H4' U 44 H4' U 44 -15.044 -12.066 0.302 1135 H3' U 44 H3' U 44 -13.109 -12.137 2.460 1136 HO3' U 44 HO3' U 44 -11.793 -12.444 0.655 1137 H2' U 44 H2' U 44 -12.210 -9.970 2.318 1138 HO2' U 44 HO2' U 44 -11.853 -10.263 -0.005 1139 H1' U 44 H1' U 44 -14.305 -8.497 1.479 1140 H3 U 44 H3 U 44 -17.145 -8.356 5.205 1141 H5 U 44 H5 U 44 -13.471 -9.991 6.407 1142 H6 U 44 H6 U 44 -12.846 -10.191 4.101 Start of MODEL 10 1 H1 MET 1 H1 MET 1 8.394 10.296 -0.989 2 H2 MET 1 H2 MET 1 8.499 10.857 -2.533 3 H3 MET 1 H3 MET 1 8.518 9.240 -2.248 4 HA MET 1 HA MET 1 6.282 9.280 -1.434 5 HB2 MET 1 HB2 MET 1 6.348 11.625 -0.586 6 HB3 MET 1 HB3 MET 1 6.433 12.219 -2.250 7 HG2 MET 1 HG2 MET 1 4.168 12.444 -1.468 8 HG3 MET 1 HG3 MET 1 4.204 11.203 -2.704 9 HE1 MET 1 HE1 MET 1 1.802 10.527 -1.984 10 HE2 MET 1 HE2 MET 1 1.321 10.135 -0.320 11 HE3 MET 1 HE3 MET 1 1.852 11.791 -0.728 12 H LEU 2 H LEU 2 4.718 8.580 -2.882 13 HA LEU 2 HA LEU 2 4.976 9.422 -5.707 14 HB2 LEU 2 HB2 LEU 2 5.550 6.772 -4.545 15 HB3 LEU 2 HB3 LEU 2 4.313 6.710 -5.814 16 HG LEU 2 HG LEU 2 7.094 7.886 -6.081 17 HD11 LEU 2 HD11 LEU 2 5.813 5.324 -7.120 18 HD12 LEU 2 HD12 LEU 2 7.415 5.935 -7.617 19 HD13 LEU 2 HD13 LEU 2 7.122 5.470 -5.926 20 HD21 LEU 2 HD21 LEU 2 6.561 7.946 -8.518 21 HD22 LEU 2 HD22 LEU 2 4.874 7.505 -8.149 22 HD23 LEU 2 HD23 LEU 2 5.551 9.063 -7.597 23 H ILE 3 H ILE 3 3.030 9.209 -6.882 24 HA ILE 3 HA ILE 3 0.612 8.442 -5.331 25 HB ILE 3 HB ILE 3 0.991 10.995 -6.952 26 HG12 ILE 3 HG12 ILE 3 -0.026 11.872 -4.689 27 HG13 ILE 3 HG13 ILE 3 0.591 10.356 -4.013 28 HG21 ILE 3 HG21 ILE 3 -1.502 9.806 -5.669 29 HG22 ILE 3 HG22 ILE 3 -1.374 11.444 -6.347 30 HG23 ILE 3 HG23 ILE 3 -1.227 10.039 -7.416 31 HD11 ILE 3 HD11 ILE 3 2.172 12.506 -5.478 32 HD12 ILE 3 HD12 ILE 3 2.166 12.226 -3.718 33 HD13 ILE 3 HD13 ILE 3 2.892 11.027 -4.790 34 H LEU 4 H LEU 4 -1.043 7.573 -6.602 35 HA LEU 4 HA LEU 4 -0.528 7.054 -9.471 36 HB2 LEU 4 HB2 LEU 4 -0.857 4.924 -7.313 37 HB3 LEU 4 HB3 LEU 4 -0.922 4.601 -9.045 38 HG LEU 4 HG LEU 4 1.526 5.677 -7.584 39 HD11 LEU 4 HD11 LEU 4 0.930 3.411 -6.908 40 HD12 LEU 4 HD12 LEU 4 0.778 2.911 -8.608 41 HD13 LEU 4 HD13 LEU 4 2.371 3.370 -7.952 42 HD21 LEU 4 HD21 LEU 4 2.686 5.055 -9.694 43 HD22 LEU 4 HD22 LEU 4 1.124 4.637 -10.428 44 HD23 LEU 4 HD23 LEU 4 1.476 6.322 -9.985 45 H THR 5 H THR 5 -2.426 5.875 -10.438 46 HA THR 5 HA THR 5 -4.858 5.948 -8.751 47 HB THR 5 HB THR 5 -5.132 6.751 -11.639 48 HG1 THR 5 HG1 THR 5 -3.689 8.249 -10.818 49 HG21 THR 5 HG21 THR 5 -6.625 7.502 -9.095 50 HG22 THR 5 HG22 THR 5 -7.159 7.765 -10.775 51 HG23 THR 5 HG23 THR 5 -7.065 6.116 -10.119 52 H ARG 6 H ARG 6 -5.002 3.859 -8.454 53 HA ARG 6 HA ARG 6 -4.757 1.957 -10.726 54 HB2 ARG 6 HB2 ARG 6 -3.392 1.898 -8.497 55 HB3 ARG 6 HB3 ARG 6 -4.911 1.480 -7.720 56 HG2 ARG 6 HG2 ARG 6 -3.751 -0.541 -8.016 57 HG3 ARG 6 HG3 ARG 6 -5.010 -0.554 -9.266 58 HD2 ARG 6 HD2 ARG 6 -2.137 0.375 -9.729 59 HD3 ARG 6 HD3 ARG 6 -2.661 -1.298 -9.960 60 HE ARG 6 HE ARG 6 -4.283 -0.470 -11.642 61 HH11 ARG 6 HH11 ARG 6 -1.490 1.579 -10.899 62 HH12 ARG 6 HH12 ARG 6 -1.529 2.370 -12.461 63 HH21 ARG 6 HH21 ARG 6 -4.272 0.526 -13.646 64 HH22 ARG 6 HH22 ARG 6 -3.088 1.753 -14.032 65 H LYS 7 H LYS 7 -6.495 0.140 -10.765 66 HA LYS 7 HA LYS 7 -8.927 1.011 -9.289 67 HB2 LYS 7 HB2 LYS 7 -10.347 0.159 -11.102 68 HB3 LYS 7 HB3 LYS 7 -9.439 1.572 -11.574 69 HG2 LYS 7 HG2 LYS 7 -7.855 0.196 -12.828 70 HG3 LYS 7 HG3 LYS 7 -8.628 -1.296 -12.214 71 HD2 LYS 7 HD2 LYS 7 -10.790 -0.487 -13.264 72 HD3 LYS 7 HD3 LYS 7 -9.872 0.830 -14.015 73 HE2 LYS 7 HE2 LYS 7 -9.459 -2.162 -14.421 74 HE3 LYS 7 HE3 LYS 7 -10.183 -1.036 -15.573 75 HZ1 LYS 7 HZ1 LYS 7 -7.917 -1.422 -16.133 76 HZ2 LYS 7 HZ2 LYS 7 -8.049 0.136 -15.607 77 HZ3 LYS 7 HZ3 LYS 7 -7.394 -1.022 -14.634 78 H VAL 8 H VAL 8 -10.630 -0.800 -9.288 79 HA VAL 8 HA VAL 8 -9.459 -2.591 -7.453 80 HB VAL 8 HB VAL 8 -11.610 -3.578 -7.206 81 HG11 VAL 8 HG11 VAL 8 -11.906 -0.598 -7.839 82 HG12 VAL 8 HG12 VAL 8 -12.938 -1.548 -6.761 83 HG13 VAL 8 HG13 VAL 8 -11.234 -1.262 -6.335 84 HG21 VAL 8 HG21 VAL 8 -12.332 -3.895 -9.514 85 HG22 VAL 8 HG22 VAL 8 -13.532 -2.995 -8.562 86 HG23 VAL 8 HG23 VAL 8 -12.492 -2.123 -9.720 87 H GLY 9 H GLY 9 -8.731 -4.579 -7.471 88 HA2 GLY 9 HA2 GLY 9 -8.525 -6.797 -8.241 89 HA3 GLY 9 HA3 GLY 9 -9.149 -6.315 -9.831 90 H GLU 10 H GLU 10 -6.897 -3.984 -8.986 91 HA GLU 10 HA GLU 10 -4.748 -5.400 -10.493 92 HB2 GLU 10 HB2 GLU 10 -5.293 -2.448 -10.089 93 HB3 GLU 10 HB3 GLU 10 -3.966 -3.138 -11.056 94 HG2 GLU 10 HG2 GLU 10 -5.584 -4.240 -12.534 95 HG3 GLU 10 HG3 GLU 10 -6.938 -3.599 -11.585 96 H SER 11 H SER 11 -2.489 -4.109 -9.852 97 HA SER 11 HA SER 11 -2.250 -4.213 -6.903 98 HB2 SER 11 HB2 SER 11 -0.881 -6.144 -8.803 99 HB3 SER 11 HB3 SER 11 -0.445 -5.936 -7.096 100 HG SER 11 HG SER 11 -2.970 -6.739 -8.120 101 H ILE 12 H ILE 12 0.123 -4.131 -6.311 102 HA ILE 12 HA ILE 12 1.803 -2.269 -7.818 103 HB ILE 12 HB ILE 12 0.572 -1.477 -5.135 104 HG12 ILE 12 HG12 ILE 12 0.020 -0.392 -7.924 105 HG13 ILE 12 HG13 ILE 12 -1.111 -1.267 -6.873 106 HG21 ILE 12 HG21 ILE 12 1.739 0.656 -5.420 107 HG22 ILE 12 HG22 ILE 12 2.918 -0.642 -5.499 108 HG23 ILE 12 HG23 ILE 12 2.371 0.155 -6.989 109 HD11 ILE 12 HD11 ILE 12 -0.968 0.570 -5.205 110 HD12 ILE 12 HD12 ILE 12 0.062 1.487 -6.341 111 HD13 ILE 12 HD13 ILE 12 -1.604 1.100 -6.779 112 H ASN 13 H ASN 13 3.933 -2.052 -6.596 113 HA ASN 13 HA ASN 13 4.331 -4.255 -4.628 114 HB2 ASN 13 HB2 ASN 13 5.662 -3.892 -7.312 115 HB3 ASN 13 HB3 ASN 13 6.525 -4.665 -5.973 116 HD21 ASN 13 HD22 ASN 13 3.274 -4.825 -7.498 117 HD22 ASN 13 HD21 ASN 13 3.172 -6.580 -7.482 118 H ILE 14 H ILE 14 6.277 -4.161 -3.474 119 HA ILE 14 HA ILE 14 7.714 -1.565 -3.389 120 HB ILE 14 HB ILE 14 6.393 -2.939 -1.003 121 HG12 ILE 14 HG12 ILE 14 5.868 -0.221 -2.279 122 HG13 ILE 14 HG13 ILE 14 4.813 -1.644 -2.388 123 HG21 ILE 14 HG21 ILE 14 8.193 -0.476 -1.081 124 HG22 ILE 14 HG22 ILE 14 7.328 -1.093 0.344 125 HG23 ILE 14 HG23 ILE 14 8.602 -2.054 -0.389 126 HD11 ILE 14 HD11 ILE 14 5.474 -0.098 0.143 127 HD12 ILE 14 HD12 ILE 14 3.920 -0.178 -0.712 128 HD13 ILE 14 HD13 ILE 14 4.560 -1.624 0.092 129 H GLY 15 H GLY 15 9.840 -1.757 -2.677 130 HA2 GLY 15 HA2 GLY 15 11.874 -2.823 -2.461 131 HA3 GLY 15 HA3 GLY 15 11.032 -3.899 -1.338 132 H ASP 16 H ASP 16 11.828 -5.868 -1.911 133 HA ASP 16 HA ASP 16 11.154 -6.818 -4.646 134 HB2 ASP 16 HB2 ASP 16 13.667 -7.456 -3.053 135 HB3 ASP 16 HB3 ASP 16 13.200 -8.219 -4.581 136 H ASP 17 H ASP 17 10.135 -6.935 -1.638 137 HA ASP 17 HA ASP 17 9.461 -9.813 -1.726 138 HB2 ASP 17 HB2 ASP 17 10.608 -8.391 0.709 139 HB3 ASP 17 HB3 ASP 17 9.984 -10.042 0.674 140 H ILE 18 H ILE 18 8.153 -6.837 -1.838 141 HA ILE 18 HA ILE 18 5.886 -7.658 -0.084 142 HB ILE 18 HB ILE 18 6.953 -4.833 -0.424 143 HG12 ILE 18 HG12 ILE 18 7.072 -5.249 2.229 144 HG13 ILE 18 HG13 ILE 18 7.375 -6.911 1.703 145 HG21 ILE 18 HG21 ILE 18 4.537 -4.838 -0.176 146 HG22 ILE 18 HG22 ILE 18 4.639 -5.974 1.195 147 HG23 ILE 18 HG23 ILE 18 5.261 -4.318 1.350 148 HD11 ILE 18 HD11 ILE 18 8.875 -4.427 0.751 149 HD12 ILE 18 HD12 ILE 18 9.470 -5.572 1.980 150 HD13 ILE 18 HD13 ILE 18 9.264 -6.099 0.296 151 H THR 19 H THR 19 3.843 -7.184 -0.824 152 HA THR 19 HA THR 19 3.557 -5.926 -3.498 153 HB THR 19 HB THR 19 2.304 -8.582 -2.689 154 HG1 THR 19 HG1 THR 19 4.517 -8.780 -3.105 155 HG21 THR 19 HG21 THR 19 0.889 -7.385 -4.253 156 HG22 THR 19 HG22 THR 19 2.292 -7.002 -5.287 157 HG23 THR 19 HG23 THR 19 1.724 -8.677 -5.125 158 H ILE 20 H ILE 20 1.387 -5.180 -3.895 159 HA ILE 20 HA ILE 20 -0.402 -4.940 -1.537 160 HB ILE 20 HB ILE 20 0.545 -2.715 -3.389 161 HG12 ILE 20 HG12 ILE 20 2.222 -3.337 -1.659 162 HG13 ILE 20 HG13 ILE 20 1.615 -1.687 -1.503 163 HG21 ILE 20 HG21 ILE 20 -1.477 -2.687 -1.112 164 HG22 ILE 20 HG22 ILE 20 -0.810 -1.229 -1.878 165 HG23 ILE 20 HG23 ILE 20 -1.781 -2.361 -2.833 166 HD11 ILE 20 HD11 ILE 20 0.163 -2.330 0.346 167 HD12 ILE 20 HD12 ILE 20 0.592 -4.043 0.129 168 HD13 ILE 20 HD13 ILE 20 1.819 -2.876 0.683 169 H THR 21 H THR 21 -2.603 -4.815 -2.126 170 HA THR 21 HA THR 21 -3.241 -4.863 -5.024 171 HB THR 21 HB THR 21 -4.183 -6.965 -3.034 172 HG1 THR 21 HG1 THR 21 -2.381 -7.160 -5.213 173 HG21 THR 21 HG21 THR 21 -5.843 -6.510 -4.807 174 HG22 THR 21 HG22 THR 21 -4.578 -6.700 -6.046 175 HG23 THR 21 HG23 THR 21 -5.076 -8.088 -5.058 176 H ILE 22 H ILE 22 -5.309 -4.155 -5.515 177 HA ILE 22 HA ILE 22 -6.845 -2.926 -3.279 178 HB ILE 22 HB ILE 22 -6.090 -1.254 -4.723 179 HG12 ILE 22 HG12 ILE 22 -8.037 -0.299 -5.781 180 HG13 ILE 22 HG13 ILE 22 -8.859 -1.874 -5.805 181 HG21 ILE 22 HG21 ILE 22 -5.284 -2.526 -6.607 182 HG22 ILE 22 HG22 ILE 22 -6.953 -2.982 -7.067 183 HG23 ILE 22 HG23 ILE 22 -6.408 -1.296 -7.192 184 HD11 ILE 22 HD11 ILE 22 -9.683 -0.441 -4.003 185 HD12 ILE 22 HD12 ILE 22 -8.935 -1.927 -3.386 186 HD13 ILE 22 HD13 ILE 22 -8.043 -0.378 -3.298 187 H LEU 23 H LEU 23 -8.104 -4.661 -2.615 188 HA LEU 23 HA LEU 23 -9.098 -6.627 -4.423 189 HB2 LEU 23 HB2 LEU 23 -10.450 -5.959 -1.810 190 HB3 LEU 23 HB3 LEU 23 -10.322 -7.511 -2.634 191 HG LEU 23 HG LEU 23 -8.168 -6.063 -1.061 192 HD11 LEU 23 HD11 LEU 23 -9.513 -8.798 -0.825 193 HD12 LEU 23 HD12 LEU 23 -8.239 -8.190 0.244 194 HD13 LEU 23 HD13 LEU 23 -9.836 -7.394 0.202 195 HD21 LEU 23 HD21 LEU 23 -6.708 -8.018 -1.626 196 HD22 LEU 23 HD22 LEU 23 -7.921 -8.513 -2.842 197 HD23 LEU 23 HD23 LEU 23 -7.051 -6.973 -3.015 198 H GLY 24 H GLY 24 -10.459 -3.527 -3.279 199 HA2 GLY 24 HA2 GLY 24 -12.152 -3.073 -5.393 200 HA3 GLY 24 HA3 GLY 24 -13.116 -4.121 -4.364 201 H VAL 25 H VAL 25 -14.456 -2.040 -4.510 202 HA VAL 25 HA VAL 25 -13.788 -0.366 -2.141 203 HB VAL 25 HB VAL 25 -14.497 1.635 -3.213 204 HG11 VAL 25 HG11 VAL 25 -12.836 1.944 -4.954 205 HG12 VAL 25 HG12 VAL 25 -12.153 0.938 -3.655 206 HG13 VAL 25 HG13 VAL 25 -12.684 0.194 -5.188 207 HG21 VAL 25 HG21 VAL 25 -16.326 0.818 -4.580 208 HG22 VAL 25 HG22 VAL 25 -15.188 1.724 -5.584 209 HG23 VAL 25 HG23 VAL 25 -15.186 -0.055 -5.642 210 H SER 26 H SER 26 -15.611 0.676 -1.152 211 HA SER 26 HA SER 26 -18.315 -0.115 -1.952 212 HB2 SER 26 HB2 SER 26 -18.818 -0.886 0.395 213 HB3 SER 26 HB3 SER 26 -17.789 -1.994 -0.539 214 HG SER 26 HG SER 26 -17.008 -1.639 1.581 215 H GLY 27 H GLY 27 -18.609 2.107 -2.388 216 HA2 GLY 27 HA2 GLY 27 -19.160 4.286 -1.802 217 HA3 GLY 27 HA3 GLY 27 -19.133 3.781 -0.096 218 H GLN 28 H GLN 28 -17.632 4.919 1.075 219 HA GLN 28 HA GLN 28 -15.242 5.982 -0.308 220 HB2 GLN 28 HB2 GLN 28 -16.150 6.194 2.596 221 HB3 GLN 28 HB3 GLN 28 -14.742 7.003 1.890 222 HG2 GLN 28 HG2 GLN 28 -17.648 7.466 1.155 223 HG3 GLN 28 HG3 GLN 28 -16.568 8.542 2.073 224 HE21 GLN 28 HE22 GLN 28 -17.273 7.193 -1.160 225 HE22 GLN 28 HE21 GLN 28 -16.313 8.350 -2.056 226 H GLN 29 H GLN 29 -16.219 3.242 1.610 227 HA GLN 29 HA GLN 29 -13.616 2.644 2.703 228 HB2 GLN 29 HB2 GLN 29 -16.287 1.357 2.524 229 HB3 GLN 29 HB3 GLN 29 -14.937 0.232 2.432 230 HG2 GLN 29 HG2 GLN 29 -15.633 0.506 4.743 231 HG3 GLN 29 HG3 GLN 29 -13.997 1.153 4.528 232 HE21 GLN 29 HE22 GLN 29 -17.227 2.630 3.777 233 HE22 GLN 29 HE21 GLN 29 -17.003 4.006 4.832 234 H VAL 30 H VAL 30 -12.072 1.241 1.940 235 HA VAL 30 HA VAL 30 -12.262 0.307 -0.869 236 HB VAL 30 HB VAL 30 -10.004 1.926 0.397 237 HG11 VAL 30 HG11 VAL 30 -9.221 0.152 -1.188 238 HG12 VAL 30 HG12 VAL 30 -10.281 0.852 -2.434 239 HG13 VAL 30 HG13 VAL 30 -8.928 1.804 -1.783 240 HG21 VAL 30 HG21 VAL 30 -11.922 2.605 -1.877 241 HG22 VAL 30 HG22 VAL 30 -11.883 3.361 -0.270 242 HG23 VAL 30 HG23 VAL 30 -10.519 3.579 -1.381 243 H ARG 31 H ARG 31 -11.915 -1.832 -0.766 244 HA ARG 31 HA ARG 31 -10.592 -3.084 1.525 245 HB2 ARG 31 HB2 ARG 31 -11.878 -4.026 -1.063 246 HB3 ARG 31 HB3 ARG 31 -10.937 -5.144 -0.036 247 HG2 ARG 31 HG2 ARG 31 -13.070 -3.459 1.235 248 HG3 ARG 31 HG3 ARG 31 -13.527 -4.910 0.334 249 HD2 ARG 31 HD2 ARG 31 -12.109 -6.326 1.707 250 HD3 ARG 31 HD3 ARG 31 -11.371 -4.927 2.474 251 HE ARG 31 HE ARG 31 -13.075 -4.893 3.989 252 HH11 ARG 31 HH11 ARG 31 -14.273 -6.510 1.087 253 HH12 ARG 31 HH12 ARG 31 -15.890 -6.717 1.730 254 HH21 ARG 31 HH21 ARG 31 -15.160 -5.222 4.819 255 HH22 ARG 31 HH22 ARG 31 -16.377 -6.030 3.856 256 H ILE 32 H ILE 32 -8.491 -3.286 1.692 257 HA ILE 32 HA ILE 32 -6.837 -3.392 -0.796 258 HB ILE 32 HB ILE 32 -5.919 -2.062 1.767 259 HG12 ILE 32 HG12 ILE 32 -7.501 -0.823 -0.509 260 HG13 ILE 32 HG13 ILE 32 -7.866 -0.816 1.224 261 HG21 ILE 32 HG21 ILE 32 -5.067 -1.768 -1.145 262 HG22 ILE 32 HG22 ILE 32 -4.296 -1.000 0.264 263 HG23 ILE 32 HG23 ILE 32 -4.223 -2.746 0.085 264 HD11 ILE 32 HD11 ILE 32 -5.599 0.661 -0.166 265 HD12 ILE 32 HD12 ILE 32 -7.052 1.362 0.581 266 HD13 ILE 32 HD13 ILE 32 -5.821 0.581 1.603 267 H GLY 33 H GLY 33 -4.884 -4.625 -0.604 268 HA2 GLY 33 HA2 GLY 33 -4.723 -6.378 1.798 269 HA3 GLY 33 HA3 GLY 33 -4.724 -7.073 0.166 270 H ILE 34 H ILE 34 -2.652 -7.368 2.080 271 HA ILE 34 HA ILE 34 -0.364 -6.060 0.700 272 HB ILE 34 HB ILE 34 -0.728 -6.231 3.720 273 HG12 ILE 34 HG12 ILE 34 -0.862 -3.716 1.997 274 HG13 ILE 34 HG13 ILE 34 -2.278 -4.551 2.650 275 HG21 ILE 34 HG21 ILE 34 1.618 -6.344 3.013 276 HG22 ILE 34 HG22 ILE 34 1.414 -4.904 1.996 277 HG23 ILE 34 HG23 ILE 34 1.317 -4.776 3.760 278 HD11 ILE 34 HD11 ILE 34 -0.064 -3.280 4.287 279 HD12 ILE 34 HD12 ILE 34 -1.753 -2.747 4.126 280 HD13 ILE 34 HD13 ILE 34 -1.387 -4.288 4.942 281 H ASN 35 H ASN 35 1.503 -7.322 0.683 282 HA ASN 35 HA ASN 35 1.307 -9.959 2.021 283 HB2 ASN 35 HB2 ASN 35 0.286 -9.967 -0.300 284 HB3 ASN 35 HB3 ASN 35 1.883 -9.613 -0.945 285 HD21 ASN 35 HD22 ASN 35 -0.122 -12.014 -0.907 286 HD22 ASN 35 HD21 ASN 35 0.888 -13.389 -0.527 287 H ALA 36 H ALA 36 3.051 -9.892 3.282 288 HA ALA 36 HA ALA 36 5.708 -9.544 2.046 289 HB1 ALA 36 HB1 ALA 36 4.728 -7.947 4.461 290 HB2 ALA 36 HB2 ALA 36 6.392 -7.978 3.854 291 HB3 ALA 36 HB3 ALA 36 5.100 -7.274 2.855 292 HA PRO 37 HA PRO 37 6.723 -12.751 4.959 293 HB2 PRO 37 HB2 PRO 37 9.315 -12.028 5.630 294 HB3 PRO 37 HB3 PRO 37 8.865 -12.830 4.082 295 HG2 PRO 37 HG2 PRO 37 9.327 -9.882 4.634 296 HG3 PRO 37 HG3 PRO 37 9.925 -10.872 3.263 297 HD2 PRO 37 HD2 PRO 37 7.737 -9.295 3.026 298 HD3 PRO 37 HD3 PRO 37 7.801 -10.913 2.255 299 H LYS 38 H LYS 38 7.054 -13.101 7.250 300 HA LYS 38 HA LYS 38 6.276 -10.902 8.950 301 HB2 LYS 38 HB2 LYS 38 7.378 -13.685 9.554 302 HB3 LYS 38 HB3 LYS 38 6.805 -12.560 10.801 303 HG2 LYS 38 HG2 LYS 38 5.101 -13.507 8.457 304 HG3 LYS 38 HG3 LYS 38 5.086 -14.276 10.043 305 HD2 LYS 38 HD2 LYS 38 4.605 -11.294 9.908 306 HD3 LYS 38 HD3 LYS 38 3.356 -12.384 9.326 307 HE2 LYS 38 HE2 LYS 38 2.920 -11.894 11.649 308 HE3 LYS 38 HE3 LYS 38 3.382 -13.590 11.499 309 HZ1 LYS 38 HZ1 LYS 38 4.467 -12.508 13.346 310 HZ2 LYS 38 HZ2 LYS 38 5.589 -12.978 12.246 311 HZ3 LYS 38 HZ3 LYS 38 5.155 -11.392 12.359 312 H ASP 39 H ASP 39 9.047 -11.461 7.373 313 HA ASP 39 HA ASP 39 11.087 -10.689 9.214 314 HB2 ASP 39 HB2 ASP 39 11.221 -11.719 6.849 315 HB3 ASP 39 HB3 ASP 39 10.947 -10.098 6.234 316 H VAL 40 H VAL 40 8.400 -8.974 7.996 317 HA VAL 40 HA VAL 40 9.573 -6.366 8.781 318 HB VAL 40 HB VAL 40 8.648 -5.257 6.851 319 HG11 VAL 40 HG11 VAL 40 10.118 -7.756 5.904 320 HG12 VAL 40 HG12 VAL 40 10.005 -6.210 5.046 321 HG13 VAL 40 HG13 VAL 40 10.901 -6.310 6.582 322 HG21 VAL 40 HG21 VAL 40 7.700 -7.954 5.843 323 HG22 VAL 40 HG22 VAL 40 6.639 -6.688 6.533 324 HG23 VAL 40 HG23 VAL 40 7.535 -6.381 5.035 325 H ALA 41 H ALA 41 7.741 -4.702 8.996 326 HA ALA 41 HA ALA 41 5.476 -6.084 10.361 327 HB1 ALA 41 HB1 ALA 41 6.972 -4.743 11.795 328 HB2 ALA 41 HB2 ALA 41 6.668 -3.313 10.780 329 HB3 ALA 41 HB3 ALA 41 5.345 -4.034 11.723 330 H VAL 42 H VAL 42 3.349 -5.235 10.140 331 HA VAL 42 HA VAL 42 2.880 -2.955 8.381 332 HB VAL 42 HB VAL 42 2.977 -4.453 6.591 333 HG11 VAL 42 HG11 VAL 42 3.287 -6.540 7.724 334 HG12 VAL 42 HG12 VAL 42 1.628 -6.508 8.372 335 HG13 VAL 42 HG13 VAL 42 1.911 -6.721 6.624 336 HG21 VAL 42 HG21 VAL 42 0.070 -4.613 7.481 337 HG22 VAL 42 HG22 VAL 42 0.817 -3.241 6.631 338 HG23 VAL 42 HG23 VAL 42 0.689 -4.833 5.837 339 H HIS 43 H HIS 43 1.188 -1.852 9.109 340 HA HIS 43 HA HIS 43 -1.101 -3.172 10.368 341 HB2 HIS 43 HB2 HIS 43 0.275 -0.997 11.965 342 HB3 HIS 43 HB3 HIS 43 -0.931 -2.165 12.480 343 HD2 HIS 43 HD2 HIS 43 2.852 -1.867 11.738 344 HE1 HIS 43 HE1 HIS 43 2.310 -5.416 14.017 345 HE2 HIS 43 HE2 HIS 43 4.028 -3.848 12.993 346 H ARG 44 H ARG 44 -2.798 -1.389 10.972 347 HA ARG 44 HA ARG 44 -2.798 0.648 8.884 348 HB2 ARG 44 HB2 ARG 44 -4.952 1.334 9.906 349 HB3 ARG 44 HB3 ARG 44 -4.908 -0.389 9.512 350 HG2 ARG 44 HG2 ARG 44 -4.426 -0.935 11.866 351 HG3 ARG 44 HG3 ARG 44 -4.450 0.796 12.281 352 HD2 ARG 44 HD2 ARG 44 -6.795 0.947 11.570 353 HD3 ARG 44 HD3 ARG 44 -6.768 -0.744 11.042 354 HE ARG 44 HE ARG 44 -6.315 -1.350 13.433 355 HH11 ARG 44 HH11 ARG 44 -8.004 1.673 12.667 356 HH12 ARG 44 HH12 ARG 44 -8.769 1.766 14.234 357 HH21 ARG 44 HH21 ARG 44 -7.337 -1.197 15.442 358 HH22 ARG 44 HH22 ARG 44 -8.412 0.133 15.797 359 H GLU 45 H GLU 45 -3.192 3.010 9.563 360 HA GLU 45 HA GLU 45 -0.812 3.815 10.822 361 HB2 GLU 45 HB2 GLU 45 -2.277 4.989 9.103 362 HB3 GLU 45 HB3 GLU 45 -3.308 5.523 10.424 363 HG2 GLU 45 HG2 GLU 45 -0.310 6.097 10.240 364 HG3 GLU 45 HG3 GLU 45 -1.549 7.165 9.572 365 H GLU 46 H GLU 46 -3.844 2.946 12.257 366 HA GLU 46 HA GLU 46 -3.643 4.552 14.633 367 HB2 GLU 46 HB2 GLU 46 -5.724 3.443 13.699 368 HB3 GLU 46 HB3 GLU 46 -5.030 1.880 14.150 369 HG2 GLU 46 HG2 GLU 46 -6.612 2.601 15.860 370 HG3 GLU 46 HG3 GLU 46 -4.971 2.589 16.525 371 H ILE 47 H ILE 47 -2.749 1.139 13.850 372 HA ILE 47 HA ILE 47 -1.940 0.610 16.587 373 HB ILE 47 HB ILE 47 -1.318 -1.006 14.099 374 HG12 ILE 47 HG12 ILE 47 -3.671 -0.623 13.935 375 HG13 ILE 47 HG13 ILE 47 -3.432 -2.265 14.544 376 HG21 ILE 47 HG21 ILE 47 -1.729 -1.782 17.024 377 HG22 ILE 47 HG22 ILE 47 -1.450 -2.920 15.685 378 HG23 ILE 47 HG23 ILE 47 -0.193 -1.757 16.136 379 HD11 ILE 47 HD11 ILE 47 -4.195 0.186 16.187 380 HD12 ILE 47 HD12 ILE 47 -5.256 -1.159 15.730 381 HD13 ILE 47 HD13 ILE 47 -3.907 -1.451 16.852 382 H TYR 48 H TYR 48 -0.431 1.792 13.670 383 HA TYR 48 HA TYR 48 2.248 0.990 14.083 384 HB2 TYR 48 HB2 TYR 48 1.243 1.872 11.996 385 HB3 TYR 48 HB3 TYR 48 1.057 3.448 12.749 386 HD1 TYR 48 HD2 TYR 48 3.608 0.930 11.671 387 HD2 TYR 48 HD1 TYR 48 2.823 5.015 12.769 388 HE1 TYR 48 HE2 TYR 48 5.843 1.581 10.824 389 HE2 TYR 48 HE1 TYR 48 5.032 5.684 11.924 390 HH TYR 48 HH TYR 48 6.983 4.986 10.893 391 H GLN 49 H GLN 49 0.350 3.571 15.568 392 HA GLN 49 HA GLN 49 2.599 5.148 16.436 393 HB2 GLN 49 HB2 GLN 49 -0.315 5.013 17.296 394 HB3 GLN 49 HB3 GLN 49 0.832 6.237 17.868 395 HG2 GLN 49 HG2 GLN 49 1.174 7.081 15.620 396 HG3 GLN 49 HG3 GLN 49 0.248 5.754 14.923 397 HE21 GLN 49 HE22 GLN 49 -1.134 7.317 13.894 398 HE22 GLN 49 HE21 GLN 49 -2.386 8.136 14.778 399 H ARG 50 H ARG 50 1.050 2.252 17.684 400 HA ARG 50 HA ARG 50 1.974 2.574 20.436 401 HB2 ARG 50 HB2 ARG 50 0.799 0.314 18.771 402 HB3 ARG 50 HB3 ARG 50 1.520 -0.010 20.340 403 HG2 ARG 50 HG2 ARG 50 -0.838 0.257 20.638 404 HG3 ARG 50 HG3 ARG 50 -0.016 1.619 21.408 405 HD2 ARG 50 HD2 ARG 50 -0.569 3.049 19.468 406 HD3 ARG 50 HD3 ARG 50 -1.333 1.662 18.664 407 HE ARG 50 HE ARG 50 -2.466 2.030 21.269 408 HH11 ARG 50 HH11 ARG 50 -2.476 3.538 18.058 409 HH12 ARG 50 HH12 ARG 50 -4.044 4.259 18.287 410 HH21 ARG 50 HH21 ARG 50 -4.511 3.003 21.521 411 HH22 ARG 50 HH22 ARG 50 -5.191 3.958 20.214 412 H ILE 51 H ILE 51 3.378 1.734 17.426 413 HA ILE 51 HA ILE 51 5.423 -0.027 18.658 414 HB ILE 51 HB ILE 51 4.632 0.556 15.777 415 HG12 ILE 51 HG12 ILE 51 4.181 -1.893 17.542 416 HG13 ILE 51 HG13 ILE 51 2.946 -0.661 17.225 417 HG21 ILE 51 HG21 ILE 51 7.028 -0.098 16.032 418 HG22 ILE 51 HG22 ILE 51 6.506 -1.547 16.923 419 HG23 ILE 51 HG23 ILE 51 6.079 -1.342 15.203 420 HD11 ILE 51 HD11 ILE 51 2.586 -2.528 15.756 421 HD12 ILE 51 HD12 ILE 51 3.091 -1.116 14.808 422 HD13 ILE 51 HD13 ILE 51 4.258 -2.432 15.140 423 H GLN 52 H GLN 52 5.119 2.913 16.571 424 HA GLN 52 HA GLN 52 7.969 3.349 16.542 425 HB2 GLN 52 HB2 GLN 52 5.624 5.181 15.880 426 HB3 GLN 52 HB3 GLN 52 7.326 5.549 15.540 427 HG2 GLN 52 HG2 GLN 52 5.630 3.339 14.349 428 HG3 GLN 52 HG3 GLN 52 6.470 4.667 13.531 429 HE21 GLN 52 HE22 GLN 52 6.614 1.389 14.320 430 HE22 GLN 52 HE21 GLN 52 8.326 1.118 14.061 431 H ALA 53 H ALA 53 5.970 3.460 19.131 432 HA ALA 53 HA ALA 53 6.763 5.887 20.426 433 HB1 ALA 53 HB1 ALA 53 5.962 4.727 22.454 434 HB2 ALA 53 HB2 ALA 53 4.828 4.514 21.094 435 HB3 ALA 53 HB3 ALA 53 5.916 3.190 21.559 436 H GLY 54 H GLY 54 8.527 2.973 19.668 437 HA2 GLY 54 HA2 GLY 54 11.015 3.796 20.111 438 HA3 GLY 54 HA3 GLY 54 10.534 3.486 21.784 439 H LEU 55 H LEU 55 9.239 1.372 19.213 440 HA LEU 55 HA LEU 55 11.219 -0.704 19.777 441 HB2 LEU 55 HB2 LEU 55 9.513 -2.150 20.959 442 HB3 LEU 55 HB3 LEU 55 10.069 -0.733 21.845 443 HG LEU 55 HG LEU 55 7.965 0.488 21.046 444 HD11 LEU 55 HD11 LEU 55 6.040 -0.967 20.469 445 HD12 LEU 55 HD12 LEU 55 7.268 -0.974 19.199 446 HD13 LEU 55 HD13 LEU 55 7.142 -2.358 20.314 447 HD21 LEU 55 HD21 LEU 55 6.608 -0.555 22.798 448 HD22 LEU 55 HD22 LEU 55 7.687 -1.977 22.790 449 HD23 LEU 55 HD23 LEU 55 8.307 -0.389 23.298 450 H THR 56 H THR 56 10.155 -2.930 19.136 451 HA THR 56 HA THR 56 8.184 -2.744 16.952 452 HB THR 56 HB THR 56 9.642 -4.336 15.592 453 HG1 THR 56 HG1 THR 56 11.870 -4.140 16.001 454 HG21 THR 56 HG21 THR 56 9.236 -1.941 15.029 455 HG22 THR 56 HG22 THR 56 10.709 -1.506 15.931 456 HG23 THR 56 HG23 THR 56 10.825 -2.532 14.485 457 H ALA 57 H ALA 57 8.902 -3.928 19.838 458 HA ALA 57 HA ALA 57 7.267 -6.332 19.390 459 HB1 ALA 57 HB1 ALA 57 9.999 -6.406 20.736 460 HB2 ALA 57 HB2 ALA 57 8.830 -7.748 20.684 461 HB3 ALA 57 HB3 ALA 57 9.579 -7.163 19.186 462 HA PRO 58 HA PRO 58 5.415 -4.425 23.021 463 HB2 PRO 58 HB2 PRO 58 4.329 -7.228 23.178 464 HB3 PRO 58 HB3 PRO 58 3.472 -5.670 23.426 465 HG2 PRO 58 HG2 PRO 58 3.236 -7.006 21.072 466 HG3 PRO 58 HG3 PRO 58 3.500 -5.228 21.066 467 HD2 PRO 58 HD2 PRO 58 5.531 -7.433 20.627 468 HD3 PRO 58 HD3 PRO 58 5.321 -5.887 19.737 469 H ASP 59 H ASP 59 4.996 -5.124 25.346 470 HA ASP 59 HA ASP 59 7.468 -5.661 26.621 471 HB2 ASP 59 HB2 ASP 59 5.428 -4.326 27.421 472 HB3 ASP 59 HB3 ASP 59 4.661 -5.862 27.772 473 H5' U 36 H5' U 36 -4.641 10.941 -16.973 474 H5'' U 36 H5'' U 36 -5.663 10.784 -15.530 475 H4' U 36 H4' U 36 -3.117 12.462 -15.628 476 H3' U 36 H3' U 36 -2.964 9.772 -15.863 477 H2' U 36 H2' U 36 -4.611 9.279 -14.211 478 HO2' U 36 HO2' U 36 -2.670 8.114 -13.692 479 H1' U 36 H1' U 36 -3.231 11.174 -12.309 480 H3 U 36 H3 U 36 -6.427 11.396 -9.178 481 H5 U 36 H5 U 36 -8.451 9.698 -12.444 482 H6 U 36 H6 U 36 -6.447 9.959 -13.761 483 HO5' U 36 HO5' U 36 -6.348 12.482 -16.926 484 H5' C 37 H5' C 37 -0.291 9.793 -18.319 485 H5'' C 37 H5'' C 37 -1.720 9.239 -17.420 486 H4' C 37 H4' C 37 0.866 7.650 -17.465 487 H3' C 37 H3' C 37 -0.462 8.123 -19.821 488 H2' C 37 H2' C 37 -2.599 7.502 -19.104 489 HO2' C 37 HO2' C 37 -1.351 5.116 -20.005 490 H1' C 37 H1' C 37 -1.563 5.107 -17.607 491 H41 C 37 H41 C 37 -7.264 5.545 -14.844 492 H42 C 37 H42 C 37 -7.445 7.227 -15.306 493 H5 C 37 H5 C 37 -5.693 8.459 -16.506 494 H6 C 37 H6 C 37 -3.478 8.280 -17.489 495 H5' A 38 H5' A 38 2.516 8.751 -18.177 496 H5'' A 38 H5'' A 38 4.070 8.299 -18.900 497 H4' A 38 H4' A 38 4.444 8.764 -16.562 498 H3' A 38 H3' A 38 5.309 6.400 -17.654 499 H2' A 38 H2' A 38 3.293 5.193 -17.117 500 HO2' A 38 HO2' A 38 5.266 4.854 -15.120 501 H1' A 38 H1' A 38 3.483 6.423 -14.351 502 H8 A 38 H8 A 38 1.440 4.456 -16.840 503 H61 A 38 H61 A 38 -3.151 4.660 -12.670 504 H62 A 38 H62 A 38 -2.629 3.989 -14.200 505 H2 A 38 H2 A 38 0.063 7.459 -11.353 506 H5' G 39 H5' G 39 5.042 9.362 -14.506 507 H5'' G 39 H5'' G 39 6.320 10.488 -15.003 508 H4' G 39 H4' G 39 5.752 11.347 -12.949 509 H3' G 39 H3' G 39 8.253 10.337 -12.978 510 H2' G 39 H2' G 39 7.738 8.127 -12.291 511 HO2' G 39 HO2' G 39 8.109 9.614 -9.902 512 H1' G 39 H1' G 39 5.786 8.912 -10.180 513 H8 G 39 H8 G 39 3.613 7.661 -12.560 514 H1 G 39 H1 G 39 7.121 2.681 -10.551 515 H21 G 39 H21 G 39 8.934 3.385 -9.558 516 H22 G 39 H22 G 39 9.310 5.087 -9.369 517 H5' G 40 H5' G 40 7.127 11.479 -8.483 518 H5'' G 40 H5'' G 40 8.308 12.726 -8.065 519 H4' G 40 H4' G 40 7.735 11.240 -6.169 520 H3' G 40 H3' G 40 10.327 12.132 -6.765 521 H2' G 40 H2' G 40 10.739 9.970 -7.878 522 HO2' G 40 HO2' G 40 12.451 10.479 -6.452 523 H1' G 40 H1' G 40 9.368 8.980 -5.351 524 H8 G 40 H8 G 40 10.022 7.817 -9.034 525 H1 G 40 H1 G 40 11.111 3.464 -4.449 526 H21 G 40 H21 G 40 10.691 4.352 -2.449 527 H22 G 40 H22 G 40 10.117 5.990 -2.269 528 H5' A 41 H5' A 41 7.526 13.687 -3.342 529 H5'' A 41 H5'' A 41 7.283 12.589 -4.710 530 H4' A 41 H4' A 41 7.403 15.600 -5.070 531 H3' A 41 H3' A 41 5.176 13.894 -4.028 532 H2' A 41 H2' A 41 3.608 14.735 -5.547 533 HO2' A 41 HO2' A 41 3.675 16.773 -6.287 534 H1' A 41 H1' A 41 5.315 15.303 -7.691 535 H8 A 41 H8 A 41 4.635 12.063 -5.611 536 H61 A 41 H61 A 41 2.450 9.909 -11.021 537 H62 A 41 H62 A 41 2.653 9.524 -9.323 538 H2 A 41 H2 A 41 3.956 14.013 -11.677 539 H5' C 42 H5' C 42 1.741 15.033 -1.650 540 H5'' C 42 H5'' C 42 2.745 13.866 -2.525 541 H4' C 42 H4' C 42 1.554 14.246 -4.576 542 H3' C 42 H3' C 42 1.004 16.769 -3.823 543 H2' C 42 H2' C 42 -0.258 16.224 -1.882 544 HO2' C 42 HO2' C 42 -2.104 16.367 -4.041 545 H1' C 42 H1' C 42 -1.819 14.127 -3.379 546 H41 C 42 H41 C 42 -3.425 13.360 2.748 547 H42 C 42 H42 C 42 -1.769 12.977 3.173 548 H5 C 42 H5 C 42 0.066 13.081 1.547 549 H6 C 42 H6 C 42 0.618 13.587 -0.780 550 H5' A 43 H5' A 43 -1.932 15.118 -6.844 551 H5'' A 43 H5'' A 43 -2.015 15.450 -8.573 552 H4' A 43 H4' A 43 -3.785 16.537 -7.107 553 H3' A 43 H3' A 43 -2.792 17.497 -9.428 554 H2' A 43 H2' A 43 -0.849 18.514 -8.467 555 HO2' A 43 HO2' A 43 -1.210 20.741 -8.591 556 H1' A 43 H1' A 43 -2.593 19.812 -6.390 557 H8 A 43 H8 A 43 -0.832 18.302 -4.055 558 H61 A 43 H61 A 43 4.456 21.342 -5.155 559 H62 A 43 H62 A 43 3.568 20.388 -3.980 560 H2 A 43 H2 A 43 1.876 21.761 -8.733 561 H5' U 44 H5' U 44 -7.238 18.734 -6.256 562 H5'' U 44 H5'' U 44 -5.547 19.256 -6.161 563 H4' U 44 H4' U 44 -6.722 16.910 -4.593 564 H3' U 44 H3' U 44 -6.188 19.804 -3.867 565 HO3' U 44 HO3' U 44 -8.250 18.005 -3.076 566 H2' U 44 H2' U 44 -5.754 19.048 -1.612 567 HO2' U 44 HO2' U 44 -6.058 16.827 -1.092 568 H1' U 44 H1' U 44 -4.074 17.076 -2.413 569 H3 U 44 H3 U 44 -1.649 20.677 -0.914 570 H5 U 44 H5 U 44 -2.536 21.543 -4.929 571 H6 U 44 H6 U 44 -3.973 19.606 -4.975 572 H1 MET 1 H1 MET 1 0.626 -13.034 3.738 573 H2 MET 1 H2 MET 1 -0.330 -13.213 5.060 574 H3 MET 1 H3 MET 1 0.681 -11.922 4.950 575 HA MET 1 HA MET 1 -0.521 -11.042 3.088 576 HB2 MET 1 HB2 MET 1 -1.291 -13.227 2.202 577 HB3 MET 1 HB3 MET 1 -2.338 -13.427 3.623 578 HG2 MET 1 HG2 MET 1 -3.702 -12.652 1.784 579 HG3 MET 1 HG3 MET 1 -3.589 -11.374 2.977 580 HE1 MET 1 HE1 MET 1 -4.438 -9.523 1.368 581 HE2 MET 1 HE2 MET 1 -3.997 -9.489 -0.361 582 HE3 MET 1 HE3 MET 1 -4.785 -10.931 0.347 583 H LEU 2 H LEU 2 -1.893 -9.319 3.634 584 HA LEU 2 HA LEU 2 -3.631 -9.674 6.010 585 HB2 LEU 2 HB2 LEU 2 -1.335 -7.828 5.640 586 HB3 LEU 2 HB3 LEU 2 -2.836 -7.021 6.125 587 HG LEU 2 HG LEU 2 -1.529 -9.340 7.582 588 HD11 LEU 2 HD11 LEU 2 -0.996 -7.641 9.273 589 HD12 LEU 2 HD12 LEU 2 -0.279 -7.215 7.706 590 HD13 LEU 2 HD13 LEU 2 -1.740 -6.371 8.260 591 HD21 LEU 2 HD21 LEU 2 -3.979 -9.346 7.955 592 HD22 LEU 2 HD22 LEU 2 -3.153 -8.721 9.391 593 HD23 LEU 2 HD23 LEU 2 -3.949 -7.595 8.256 594 H ILE 3 H ILE 3 -5.464 -8.290 5.999 595 HA ILE 3 HA ILE 3 -5.951 -6.735 3.525 596 HB ILE 3 HB ILE 3 -7.820 -8.844 4.708 597 HG12 ILE 3 HG12 ILE 3 -7.921 -9.402 2.145 598 HG13 ILE 3 HG13 ILE 3 -6.382 -8.547 2.049 599 HG21 ILE 3 HG21 ILE 3 -8.341 -6.747 2.567 600 HG22 ILE 3 HG22 ILE 3 -9.421 -8.090 2.986 601 HG23 ILE 3 HG23 ILE 3 -9.110 -6.832 4.182 602 HD11 ILE 3 HD11 ILE 3 -7.052 -10.996 3.742 603 HD12 ILE 3 HD12 ILE 3 -6.038 -10.951 2.284 604 HD13 ILE 3 HD13 ILE 3 -5.474 -10.177 3.775 605 H LEU 4 H LEU 4 -7.318 -4.996 3.816 606 HA LEU 4 HA LEU 4 -8.321 -4.372 6.534 607 HB2 LEU 4 HB2 LEU 4 -6.422 -2.653 4.886 608 HB3 LEU 4 HB3 LEU 4 -7.304 -2.080 6.295 609 HG LEU 4 HG LEU 4 -5.222 -4.314 6.347 610 HD11 LEU 4 HD11 LEU 4 -5.156 -1.376 7.155 611 HD12 LEU 4 HD12 LEU 4 -3.876 -2.562 7.522 612 HD13 LEU 4 HD13 LEU 4 -4.239 -2.139 5.835 613 HD21 LEU 4 HD21 LEU 4 -6.702 -2.825 8.566 614 HD22 LEU 4 HD22 LEU 4 -6.878 -4.550 8.160 615 HD23 LEU 4 HD23 LEU 4 -5.342 -3.954 8.804 616 H THR 5 H THR 5 -9.765 -2.467 6.473 617 HA THR 5 HA THR 5 -10.661 -1.759 3.722 618 HB THR 5 HB THR 5 -12.696 -1.776 5.909 619 HG1 THR 5 HG1 THR 5 -11.766 -3.863 5.967 620 HG21 THR 5 HG21 THR 5 -14.118 -2.271 3.919 621 HG22 THR 5 HG22 THR 5 -13.144 -0.797 3.705 622 HG23 THR 5 HG23 THR 5 -12.637 -2.301 2.914 623 H ARG 6 H ARG 6 -9.577 0.111 3.654 624 HA ARG 6 HA ARG 6 -9.772 2.085 5.865 625 HB2 ARG 6 HB2 ARG 6 -7.580 1.239 4.785 626 HB3 ARG 6 HB3 ARG 6 -8.120 2.016 3.299 627 HG2 ARG 6 HG2 ARG 6 -6.659 3.556 4.168 628 HG3 ARG 6 HG3 ARG 6 -8.203 4.207 4.734 629 HD2 ARG 6 HD2 ARG 6 -6.396 2.366 6.371 630 HD3 ARG 6 HD3 ARG 6 -6.270 4.131 6.397 631 HE ARG 6 HE ARG 6 -8.960 3.210 6.989 632 HH11 ARG 6 HH11 ARG 6 -5.741 3.776 8.350 633 HH12 ARG 6 HH12 ARG 6 -6.343 4.072 9.962 634 HH21 ARG 6 HH21 ARG 6 -9.714 3.557 9.112 635 HH22 ARG 6 HH22 ARG 6 -8.590 3.948 10.393 636 H LYS 7 H LYS 7 -10.267 4.423 5.143 637 HA LYS 7 HA LYS 7 -11.630 4.482 2.499 638 HB2 LYS 7 HB2 LYS 7 -13.290 6.058 3.365 639 HB3 LYS 7 HB3 LYS 7 -13.465 4.437 4.028 640 HG2 LYS 7 HG2 LYS 7 -12.523 5.133 6.149 641 HG3 LYS 7 HG3 LYS 7 -12.049 6.718 5.476 642 HD2 LYS 7 HD2 LYS 7 -14.426 7.231 5.004 643 HD3 LYS 7 HD3 LYS 7 -14.911 5.681 5.709 644 HE2 LYS 7 HE2 LYS 7 -13.453 7.915 7.172 645 HE3 LYS 7 HE3 LYS 7 -15.197 7.601 7.250 646 HZ1 LYS 7 HZ1 LYS 7 -13.093 5.724 8.119 647 HZ2 LYS 7 HZ2 LYS 7 -14.046 6.623 9.108 648 HZ3 LYS 7 HZ3 LYS 7 -14.714 5.444 8.180 649 H VAL 8 H VAL 8 -12.058 6.803 1.799 650 HA VAL 8 HA VAL 8 -9.486 7.700 1.192 651 HB VAL 8 HB VAL 8 -10.455 9.477 -0.003 652 HG11 VAL 8 HG11 VAL 8 -12.343 7.072 -0.026 653 HG12 VAL 8 HG12 VAL 8 -12.091 8.218 -1.355 654 HG13 VAL 8 HG13 VAL 8 -10.761 7.154 -0.843 655 HG21 VAL 8 HG21 VAL 8 -12.054 10.413 1.590 656 HG22 VAL 8 HG22 VAL 8 -12.807 10.041 0.025 657 HG23 VAL 8 HG23 VAL 8 -13.085 8.962 1.427 658 H GLY 9 H GLY 9 -8.057 9.008 2.007 659 HA2 GLY 9 HA2 GLY 9 -7.378 11.037 3.051 660 HA3 GLY 9 HA3 GLY 9 -8.873 11.060 3.999 661 H GLU 10 H GLU 10 -7.835 7.894 4.151 662 HA GLU 10 HA GLU 10 -6.367 8.413 6.701 663 HB2 GLU 10 HB2 GLU 10 -7.980 6.005 5.801 664 HB3 GLU 10 HB3 GLU 10 -7.143 6.169 7.358 665 HG2 GLU 10 HG2 GLU 10 -9.408 7.933 6.350 666 HG3 GLU 10 HG3 GLU 10 -9.547 6.659 7.565 667 H SER 11 H SER 11 -5.066 6.144 7.226 668 HA SER 11 HA SER 11 -3.312 5.639 4.885 669 HB2 SER 11 HB2 SER 11 -2.353 6.765 7.538 670 HB3 SER 11 HB3 SER 11 -1.333 6.309 6.155 671 HG SER 11 HG SER 11 -1.791 8.551 6.220 672 H ILE 12 H ILE 12 -1.536 4.172 5.396 673 HA ILE 12 HA ILE 12 -1.993 2.162 7.513 674 HB ILE 12 HB ILE 12 -1.660 1.561 4.536 675 HG12 ILE 12 HG12 ILE 12 -4.067 1.025 6.329 676 HG13 ILE 12 HG13 ILE 12 -3.956 2.369 5.180 677 HG21 ILE 12 HG21 ILE 12 -2.032 -0.333 6.904 678 HG22 ILE 12 HG22 ILE 12 -1.998 -0.817 5.204 679 HG23 ILE 12 HG23 ILE 12 -0.548 -0.142 5.926 680 HD11 ILE 12 HD11 ILE 12 -5.205 0.570 4.171 681 HD12 ILE 12 HD12 ILE 12 -3.662 0.791 3.313 682 HD13 ILE 12 HD13 ILE 12 -3.878 -0.574 4.442 683 H ASN 13 H ASN 13 0.114 0.747 7.621 684 HA ASN 13 HA ASN 13 2.465 2.280 6.631 685 HB2 ASN 13 HB2 ASN 13 1.872 1.556 9.522 686 HB3 ASN 13 HB3 ASN 13 3.456 2.078 8.929 687 HD21 ASN 13 HD22 ASN 13 3.871 4.246 8.653 688 HD22 ASN 13 HD21 ASN 13 2.685 5.505 8.909 689 H ILE 14 H ILE 14 4.427 1.167 6.632 690 HA ILE 14 HA ILE 14 4.375 -1.752 7.114 691 HB ILE 14 HB ILE 14 5.292 -0.487 4.503 692 HG12 ILE 14 HG12 ILE 14 2.835 -2.196 5.096 693 HG13 ILE 14 HG13 ILE 14 2.825 -0.474 4.687 694 HG21 ILE 14 HG21 ILE 14 5.085 -3.406 5.363 695 HG22 ILE 14 HG22 ILE 14 5.591 -2.817 3.757 696 HG23 ILE 14 HG23 ILE 14 6.590 -2.478 5.167 697 HD11 ILE 14 HD11 ILE 14 3.885 -1.018 2.484 698 HD12 ILE 14 HD12 ILE 14 3.697 -2.748 2.866 699 HD13 ILE 14 HD13 ILE 14 2.266 -1.710 2.709 700 H GLY 15 H GLY 15 6.455 -2.603 7.550 701 HA2 GLY 15 HA2 GLY 15 8.554 -2.518 8.507 702 HA3 GLY 15 HA3 GLY 15 8.927 -1.339 7.241 703 H ASP 16 H ASP 16 10.121 0.114 8.408 704 HA ASP 16 HA ASP 16 8.652 1.645 10.499 705 HB2 ASP 16 HB2 ASP 16 11.594 0.856 10.532 706 HB3 ASP 16 HB3 ASP 16 10.811 1.952 11.675 707 H ASP 17 H ASP 17 9.507 1.759 7.439 708 HA ASP 17 HA ASP 17 10.193 4.632 7.519 709 HB2 ASP 17 HB2 ASP 17 11.668 2.613 5.775 710 HB3 ASP 17 HB3 ASP 17 11.905 4.359 5.796 711 H ILE 18 H ILE 18 7.874 2.540 6.632 712 HA ILE 18 HA ILE 18 7.401 3.993 4.079 713 HB ILE 18 HB ILE 18 6.790 1.053 4.578 714 HG12 ILE 18 HG12 ILE 18 8.427 1.029 2.441 715 HG13 ILE 18 HG13 ILE 18 9.104 2.442 3.262 716 HG21 ILE 18 HG21 ILE 18 5.142 2.081 3.127 717 HG22 ILE 18 HG22 ILE 18 6.413 2.852 2.155 718 HG23 ILE 18 HG23 ILE 18 6.225 1.082 2.153 719 HD11 ILE 18 HD11 ILE 18 8.661 -0.320 4.487 720 HD12 ILE 18 HD12 ILE 18 10.227 0.321 3.939 721 HD13 ILE 18 HD13 ILE 18 9.397 1.062 5.327 722 H THR 19 H THR 19 5.354 4.613 3.657 723 HA THR 19 HA THR 19 3.150 3.846 5.478 724 HB THR 19 HB THR 19 3.884 6.711 4.741 725 HG1 THR 19 HG1 THR 19 5.252 5.844 6.307 726 HG21 THR 19 HG21 THR 19 1.693 5.586 6.537 727 HG22 THR 19 HG22 THR 19 2.133 7.304 6.398 728 HG23 THR 19 HG23 THR 19 1.464 6.455 4.996 729 H ILE 20 H ILE 20 1.069 4.221 4.477 730 HA ILE 20 HA ILE 20 1.108 4.661 1.528 731 HB ILE 20 HB ILE 20 -0.326 2.453 3.055 732 HG12 ILE 20 HG12 ILE 20 2.097 2.008 2.791 733 HG13 ILE 20 HG13 ILE 20 1.067 0.856 1.942 734 HG21 ILE 20 HG21 ILE 20 -0.312 3.150 0.087 735 HG22 ILE 20 HG22 ILE 20 -0.979 1.649 0.776 736 HG23 ILE 20 HG23 ILE 20 -1.692 3.210 1.202 737 HD11 ILE 20 HD11 ILE 20 2.460 3.227 0.623 738 HD12 ILE 20 HD12 ILE 20 3.044 1.551 0.601 739 HD13 ILE 20 HD13 ILE 20 1.516 1.957 -0.204 740 H THR 21 H THR 21 -0.858 5.588 0.742 741 HA THR 21 HA THR 21 -2.818 6.419 2.821 742 HB THR 21 HB THR 21 -1.576 8.374 0.862 743 HG1 THR 21 HG1 THR 21 -0.410 9.121 2.665 744 HG21 THR 21 HG21 THR 21 -2.575 10.053 2.376 745 HG22 THR 21 HG22 THR 21 -3.825 8.955 1.763 746 HG23 THR 21 HG23 THR 21 -3.204 8.747 3.416 747 H ILE 22 H ILE 22 -4.871 6.780 2.049 748 HA ILE 22 HA ILE 22 -5.352 6.080 -0.800 749 HB ILE 22 HB ILE 22 -6.345 4.474 0.579 750 HG12 ILE 22 HG12 ILE 22 -8.708 4.643 0.214 751 HG13 ILE 22 HG13 ILE 22 -8.631 6.415 0.093 752 HG21 ILE 22 HG21 ILE 22 -7.443 6.715 2.314 753 HG22 ILE 22 HG22 ILE 22 -7.880 5.000 2.461 754 HG23 ILE 22 HG23 ILE 22 -6.205 5.508 2.747 755 HD11 ILE 22 HD11 ILE 22 -7.304 4.487 -1.836 756 HD12 ILE 22 HD12 ILE 22 -8.836 5.373 -2.104 757 HD13 ILE 22 HD13 ILE 22 -7.320 6.273 -1.943 758 H LEU 23 H LEU 23 -5.119 8.037 -1.795 759 HA LEU 23 HA LEU 23 -5.834 10.494 -0.529 760 HB2 LEU 23 HB2 LEU 23 -5.420 10.015 -3.495 761 HB3 LEU 23 HB3 LEU 23 -5.240 11.535 -2.615 762 HG LEU 23 HG LEU 23 -3.461 9.078 -2.473 763 HD11 LEU 23 HD11 LEU 23 -2.937 11.987 -3.228 764 HD12 LEU 23 HD12 LEU 23 -1.737 10.685 -3.230 765 HD13 LEU 23 HD13 LEU 23 -3.107 10.638 -4.368 766 HD21 LEU 23 HD21 LEU 23 -3.643 9.955 -0.189 767 HD22 LEU 23 HD22 LEU 23 -2.057 10.374 -0.888 768 HD23 LEU 23 HD23 LEU 23 -3.333 11.608 -0.782 769 H GLY 24 H GLY 24 -7.682 8.275 -2.589 770 HA2 GLY 24 HA2 GLY 24 -10.171 9.101 -1.873 771 HA3 GLY 24 HA3 GLY 24 -9.794 10.253 -3.133 772 H VAL 25 H VAL 25 -11.818 9.049 -4.011 773 HA VAL 25 HA VAL 25 -10.803 6.899 -5.799 774 HB VAL 25 HB VAL 25 -12.789 5.610 -5.601 775 HG11 VAL 25 HG11 VAL 25 -12.740 4.878 -3.279 776 HG12 VAL 25 HG12 VAL 25 -11.092 5.252 -3.826 777 HG13 VAL 25 HG13 VAL 25 -11.960 6.395 -2.778 778 HG21 VAL 25 HG21 VAL 25 -13.883 7.787 -3.788 779 HG22 VAL 25 HG22 VAL 25 -14.462 7.341 -5.419 780 HG23 VAL 25 HG23 VAL 25 -14.647 6.204 -4.080 781 H SER 26 H SER 26 -11.996 6.620 -7.757 782 HA SER 26 HA SER 26 -13.932 8.669 -8.562 783 HB2 SER 26 HB2 SER 26 -11.730 9.698 -9.083 784 HB3 SER 26 HB3 SER 26 -11.289 8.259 -10.028 785 HG SER 26 HG SER 26 -12.163 9.932 -11.333 786 H GLY 27 H GLY 27 -15.411 6.902 -8.691 787 HA2 GLY 27 HA2 GLY 27 -16.421 5.085 -9.727 788 HA3 GLY 27 HA3 GLY 27 -15.257 5.290 -11.062 789 H GLN 28 H GLN 28 -14.394 3.242 -11.377 790 HA GLN 28 HA GLN 28 -13.726 1.539 -9.094 791 HB2 GLN 28 HB2 GLN 28 -12.935 1.349 -12.035 792 HB3 GLN 28 HB3 GLN 28 -12.636 0.110 -10.803 793 HG2 GLN 28 HG2 GLN 28 -15.346 1.050 -11.789 794 HG3 GLN 28 HG3 GLN 28 -14.532 -0.497 -12.120 795 HE21 GLN 28 HE22 GLN 28 -15.985 1.482 -9.493 796 HE22 GLN 28 HE21 GLN 28 -16.326 0.130 -8.434 797 H GLN 29 H GLN 29 -12.188 4.117 -10.918 798 HA GLN 29 HA GLN 29 -9.484 3.349 -10.260 799 HB2 GLN 29 HB2 GLN 29 -10.824 5.497 -11.681 800 HB3 GLN 29 HB3 GLN 29 -9.747 6.185 -10.476 801 HG2 GLN 29 HG2 GLN 29 -8.458 5.912 -12.481 802 HG3 GLN 29 HG3 GLN 29 -7.917 4.644 -11.373 803 HE21 GLN 29 HE22 GLN 29 -10.751 4.958 -13.619 804 HE22 GLN 29 HE21 GLN 29 -10.403 3.486 -14.509 805 H VAL 30 H VAL 30 -8.197 4.106 -8.603 806 HA VAL 30 HA VAL 30 -9.491 5.432 -6.281 807 HB VAL 30 HB VAL 30 -7.876 2.837 -6.279 808 HG11 VAL 30 HG11 VAL 30 -7.354 4.302 -4.339 809 HG12 VAL 30 HG12 VAL 30 -9.095 4.400 -3.978 810 HG13 VAL 30 HG13 VAL 30 -8.241 2.840 -3.853 811 HG21 VAL 30 HG21 VAL 30 -10.235 2.473 -6.906 812 HG22 VAL 30 HG22 VAL 30 -9.934 1.877 -5.265 813 HG23 VAL 30 HG23 VAL 30 -10.763 3.434 -5.508 814 H ARG 31 H ARG 31 -8.228 7.127 -5.742 815 HA ARG 31 HA ARG 31 -5.561 7.348 -6.949 816 HB2 ARG 31 HB2 ARG 31 -7.396 9.183 -6.738 817 HB3 ARG 31 HB3 ARG 31 -6.860 9.333 -5.052 818 HG2 ARG 31 HG2 ARG 31 -4.516 9.745 -5.910 819 HG3 ARG 31 HG3 ARG 31 -5.150 9.602 -7.567 820 HD2 ARG 31 HD2 ARG 31 -6.862 11.411 -6.818 821 HD3 ARG 31 HD3 ARG 31 -5.716 11.747 -5.502 822 HE ARG 31 HE ARG 31 -4.268 11.704 -7.933 823 HH11 ARG 31 HH11 ARG 31 -6.718 13.691 -6.315 824 HH12 ARG 31 HH12 ARG 31 -6.298 15.129 -7.222 825 HH21 ARG 31 HH21 ARG 31 -3.806 13.582 -9.125 826 HH22 ARG 31 HH22 ARG 31 -4.679 15.067 -8.804 827 H ILE 32 H ILE 32 -3.696 6.989 -5.857 828 HA ILE 32 HA ILE 32 -3.897 6.395 -2.936 829 HB ILE 32 HB ILE 32 -2.470 4.590 -4.914 830 HG12 ILE 32 HG12 ILE 32 -5.313 4.393 -3.850 831 HG13 ILE 32 HG13 ILE 32 -4.768 4.481 -5.535 832 HG21 ILE 32 HG21 ILE 32 -3.383 4.162 -2.034 833 HG22 ILE 32 HG22 ILE 32 -2.485 2.994 -3.031 834 HG23 ILE 32 HG23 ILE 32 -1.711 4.496 -2.545 835 HD11 ILE 32 HD11 ILE 32 -4.362 2.165 -3.613 836 HD12 ILE 32 HD12 ILE 32 -5.393 2.207 -5.050 837 HD13 ILE 32 HD13 ILE 32 -3.631 2.271 -5.244 838 H GLY 33 H GLY 33 -1.875 6.464 -1.818 839 HA2 GLY 33 HA2 GLY 33 0.360 7.721 -3.329 840 HA3 GLY 33 HA3 GLY 33 -0.180 8.374 -1.770 841 H ILE 34 H ILE 34 2.424 7.428 -2.325 842 HA ILE 34 HA ILE 34 2.682 5.176 -0.401 843 HB ILE 34 HB ILE 34 4.131 5.417 -3.076 844 HG12 ILE 34 HG12 ILE 34 2.065 3.330 -2.263 845 HG13 ILE 34 HG13 ILE 34 1.742 4.709 -3.338 846 HG21 ILE 34 HG21 ILE 34 4.191 3.235 -0.947 847 HG22 ILE 34 HG22 ILE 34 5.099 3.218 -2.476 848 HG23 ILE 34 HG23 ILE 34 5.478 4.421 -1.237 849 HD11 ILE 34 HD11 ILE 34 3.536 3.920 -4.866 850 HD12 ILE 34 HD12 ILE 34 3.720 2.456 -3.866 851 HD13 ILE 34 HD13 ILE 34 2.185 2.774 -4.704 852 H ASN 35 H ASN 35 4.366 5.520 0.994 853 HA ASN 35 HA ASN 35 6.122 7.846 0.393 854 HB2 ASN 35 HB2 ASN 35 4.114 8.510 1.719 855 HB3 ASN 35 HB3 ASN 35 4.601 7.390 2.984 856 HD21 ASN 35 HD22 ASN 35 4.268 10.067 3.581 857 HD22 ASN 35 HD21 ASN 35 5.816 10.833 3.853 858 H ALA 36 H ALA 36 7.895 6.672 0.070 859 HA ALA 36 HA ALA 36 9.183 5.495 2.447 860 HB1 ALA 36 HB1 ALA 36 10.003 3.605 1.060 861 HB2 ALA 36 HB2 ALA 36 8.231 3.545 1.243 862 HB3 ALA 36 HB3 ALA 36 8.967 4.122 -0.274 863 HA PRO 37 HA PRO 37 12.538 7.823 0.745 864 HB2 PRO 37 HB2 PRO 37 14.680 6.141 1.307 865 HB3 PRO 37 HB3 PRO 37 13.905 7.241 2.501 866 HG2 PRO 37 HG2 PRO 37 13.472 4.270 2.095 867 HG3 PRO 37 HG3 PRO 37 13.604 5.188 3.631 868 HD2 PRO 37 HD2 PRO 37 11.209 4.440 2.589 869 HD3 PRO 37 HD3 PRO 37 11.427 6.007 3.435 870 H LYS 38 H LYS 38 13.885 7.858 -1.139 871 HA LYS 38 HA LYS 38 13.187 6.057 -3.262 872 HB2 LYS 38 HB2 LYS 38 15.324 8.171 -2.827 873 HB3 LYS 38 HB3 LYS 38 15.355 7.128 -4.258 874 HG2 LYS 38 HG2 LYS 38 14.248 9.168 -4.765 875 HG3 LYS 38 HG3 LYS 38 13.108 7.808 -4.896 876 HD2 LYS 38 HD2 LYS 38 11.966 9.726 -3.921 877 HD3 LYS 38 HD3 LYS 38 12.088 8.490 -2.711 878 HE2 LYS 38 HE2 LYS 38 14.115 9.694 -1.785 879 HE3 LYS 38 HE3 LYS 38 13.937 10.884 -3.092 880 HZ1 LYS 38 HZ1 LYS 38 12.936 11.676 -1.069 881 HZ2 LYS 38 HZ2 LYS 38 11.775 11.449 -2.202 882 HZ3 LYS 38 HZ3 LYS 38 11.953 10.363 -0.975 883 H ASP 39 H ASP 39 15.029 5.670 -0.620 884 HA ASP 39 HA ASP 39 17.186 3.968 -1.352 885 HB2 ASP 39 HB2 ASP 39 16.531 5.121 0.895 886 HB3 ASP 39 HB3 ASP 39 15.537 3.696 1.177 887 H VAL 40 H VAL 40 13.798 3.407 -1.585 888 HA VAL 40 HA VAL 40 14.277 0.497 -1.952 889 HB VAL 40 HB VAL 40 12.185 -0.042 -0.843 890 HG11 VAL 40 HG11 VAL 40 13.722 1.944 0.898 891 HG12 VAL 40 HG12 VAL 40 12.669 0.633 1.468 892 HG13 VAL 40 HG13 VAL 40 14.186 0.246 0.628 893 HG21 VAL 40 HG21 VAL 40 11.824 2.919 -0.329 894 HG22 VAL 40 HG22 VAL 40 10.910 1.957 -1.524 895 HG23 VAL 40 HG23 VAL 40 10.764 1.597 0.207 896 H ALA 41 H ALA 41 12.650 -0.489 -3.441 897 HA ALA 41 HA ALA 41 11.903 1.537 -5.469 898 HB1 ALA 41 HB1 ALA 41 13.308 -0.385 -6.176 899 HB2 ALA 41 HB2 ALA 41 12.041 -1.508 -5.616 900 HB3 ALA 41 HB3 ALA 41 11.718 -0.412 -6.974 901 H VAL 42 H VAL 42 9.799 1.833 -6.165 902 HA VAL 42 HA VAL 42 7.770 -0.138 -5.391 903 HB VAL 42 HB VAL 42 6.231 1.404 -4.434 904 HG11 VAL 42 HG11 VAL 42 8.928 2.010 -3.153 905 HG12 VAL 42 HG12 VAL 42 7.330 2.156 -2.394 906 HG13 VAL 42 HG13 VAL 42 7.944 0.555 -2.858 907 HG21 VAL 42 HG21 VAL 42 6.613 3.378 -5.742 908 HG22 VAL 42 HG22 VAL 42 6.780 3.794 -4.031 909 HG23 VAL 42 HG23 VAL 42 8.239 3.595 -5.043 910 H HIS 43 H HIS 43 6.312 -0.409 -7.004 911 HA HIS 43 HA HIS 43 5.774 1.726 -8.940 912 HB2 HIS 43 HB2 HIS 43 6.674 -0.962 -10.010 913 HB3 HIS 43 HB3 HIS 43 6.478 0.562 -10.868 914 HD2 HIS 43 HD2 HIS 43 8.948 -1.335 -8.605 915 HE1 HIS 43 HE1 HIS 43 11.063 2.000 -10.176 916 HE2 HIS 43 HE2 HIS 43 11.274 -0.149 -8.835 917 H ARG 44 H ARG 44 3.899 0.999 -10.429 918 HA ARG 44 HA ARG 44 2.056 -0.679 -8.979 919 HB2 ARG 44 HB2 ARG 44 0.643 -0.533 -10.958 920 HB3 ARG 44 HB3 ARG 44 1.252 1.061 -10.483 921 HG2 ARG 44 HG2 ARG 44 2.971 0.953 -12.249 922 HG3 ARG 44 HG3 ARG 44 2.412 -0.671 -12.707 923 HD2 ARG 44 HD2 ARG 44 0.160 0.242 -13.206 924 HD3 ARG 44 HD3 ARG 44 0.713 1.861 -12.751 925 HE ARG 44 HE ARG 44 1.184 0.485 -15.258 926 HH11 ARG 44 HH11 ARG 44 2.570 2.870 -13.033 927 HH12 ARG 44 HH12 ARG 44 3.446 3.690 -14.303 928 HH21 ARG 44 HH21 ARG 44 2.295 1.586 -16.860 929 HH22 ARG 44 HH22 ARG 44 3.290 2.982 -16.463 930 H GLU 45 H GLU 45 1.237 -2.812 -9.838 931 HA GLU 45 HA GLU 45 3.522 -4.502 -9.954 932 HB2 GLU 45 HB2 GLU 45 1.423 -5.066 -8.832 933 HB3 GLU 45 HB3 GLU 45 0.590 -5.186 -10.396 934 HG2 GLU 45 HG2 GLU 45 1.850 -7.077 -11.034 935 HG3 GLU 45 HG3 GLU 45 3.090 -6.799 -9.791 936 H GLU 46 H GLU 46 2.017 -2.790 -12.483 937 HA GLU 46 HA GLU 46 2.519 -4.638 -14.638 938 HB2 GLU 46 HB2 GLU 46 1.011 -2.624 -14.752 939 HB3 GLU 46 HB3 GLU 46 2.440 -1.585 -14.597 940 HG2 GLU 46 HG2 GLU 46 3.332 -2.457 -16.707 941 HG3 GLU 46 HG3 GLU 46 2.001 -3.622 -16.824 942 H ILE 47 H ILE 47 4.385 -1.902 -13.204 943 HA ILE 47 HA ILE 47 6.513 -2.223 -15.162 944 HB ILE 47 HB ILE 47 6.515 -0.619 -12.584 945 HG12 ILE 47 HG12 ILE 47 4.560 0.135 -13.720 946 HG13 ILE 47 HG13 ILE 47 5.834 1.322 -14.019 947 HG21 ILE 47 HG21 ILE 47 8.059 -0.339 -15.196 948 HG22 ILE 47 HG22 ILE 47 8.105 0.828 -13.855 949 HG23 ILE 47 HG23 ILE 47 8.716 -0.818 -13.617 950 HD11 ILE 47 HD11 ILE 47 4.790 -0.810 -15.928 951 HD12 ILE 47 HD12 ILE 47 4.656 0.951 -16.094 952 HD13 ILE 47 HD13 ILE 47 6.243 0.180 -16.255 953 H TYR 48 H TYR 48 5.785 -3.443 -11.958 954 HA TYR 48 HA TYR 48 8.410 -4.027 -11.073 955 HB2 TYR 48 HB2 TYR 48 6.356 -4.040 -9.703 956 HB3 TYR 48 HB3 TYR 48 5.780 -5.464 -10.568 957 HD1 TYR 48 HD1 TYR 48 8.424 -4.220 -8.256 958 HD2 TYR 48 HD2 TYR 48 6.531 -7.667 -10.005 959 HE1 TYR 48 HE1 TYR 48 9.553 -5.666 -6.604 960 HE2 TYR 48 HE2 TYR 48 7.612 -9.118 -8.342 961 HH TYR 48 HH TYR 48 9.798 -7.825 -5.801 962 H GLN 49 H GLN 49 6.326 -5.654 -13.425 963 HA GLN 49 HA GLN 49 7.793 -8.152 -13.379 964 HB2 GLN 49 HB2 GLN 49 5.808 -6.951 -15.350 965 HB3 GLN 49 HB3 GLN 49 6.418 -8.619 -15.420 966 HG2 GLN 49 HG2 GLN 49 5.476 -9.103 -13.216 967 HG3 GLN 49 HG3 GLN 49 4.968 -7.428 -13.017 968 HE21 GLN 49 HE22 GLN 49 2.835 -7.161 -13.308 969 HE22 GLN 49 HE21 GLN 49 1.835 -8.044 -14.452 970 H ARG 50 H ARG 50 8.221 -5.057 -14.960 971 HA ARG 50 HA ARG 50 10.004 -6.049 -17.069 972 HB2 ARG 50 HB2 ARG 50 9.248 -3.309 -15.958 973 HB3 ARG 50 HB3 ARG 50 10.614 -3.509 -17.044 974 HG2 ARG 50 HG2 ARG 50 8.702 -2.880 -18.352 975 HG3 ARG 50 HG3 ARG 50 9.110 -4.559 -18.744 976 HD2 ARG 50 HD2 ARG 50 7.290 -5.352 -17.289 977 HD3 ARG 50 HD3 ARG 50 6.928 -3.677 -16.810 978 HE ARG 50 HE ARG 50 6.831 -3.784 -19.632 979 HH11 ARG 50 HH11 ARG 50 5.000 -5.121 -16.911 980 HH12 ARG 50 HH12 ARG 50 3.560 -5.351 -17.876 981 HH21 ARG 50 HH21 ARG 50 4.973 -4.024 -20.797 982 HH22 ARG 50 HH22 ARG 50 3.520 -4.690 -20.077 983 H ILE 51 H ILE 51 10.207 -5.455 -13.698 984 HA ILE 51 HA ILE 51 13.095 -4.827 -13.830 985 HB ILE 51 HB ILE 51 10.989 -4.636 -11.651 986 HG12 ILE 51 HG12 ILE 51 12.580 -2.496 -13.138 987 HG13 ILE 51 HG13 ILE 51 10.952 -3.013 -13.608 988 HG21 ILE 51 HG21 ILE 51 13.224 -5.188 -10.706 989 HG22 ILE 51 HG22 ILE 51 13.920 -3.821 -11.599 990 HG23 ILE 51 HG23 ILE 51 12.731 -3.539 -10.294 991 HD11 ILE 51 HD11 ILE 51 10.083 -2.351 -11.410 992 HD12 ILE 51 HD12 ILE 51 11.703 -1.747 -10.951 993 HD13 ILE 51 HD13 ILE 51 10.808 -0.996 -12.296 994 H GLN 52 H GLN 52 10.781 -7.135 -12.271 995 HA GLN 52 HA GLN 52 12.901 -8.690 -11.103 996 HB2 GLN 52 HB2 GLN 52 9.966 -9.309 -11.627 997 HB3 GLN 52 HB3 GLN 52 11.052 -10.335 -10.679 998 HG2 GLN 52 HG2 GLN 52 10.163 -7.516 -10.039 999 HG3 GLN 52 HG3 GLN 52 9.907 -9.004 -9.102 1000 HE21 GLN 52 HE22 GLN 52 11.704 -6.201 -9.253 1001 HE22 GLN 52 HE21 GLN 52 13.118 -6.717 -8.359 1002 H ALA 53 H ALA 53 12.303 -8.268 -14.300 1003 HA ALA 53 HA ALA 53 12.476 -10.931 -15.320 1004 HB1 ALA 53 HB1 ALA 53 13.150 -9.779 -17.401 1005 HB2 ALA 53 HB2 ALA 53 11.756 -8.976 -16.637 1006 HB3 ALA 53 HB3 ALA 53 13.384 -8.271 -16.492 1007 H GLY 54 H GLY 54 14.806 -9.041 -13.586 1008 HA2 GLY 54 HA2 GLY 54 16.677 -10.883 -13.166 1009 HA3 GLY 54 HA3 GLY 54 17.102 -10.425 -14.825 1010 H LEU 55 H LEU 55 15.805 -7.880 -12.755 1011 HA LEU 55 HA LEU 55 18.451 -6.867 -12.042 1012 HB2 LEU 55 HB2 LEU 55 18.166 -4.838 -13.531 1013 HB3 LEU 55 HB3 LEU 55 18.539 -6.362 -14.326 1014 HG LEU 55 HG LEU 55 16.013 -6.629 -14.770 1015 HD11 LEU 55 HD11 LEU 55 16.102 -3.645 -14.149 1016 HD12 LEU 55 HD12 LEU 55 14.767 -4.512 -14.938 1017 HD13 LEU 55 HD13 LEU 55 15.180 -4.872 -13.245 1018 HD21 LEU 55 HD21 LEU 55 17.630 -4.410 -16.061 1019 HD22 LEU 55 HD22 LEU 55 17.689 -6.144 -16.456 1020 HD23 LEU 55 HD23 LEU 55 16.208 -5.214 -16.770 1021 H THR 56 H THR 56 17.760 -4.129 -11.778 1022 HA THR 56 HA THR 56 15.414 -4.257 -9.947 1023 HB THR 56 HB THR 56 18.086 -3.054 -9.177 1024 HG1 THR 56 HG1 THR 56 18.213 -4.860 -7.815 1025 HG21 THR 56 HG21 THR 56 15.487 -3.580 -7.670 1026 HG22 THR 56 HG22 THR 56 17.016 -3.120 -6.886 1027 HG23 THR 56 HG23 THR 56 16.221 -1.995 -8.008 1028 H ALA 57 H ALA 57 17.257 -2.448 -12.282 1029 HA ALA 57 HA ALA 57 15.168 -0.444 -12.342 1030 HB1 ALA 57 HB1 ALA 57 17.970 0.384 -11.472 1031 HB2 ALA 57 HB2 ALA 57 16.629 1.486 -11.865 1032 HB3 ALA 57 HB3 ALA 57 16.511 0.411 -10.457 1033 HA PRO 58 HA PRO 58 18.630 0.232 -15.766 1034 HB2 PRO 58 HB2 PRO 58 19.368 -2.677 -15.973 1035 HB3 PRO 58 HB3 PRO 58 20.380 -1.236 -16.317 1036 HG2 PRO 58 HG2 PRO 58 20.718 -2.592 -14.005 1037 HG3 PRO 58 HG3 PRO 58 20.633 -0.794 -13.959 1038 HD2 PRO 58 HD2 PRO 58 18.416 -2.785 -13.424 1039 HD3 PRO 58 HD3 PRO 58 18.895 -1.382 -12.429 1040 H ASP 59 H ASP 59 18.054 0.128 -17.924 1041 HA ASP 59 HA ASP 59 16.571 -0.125 -19.632 1042 HB2 ASP 59 HB2 ASP 59 18.386 -1.806 -19.852 1043 HB3 ASP 59 HB3 ASP 59 17.315 -3.019 -19.150 1044 H5' U 36 H5' U 36 -14.304 -2.435 6.851 1045 H5'' U 36 H5'' U 36 -14.040 -3.075 8.479 1046 H4' U 36 H4' U 36 -13.582 -0.754 8.587 1047 H3' U 36 H3' U 36 -15.387 -1.814 10.320 1048 H2' U 36 H2' U 36 -17.252 -1.335 8.833 1049 HO2' U 36 HO2' U 36 -17.066 0.605 10.854 1050 H1' U 36 H1' U 36 -16.056 1.429 8.570 1051 H3 U 36 H3 U 36 -19.634 2.894 6.212 1052 H5 U 36 H5 U 36 -19.033 -0.997 4.719 1053 H6 U 36 H6 U 36 -17.260 -1.277 6.336 1054 HO5' U 36 HO5' U 36 -15.986 -3.837 7.479 1055 H5' C 37 H5' C 37 -12.932 -1.008 13.199 1056 H5'' C 37 H5'' C 37 -13.512 -2.090 11.906 1057 H4' C 37 H4' C 37 -14.274 -2.297 14.854 1058 H3' C 37 H3' C 37 -11.785 -2.882 13.872 1059 H2' C 37 H2' C 37 -12.496 -4.308 12.153 1060 HO2' C 37 HO2' C 37 -11.063 -5.535 13.492 1061 H1' C 37 H1' C 37 -14.429 -5.588 14.088 1062 H41 C 37 H41 C 37 -16.387 -8.266 8.656 1063 H42 C 37 H42 C 37 -15.684 -6.978 7.698 1064 H5 C 37 H5 C 37 -14.618 -5.025 8.687 1065 H6 C 37 H6 C 37 -13.968 -3.972 10.805 1066 H5' A 38 H5' A 38 -10.762 -5.974 15.716 1067 H5'' A 38 H5'' A 38 -9.581 -5.666 16.997 1068 H4' A 38 H4' A 38 -8.571 -6.893 15.122 1069 H3' A 38 H3' A 38 -7.343 -4.809 16.379 1070 H2' A 38 H2' A 38 -8.287 -3.124 14.943 1071 HO2' A 38 HO2' A 38 -5.772 -3.875 13.848 1072 H1' A 38 H1' A 38 -7.506 -4.866 12.597 1073 H8 A 38 H8 A 38 -9.583 -1.952 13.904 1074 H61 A 38 H61 A 38 -11.174 -1.072 7.972 1075 H62 A 38 H62 A 38 -11.222 -0.404 9.593 1076 H2 A 38 H2 A 38 -9.146 -5.033 8.305 1077 H5' G 39 H5' G 39 -7.658 -8.070 13.625 1078 H5'' G 39 H5'' G 39 -7.349 -9.421 14.729 1079 H4' G 39 H4' G 39 -7.475 -10.447 12.629 1080 H3' G 39 H3' G 39 -5.107 -10.750 13.867 1081 H2' G 39 H2' G 39 -4.012 -8.816 13.064 1082 HO2' G 39 HO2' G 39 -3.518 -10.846 11.170 1083 H1' G 39 H1' G 39 -4.969 -8.949 10.256 1084 H8 G 39 H8 G 39 -7.000 -6.409 11.112 1085 H1 G 39 H1 G 39 -1.103 -4.239 12.416 1086 H21 G 39 H21 G 39 0.296 -5.890 12.558 1087 H22 G 39 H22 G 39 -0.176 -7.566 12.309 1088 H5' G 40 H5' G 40 -4.383 -11.852 9.446 1089 H5'' G 40 H5'' G 40 -4.080 -13.594 9.408 1090 H4' G 40 H4' G 40 -2.733 -12.403 7.747 1091 H3' G 40 H3' G 40 -1.707 -14.332 9.551 1092 H2' G 40 H2' G 40 -0.514 -12.618 10.762 1093 HO2' G 40 HO2' G 40 1.005 -14.193 9.896 1094 H1' G 40 H1' G 40 -0.038 -11.404 8.013 1095 H8 G 40 H8 G 40 -0.838 -10.022 11.563 1096 H1 G 40 H1 G 40 4.728 -8.057 9.045 1097 H21 G 40 H21 G 40 5.094 -9.093 7.113 1098 H22 G 40 H22 G 40 3.925 -10.185 6.422 1099 H5' A 41 H5' A 41 -3.192 -15.064 5.036 1100 H5'' A 41 H5'' A 41 -3.229 -13.622 6.063 1101 H4' A 41 H4' A 41 -5.188 -15.905 6.489 1102 H3' A 41 H3' A 41 -5.232 -13.701 4.436 1103 H2' A 41 H2' A 41 -7.469 -13.208 4.930 1104 HO2' A 41 HO2' A 41 -8.332 -15.268 4.691 1105 H1' A 41 H1' A 41 -7.455 -14.105 7.627 1106 H8 A 41 H8 A 41 -5.472 -11.330 5.707 1107 H61 A 41 H61 A 41 -8.726 -7.434 9.294 1108 H62 A 41 H62 A 41 -7.542 -7.537 8.003 1109 H2 A 41 H2 A 41 -9.891 -11.575 10.346 1110 H5' C 42 H5' C 42 -6.074 -13.343 0.729 1111 H5'' C 42 H5'' C 42 -6.231 -12.931 2.454 1112 H4' C 42 H4' C 42 -8.488 -12.599 2.358 1113 H3' C 42 H3' C 42 -8.572 -14.852 0.584 1114 H2' C 42 H2' C 42 -8.426 -13.718 -1.377 1115 HO2' C 42 HO2' C 42 -10.500 -12.863 -2.065 1116 H1' C 42 H1' C 42 -9.585 -11.113 -0.331 1117 H41 C 42 H41 C 42 -6.699 -10.264 -6.032 1118 H42 C 42 H42 C 42 -5.132 -10.561 -5.295 1119 H5 C 42 H5 C 42 -4.885 -11.182 -2.932 1120 H6 C 42 H6 C 42 -6.110 -11.704 -0.901 1121 H5' A 43 H5' A 43 -12.481 -12.780 4.272 1122 H5'' A 43 H5'' A 43 -12.242 -12.532 2.536 1123 H4' A 43 H4' A 43 -11.036 -10.742 4.682 1124 H3' A 43 H3' A 43 -13.648 -10.801 3.240 1125 H2' A 43 H2' A 43 -13.542 -8.543 2.482 1126 HO2' A 43 HO2' A 43 -12.721 -7.738 4.537 1127 H1' A 43 H1' A 43 -11.001 -8.452 1.824 1128 H8 A 43 H8 A 43 -11.725 -11.936 0.694 1129 H61 A 43 H61 A 43 -13.629 -9.266 -4.572 1130 H62 A 43 H62 A 43 -13.159 -10.776 -3.821 1131 H2 A 43 H2 A 43 -13.285 -6.108 -1.479 1132 H5' U 44 H5' U 44 -17.035 -9.709 3.866 1133 H5'' U 44 H5'' U 44 -15.605 -10.719 3.655 1134 H4' U 44 H4' U 44 -16.432 -8.563 1.642 1135 H3' U 44 H3' U 44 -16.739 -11.539 1.809 1136 HO3' U 44 HO3' U 44 -19.002 -11.046 1.408 1137 H2' U 44 H2' U 44 -17.204 -11.432 -0.596 1138 HO2' U 44 HO2' U 44 -18.266 -9.337 -0.634 1139 H1' U 44 H1' U 44 -14.922 -10.001 -0.881 1140 H3 U 44 H3 U 44 -14.575 -14.406 -2.233 1141 H5 U 44 H5 U 44 -13.867 -14.456 1.907 1142 H6 U 44 H6 U 44 -14.488 -12.123 1.992 Start of MODEL 11 1 H1 MET 1 H1 MET 1 8.536 10.286 -1.229 2 H2 MET 1 H2 MET 1 8.602 10.748 -2.801 3 H3 MET 1 H3 MET 1 8.562 9.145 -2.418 4 HA MET 1 HA MET 1 6.358 9.353 -1.530 5 HB2 MET 1 HB2 MET 1 6.596 11.748 -0.842 6 HB3 MET 1 HB3 MET 1 6.601 12.218 -2.555 7 HG2 MET 1 HG2 MET 1 4.371 12.555 -1.674 8 HG3 MET 1 HG3 MET 1 4.334 11.220 -2.813 9 HE1 MET 1 HE1 MET 1 2.161 10.152 -2.132 10 HE2 MET 1 HE2 MET 1 1.574 10.104 -0.444 11 HE3 MET 1 HE3 MET 1 1.972 11.665 -1.223 12 H LEU 2 H LEU 2 4.822 8.489 -2.926 13 HA LEU 2 HA LEU 2 4.943 9.316 -5.774 14 HB2 LEU 2 HB2 LEU 2 5.517 6.656 -4.592 15 HB3 LEU 2 HB3 LEU 2 4.297 6.616 -5.872 16 HG LEU 2 HG LEU 2 7.066 7.811 -6.139 17 HD11 LEU 2 HD11 LEU 2 7.521 5.863 -7.548 18 HD12 LEU 2 HD12 LEU 2 7.043 5.353 -5.912 19 HD13 LEU 2 HD13 LEU 2 5.878 5.233 -7.243 20 HD21 LEU 2 HD21 LEU 2 6.492 7.793 -8.583 21 HD22 LEU 2 HD22 LEU 2 4.824 7.311 -8.171 22 HD23 LEU 2 HD23 LEU 2 5.446 8.900 -7.681 23 H ILE 3 H ILE 3 2.974 9.036 -6.900 24 HA ILE 3 HA ILE 3 0.599 8.279 -5.291 25 HB ILE 3 HB ILE 3 0.919 10.843 -6.920 26 HG12 ILE 3 HG12 ILE 3 -0.085 11.709 -4.636 27 HG13 ILE 3 HG13 ILE 3 0.590 10.220 -3.973 28 HG21 ILE 3 HG21 ILE 3 -1.537 9.668 -5.560 29 HG22 ILE 3 HG22 ILE 3 -1.428 11.278 -6.289 30 HG23 ILE 3 HG23 ILE 3 -1.303 9.843 -7.323 31 HD11 ILE 3 HD11 ILE 3 2.081 12.423 -5.460 32 HD12 ILE 3 HD12 ILE 3 2.119 12.120 -3.707 33 HD13 ILE 3 HD13 ILE 3 2.853 10.950 -4.822 34 H LEU 4 H LEU 4 -1.061 7.384 -6.525 35 HA LEU 4 HA LEU 4 -0.609 6.902 -9.412 36 HB2 LEU 4 HB2 LEU 4 -0.903 4.751 -7.267 37 HB3 LEU 4 HB3 LEU 4 -0.985 4.454 -9.003 38 HG LEU 4 HG LEU 4 1.474 5.538 -7.553 39 HD11 LEU 4 HD11 LEU 4 2.340 3.234 -7.943 40 HD12 LEU 4 HD12 LEU 4 0.931 3.262 -6.863 41 HD13 LEU 4 HD13 LEU 4 0.737 2.759 -8.558 42 HD21 LEU 4 HD21 LEU 4 1.400 6.172 -9.949 43 HD22 LEU 4 HD22 LEU 4 2.618 4.917 -9.672 44 HD23 LEU 4 HD23 LEU 4 1.048 4.486 -10.387 45 H THR 5 H THR 5 -2.567 5.807 -10.370 46 HA THR 5 HA THR 5 -4.940 5.882 -8.594 47 HB THR 5 HB THR 5 -5.233 6.791 -11.461 48 HG1 THR 5 HG1 THR 5 -3.764 8.233 -10.544 49 HG21 THR 5 HG21 THR 5 -7.172 6.112 -10.002 50 HG22 THR 5 HG22 THR 5 -6.717 7.399 -8.871 51 HG23 THR 5 HG23 THR 5 -7.239 7.814 -10.526 52 H ARG 6 H ARG 6 -5.024 3.750 -8.357 53 HA ARG 6 HA ARG 6 -4.941 1.954 -10.728 54 HB2 ARG 6 HB2 ARG 6 -3.454 1.867 -8.521 55 HB3 ARG 6 HB3 ARG 6 -4.908 1.203 -7.788 56 HG2 ARG 6 HG2 ARG 6 -3.558 -0.628 -8.368 57 HG3 ARG 6 HG3 ARG 6 -4.848 -0.611 -9.579 58 HD2 ARG 6 HD2 ARG 6 -2.155 0.721 -10.055 59 HD3 ARG 6 HD3 ARG 6 -2.417 -1.001 -10.381 60 HE ARG 6 HE ARG 6 -4.448 -0.039 -11.765 61 HH11 ARG 6 HH11 ARG 6 -1.124 1.150 -11.674 62 HH12 ARG 6 HH12 ARG 6 -1.185 1.796 -13.302 63 HH21 ARG 6 HH21 ARG 6 -4.511 0.800 -13.858 64 HH22 ARG 6 HH22 ARG 6 -3.120 1.598 -14.542 65 H LYS 7 H LYS 7 -6.649 0.099 -10.677 66 HA LYS 7 HA LYS 7 -9.034 0.955 -9.106 67 HB2 LYS 7 HB2 LYS 7 -10.497 0.146 -10.889 68 HB3 LYS 7 HB3 LYS 7 -9.568 1.552 -11.375 69 HG2 LYS 7 HG2 LYS 7 -8.042 0.148 -12.674 70 HG3 LYS 7 HG3 LYS 7 -8.839 -1.335 -12.064 71 HD2 LYS 7 HD2 LYS 7 -10.998 -0.479 -13.054 72 HD3 LYS 7 HD3 LYS 7 -10.073 0.837 -13.800 73 HE2 LYS 7 HE2 LYS 7 -9.718 -2.154 -14.276 74 HE3 LYS 7 HE3 LYS 7 -10.431 -0.981 -15.395 75 HZ1 LYS 7 HZ1 LYS 7 -8.277 0.139 -15.440 76 HZ2 LYS 7 HZ2 LYS 7 -7.636 -1.042 -14.485 77 HZ3 LYS 7 HZ3 LYS 7 -8.181 -1.414 -15.982 78 H VAL 8 H VAL 8 -10.735 -0.837 -9.066 79 HA VAL 8 HA VAL 8 -9.563 -2.670 -7.287 80 HB VAL 8 HB VAL 8 -11.709 -3.608 -6.986 81 HG11 VAL 8 HG11 VAL 8 -11.970 -0.631 -7.631 82 HG12 VAL 8 HG12 VAL 8 -13.010 -1.558 -6.542 83 HG13 VAL 8 HG13 VAL 8 -11.292 -1.308 -6.133 84 HG21 VAL 8 HG21 VAL 8 -12.629 -2.175 -9.496 85 HG22 VAL 8 HG22 VAL 8 -12.494 -3.944 -9.268 86 HG23 VAL 8 HG23 VAL 8 -13.658 -3.025 -8.302 87 H GLY 9 H GLY 9 -8.744 -4.608 -7.385 88 HA2 GLY 9 HA2 GLY 9 -8.644 -6.844 -8.177 89 HA3 GLY 9 HA3 GLY 9 -9.241 -6.317 -9.762 90 H GLU 10 H GLU 10 -6.990 -4.018 -8.907 91 HA GLU 10 HA GLU 10 -4.863 -5.412 -10.463 92 HB2 GLU 10 HB2 GLU 10 -5.428 -2.474 -9.952 93 HB3 GLU 10 HB3 GLU 10 -4.080 -3.091 -10.931 94 HG2 GLU 10 HG2 GLU 10 -5.674 -4.169 -12.472 95 HG3 GLU 10 HG3 GLU 10 -7.035 -3.590 -11.497 96 H SER 11 H SER 11 -2.576 -4.198 -9.823 97 HA SER 11 HA SER 11 -2.324 -4.301 -6.869 98 HB2 SER 11 HB2 SER 11 -0.853 -6.128 -8.814 99 HB3 SER 11 HB3 SER 11 -0.501 -5.978 -7.081 100 HG SER 11 HG SER 11 -1.905 -7.735 -7.575 101 H ILE 12 H ILE 12 -0.080 -3.922 -6.166 102 HA ILE 12 HA ILE 12 1.605 -2.245 -7.922 103 HB ILE 12 HB ILE 12 0.597 -1.357 -5.182 104 HG12 ILE 12 HG12 ILE 12 -0.223 -0.323 -7.938 105 HG13 ILE 12 HG13 ILE 12 -1.231 -1.283 -6.844 106 HG21 ILE 12 HG21 ILE 12 2.224 0.147 -7.285 107 HG22 ILE 12 HG22 ILE 12 1.668 0.795 -5.726 108 HG23 ILE 12 HG23 ILE 12 2.852 -0.491 -5.742 109 HD11 ILE 12 HD11 ILE 12 -1.865 1.020 -6.630 110 HD12 ILE 12 HD12 ILE 12 -1.069 0.510 -5.127 111 HD13 ILE 12 HD13 ILE 12 -0.198 1.517 -6.309 112 H ASN 13 H ASN 13 3.803 -1.892 -6.685 113 HA ASN 13 HA ASN 13 4.297 -4.107 -4.761 114 HB2 ASN 13 HB2 ASN 13 5.721 -3.654 -7.414 115 HB3 ASN 13 HB3 ASN 13 6.365 -4.664 -6.115 116 HD21 ASN 13 HD22 ASN 13 5.442 -6.675 -5.649 117 HD22 ASN 13 HD21 ASN 13 4.271 -7.428 -6.707 118 H ILE 14 H ILE 14 6.230 -3.949 -3.576 119 HA ILE 14 HA ILE 14 7.703 -1.384 -3.668 120 HB ILE 14 HB ILE 14 6.427 -2.523 -1.146 121 HG12 ILE 14 HG12 ILE 14 5.728 -0.021 -2.739 122 HG13 ILE 14 HG13 ILE 14 4.737 -1.486 -2.636 123 HG21 ILE 14 HG21 ILE 14 8.006 0.039 -1.625 124 HG22 ILE 14 HG22 ILE 14 7.281 -0.469 -0.080 125 HG23 ILE 14 HG23 ILE 14 8.600 -1.404 -0.769 126 HD11 ILE 14 HD11 ILE 14 5.405 0.397 -0.347 127 HD12 ILE 14 HD12 ILE 14 3.828 0.148 -1.118 128 HD13 ILE 14 HD13 ILE 14 4.564 -1.161 -0.163 129 H GLY 15 H GLY 15 9.807 -1.561 -2.763 130 HA2 GLY 15 HA2 GLY 15 11.812 -2.659 -2.428 131 HA3 GLY 15 HA3 GLY 15 10.885 -3.737 -1.374 132 H ASP 16 H ASP 16 11.813 -5.658 -1.928 133 HA ASP 16 HA ASP 16 11.258 -6.647 -4.678 134 HB2 ASP 16 HB2 ASP 16 13.713 -7.182 -2.969 135 HB3 ASP 16 HB3 ASP 16 13.336 -8.004 -4.492 136 H ASP 17 H ASP 17 10.123 -6.726 -1.722 137 HA ASP 17 HA ASP 17 9.480 -9.607 -1.753 138 HB2 ASP 17 HB2 ASP 17 10.650 -8.142 0.643 139 HB3 ASP 17 HB3 ASP 17 9.973 -9.768 0.677 140 H ILE 18 H ILE 18 8.181 -6.631 -1.951 141 HA ILE 18 HA ILE 18 5.922 -7.402 -0.174 142 HB ILE 18 HB ILE 18 6.896 -4.550 -0.630 143 HG12 ILE 18 HG12 ILE 18 7.148 -4.821 2.001 144 HG13 ILE 18 HG13 ILE 18 7.413 -6.519 1.595 145 HG21 ILE 18 HG21 ILE 18 4.698 -5.746 1.106 146 HG22 ILE 18 HG22 ILE 18 5.245 -4.053 1.167 147 HG23 ILE 18 HG23 ILE 18 4.489 -4.672 -0.298 148 HD11 ILE 18 HD11 ILE 18 8.919 -4.139 0.414 149 HD12 ILE 18 HD12 ILE 18 9.524 -5.174 1.724 150 HD13 ILE 18 HD13 ILE 18 9.295 -5.849 0.096 151 H THR 19 H THR 19 3.867 -6.963 -0.924 152 HA THR 19 HA THR 19 3.553 -5.772 -3.613 153 HB THR 19 HB THR 19 2.414 -8.478 -2.782 154 HG1 THR 19 HG1 THR 19 3.837 -9.274 -4.333 155 HG21 THR 19 HG21 THR 19 0.903 -7.340 -4.317 156 HG22 THR 19 HG22 THR 19 2.266 -6.895 -5.381 157 HG23 THR 19 HG23 THR 19 1.774 -8.599 -5.201 158 H ILE 20 H ILE 20 1.363 -5.071 -3.984 159 HA ILE 20 HA ILE 20 -0.400 -4.890 -1.592 160 HB ILE 20 HB ILE 20 0.416 -2.632 -3.472 161 HG12 ILE 20 HG12 ILE 20 2.177 -3.177 -1.815 162 HG13 ILE 20 HG13 ILE 20 1.506 -1.556 -1.639 163 HG21 ILE 20 HG21 ILE 20 -1.512 -2.681 -1.116 164 HG22 ILE 20 HG22 ILE 20 -0.927 -1.195 -1.905 165 HG23 ILE 20 HG23 ILE 20 -1.902 -2.354 -2.818 166 HD11 ILE 20 HD11 ILE 20 1.849 -2.703 0.547 167 HD12 ILE 20 HD12 ILE 20 0.154 -2.259 0.272 168 HD13 ILE 20 HD13 ILE 20 0.679 -3.948 0.057 169 H THR 21 H THR 21 -2.626 -4.777 -2.136 170 HA THR 21 HA THR 21 -3.316 -4.888 -5.022 171 HB THR 21 HB THR 21 -4.253 -6.959 -3.000 172 HG1 THR 21 HG1 THR 21 -2.353 -7.170 -5.089 173 HG21 THR 21 HG21 THR 21 -5.089 -8.144 -4.985 174 HG22 THR 21 HG22 THR 21 -5.819 -6.525 -4.906 175 HG23 THR 21 HG23 THR 21 -4.490 -6.850 -6.042 176 H ILE 22 H ILE 22 -5.378 -4.160 -5.475 177 HA ILE 22 HA ILE 22 -6.844 -2.894 -3.223 178 HB ILE 22 HB ILE 22 -6.100 -1.233 -4.693 179 HG12 ILE 22 HG12 ILE 22 -8.054 -0.230 -5.623 180 HG13 ILE 22 HG13 ILE 22 -8.896 -1.785 -5.738 181 HG21 ILE 22 HG21 ILE 22 -6.439 -1.257 -7.141 182 HG22 ILE 22 HG22 ILE 22 -5.366 -2.542 -6.581 183 HG23 ILE 22 HG23 ILE 22 -7.052 -2.924 -7.022 184 HD11 ILE 22 HD11 ILE 22 -8.950 -1.991 -3.311 185 HD12 ILE 22 HD12 ILE 22 -8.063 -0.445 -3.144 186 HD13 ILE 22 HD13 ILE 22 -9.700 -0.471 -3.848 187 H LEU 23 H LEU 23 -8.112 -4.574 -2.518 188 HA LEU 23 HA LEU 23 -9.143 -6.552 -4.289 189 HB2 LEU 23 HB2 LEU 23 -10.196 -5.888 -1.527 190 HB3 LEU 23 HB3 LEU 23 -10.290 -7.427 -2.382 191 HG LEU 23 HG LEU 23 -7.838 -6.123 -1.160 192 HD11 LEU 23 HD11 LEU 23 -9.277 -8.775 -0.740 193 HD12 LEU 23 HD12 LEU 23 -7.820 -8.236 0.132 194 HD13 LEU 23 HD13 LEU 23 -9.363 -7.365 0.339 195 HD21 LEU 23 HD21 LEU 23 -7.121 -7.169 -3.291 196 HD22 LEU 23 HD22 LEU 23 -6.558 -8.104 -1.886 197 HD23 LEU 23 HD23 LEU 23 -7.952 -8.678 -2.821 198 H GLY 24 H GLY 24 -10.468 -3.446 -3.181 199 HA2 GLY 24 HA2 GLY 24 -12.264 -3.084 -5.188 200 HA3 GLY 24 HA3 GLY 24 -13.184 -4.105 -4.102 201 H VAL 25 H VAL 25 -14.532 -2.002 -4.278 202 HA VAL 25 HA VAL 25 -13.828 -0.295 -1.945 203 HB VAL 25 HB VAL 25 -14.468 1.717 -3.052 204 HG11 VAL 25 HG11 VAL 25 -12.782 1.948 -4.801 205 HG12 VAL 25 HG12 VAL 25 -12.144 0.962 -3.466 206 HG13 VAL 25 HG13 VAL 25 -12.677 0.185 -4.977 207 HG21 VAL 25 HG21 VAL 25 -16.305 0.955 -4.411 208 HG22 VAL 25 HG22 VAL 25 -15.137 1.798 -5.428 209 HG23 VAL 25 HG23 VAL 25 -15.198 0.021 -5.465 210 H SER 26 H SER 26 -15.650 0.868 -1.057 211 HA SER 26 HA SER 26 -18.368 -0.009 -1.779 212 HB2 SER 26 HB2 SER 26 -17.137 -0.488 0.973 213 HB3 SER 26 HB3 SER 26 -18.862 -0.652 0.576 214 HG SER 26 HG SER 26 -17.763 -2.640 0.484 215 H GLY 27 H GLY 27 -18.667 2.208 -2.343 216 HA2 GLY 27 HA2 GLY 27 -19.409 4.349 -1.842 217 HA3 GLY 27 HA3 GLY 27 -19.320 3.936 -0.115 218 H GLN 28 H GLN 28 -17.606 4.695 1.094 219 HA GLN 28 HA GLN 28 -15.393 6.030 -0.408 220 HB2 GLN 28 HB2 GLN 28 -16.221 6.328 2.515 221 HB3 GLN 28 HB3 GLN 28 -14.912 7.188 1.708 222 HG2 GLN 28 HG2 GLN 28 -17.879 7.501 1.296 223 HG3 GLN 28 HG3 GLN 28 -16.662 8.698 1.812 224 HE21 GLN 28 HE22 GLN 28 -14.704 8.716 -0.001 225 HE22 GLN 28 HE21 GLN 28 -15.287 8.930 -1.640 226 H GLN 29 H GLN 29 -16.265 3.319 1.617 227 HA GLN 29 HA GLN 29 -13.628 2.907 2.694 228 HB2 GLN 29 HB2 GLN 29 -16.021 1.048 2.334 229 HB3 GLN 29 HB3 GLN 29 -14.469 0.541 3.002 230 HG2 GLN 29 HG2 GLN 29 -15.778 1.040 4.886 231 HG3 GLN 29 HG3 GLN 29 -14.641 2.375 4.712 232 HE21 GLN 29 HE22 GLN 29 -15.421 4.441 4.451 233 HE22 GLN 29 HE21 GLN 29 -17.129 4.815 4.248 234 H VAL 30 H VAL 30 -12.085 1.393 2.011 235 HA VAL 30 HA VAL 30 -12.245 0.411 -0.779 236 HB VAL 30 HB VAL 30 -9.976 2.039 0.446 237 HG11 VAL 30 HG11 VAL 30 -9.255 0.222 -1.110 238 HG12 VAL 30 HG12 VAL 30 -10.293 0.938 -2.366 239 HG13 VAL 30 HG13 VAL 30 -8.912 1.854 -1.729 240 HG21 VAL 30 HG21 VAL 30 -11.930 2.694 -1.804 241 HG22 VAL 30 HG22 VAL 30 -11.834 3.503 -0.218 242 HG23 VAL 30 HG23 VAL 30 -10.500 3.659 -1.377 243 H ARG 31 H ARG 31 -11.894 -1.738 -0.606 244 HA ARG 31 HA ARG 31 -10.568 -2.759 1.814 245 HB2 ARG 31 HB2 ARG 31 -12.713 -3.731 0.769 246 HB3 ARG 31 HB3 ARG 31 -11.668 -4.407 -0.500 247 HG2 ARG 31 HG2 ARG 31 -10.326 -5.567 1.247 248 HG3 ARG 31 HG3 ARG 31 -11.334 -4.818 2.504 249 HD2 ARG 31 HD2 ARG 31 -13.334 -5.909 1.370 250 HD3 ARG 31 HD3 ARG 31 -12.170 -6.893 0.452 251 HE ARG 31 HE ARG 31 -12.437 -6.829 3.441 252 HH11 ARG 31 HH11 ARG 31 -11.677 -8.638 0.496 253 HH12 ARG 31 HH12 ARG 31 -11.314 -10.110 1.374 254 HH21 ARG 31 HH21 ARG 31 -12.001 -8.741 4.530 255 HH22 ARG 31 HH22 ARG 31 -11.470 -10.160 3.670 256 H ILE 32 H ILE 32 -8.513 -3.333 1.873 257 HA ILE 32 HA ILE 32 -6.991 -3.419 -0.697 258 HB ILE 32 HB ILE 32 -5.959 -2.039 1.798 259 HG12 ILE 32 HG12 ILE 32 -7.595 -0.823 -0.455 260 HG13 ILE 32 HG13 ILE 32 -7.965 -0.851 1.277 261 HG21 ILE 32 HG21 ILE 32 -4.338 -2.746 0.022 262 HG22 ILE 32 HG22 ILE 32 -5.255 -1.781 -1.159 263 HG23 ILE 32 HG23 ILE 32 -4.414 -0.992 0.196 264 HD11 ILE 32 HD11 ILE 32 -5.701 0.676 -0.059 265 HD12 ILE 32 HD12 ILE 32 -7.165 1.348 0.684 266 HD13 ILE 32 HD13 ILE 32 -5.940 0.559 1.708 267 H GLY 33 H GLY 33 -4.978 -4.591 -0.579 268 HA2 GLY 33 HA2 GLY 33 -4.696 -6.341 1.817 269 HA3 GLY 33 HA3 GLY 33 -4.676 -7.013 0.178 270 H ILE 34 H ILE 34 -2.611 -7.244 2.073 271 HA ILE 34 HA ILE 34 -0.355 -5.891 0.694 272 HB ILE 34 HB ILE 34 -0.686 -5.988 3.732 273 HG12 ILE 34 HG12 ILE 34 -0.388 -3.379 3.272 274 HG13 ILE 34 HG13 ILE 34 -1.162 -3.776 1.734 275 HG21 ILE 34 HG21 ILE 34 1.382 -4.604 3.697 276 HG22 ILE 34 HG22 ILE 34 1.635 -6.228 3.042 277 HG23 ILE 34 HG23 ILE 34 1.480 -4.843 1.938 278 HD11 ILE 34 HD11 ILE 34 -2.819 -3.079 3.426 279 HD12 ILE 34 HD12 ILE 34 -3.079 -4.788 3.025 280 HD13 ILE 34 HD13 ILE 34 -2.249 -4.353 4.533 281 H ASN 35 H ASN 35 1.533 -7.105 0.709 282 HA ASN 35 HA ASN 35 1.392 -9.759 2.020 283 HB2 ASN 35 HB2 ASN 35 0.402 -9.796 -0.310 284 HB3 ASN 35 HB3 ASN 35 1.992 -9.369 -0.934 285 HD21 ASN 35 HD22 ASN 35 0.409 -11.780 -1.445 286 HD22 ASN 35 HD21 ASN 35 1.327 -13.150 -0.859 287 H ALA 36 H ALA 36 3.115 -9.649 3.306 288 HA ALA 36 HA ALA 36 5.778 -9.074 2.138 289 HB1 ALA 36 HB1 ALA 36 4.951 -6.894 2.987 290 HB2 ALA 36 HB2 ALA 36 4.605 -7.649 4.564 291 HB3 ALA 36 HB3 ALA 36 6.283 -7.523 3.990 292 HA PRO 37 HA PRO 37 7.008 -12.292 4.912 293 HB2 PRO 37 HB2 PRO 37 9.549 -11.410 5.594 294 HB3 PRO 37 HB3 PRO 37 9.136 -12.195 4.024 295 HG2 PRO 37 HG2 PRO 37 9.417 -9.256 4.680 296 HG3 PRO 37 HG3 PRO 37 10.042 -10.148 3.252 297 HD2 PRO 37 HD2 PRO 37 7.744 -8.692 3.142 298 HD3 PRO 37 HD3 PRO 37 7.895 -10.254 2.277 299 H LYS 38 H LYS 38 7.389 -12.724 7.180 300 HA LYS 38 HA LYS 38 6.389 -10.661 8.954 301 HB2 LYS 38 HB2 LYS 38 7.589 -13.425 9.456 302 HB3 LYS 38 HB3 LYS 38 6.847 -12.419 10.718 303 HG2 LYS 38 HG2 LYS 38 5.392 -13.260 8.168 304 HG3 LYS 38 HG3 LYS 38 5.296 -14.160 9.693 305 HD2 LYS 38 HD2 LYS 38 4.690 -11.185 9.665 306 HD3 LYS 38 HD3 LYS 38 3.508 -12.314 9.026 307 HE2 LYS 38 HE2 LYS 38 4.764 -12.534 11.799 308 HE3 LYS 38 HE3 LYS 38 3.232 -11.713 11.466 309 HZ1 LYS 38 HZ1 LYS 38 3.772 -14.557 10.938 310 HZ2 LYS 38 HZ2 LYS 38 2.855 -13.957 12.170 311 HZ3 LYS 38 HZ3 LYS 38 2.367 -13.768 10.611 312 H ASP 39 H ASP 39 9.303 -11.044 7.518 313 HA ASP 39 HA ASP 39 11.104 -10.143 9.591 314 HB2 ASP 39 HB2 ASP 39 11.139 -9.992 6.552 315 HB3 ASP 39 HB3 ASP 39 12.468 -9.435 7.567 316 H VAL 40 H VAL 40 8.451 -8.682 8.087 317 HA VAL 40 HA VAL 40 9.293 -6.006 9.021 318 HB VAL 40 HB VAL 40 8.419 -4.930 7.039 319 HG11 VAL 40 HG11 VAL 40 10.297 -7.175 6.194 320 HG12 VAL 40 HG12 VAL 40 10.062 -5.634 5.361 321 HG13 VAL 40 HG13 VAL 40 10.805 -5.658 6.982 322 HG21 VAL 40 HG21 VAL 40 6.692 -6.647 6.460 323 HG22 VAL 40 HG22 VAL 40 7.685 -6.143 5.076 324 HG23 VAL 40 HG23 VAL 40 8.006 -7.702 5.864 325 H ALA 41 H ALA 41 7.231 -4.520 9.010 326 HA ALA 41 HA ALA 41 5.026 -6.202 10.115 327 HB1 ALA 41 HB1 ALA 41 6.030 -3.483 11.044 328 HB2 ALA 41 HB2 ALA 41 4.715 -4.439 11.774 329 HB3 ALA 41 HB3 ALA 41 6.387 -5.040 11.829 330 H VAL 42 H VAL 42 2.891 -5.168 10.119 331 HA VAL 42 HA VAL 42 2.429 -2.863 8.394 332 HB VAL 42 HB VAL 42 2.517 -4.361 6.609 333 HG11 VAL 42 HG11 VAL 42 1.431 -6.598 6.576 334 HG12 VAL 42 HG12 VAL 42 2.740 -6.468 7.758 335 HG13 VAL 42 HG13 VAL 42 1.047 -6.413 8.306 336 HG21 VAL 42 HG21 VAL 42 0.384 -3.100 6.623 337 HG22 VAL 42 HG22 VAL 42 0.236 -4.693 5.824 338 HG23 VAL 42 HG23 VAL 42 -0.401 -4.470 7.458 339 H HIS 43 H HIS 43 0.775 -1.729 9.246 340 HA HIS 43 HA HIS 43 -1.462 -3.093 10.594 341 HB2 HIS 43 HB2 HIS 43 0.028 -0.948 12.118 342 HB3 HIS 43 HB3 HIS 43 -1.187 -2.083 12.702 343 HD2 HIS 43 HD2 HIS 43 2.554 -1.752 11.954 344 HE1 HIS 43 HE1 HIS 43 2.055 -5.414 14.064 345 HE2 HIS 43 HE2 HIS 43 3.756 -3.749 13.162 346 H ARG 44 H ARG 44 -3.083 -1.357 11.416 347 HA ARG 44 HA ARG 44 -3.338 0.837 9.537 348 HB2 ARG 44 HB2 ARG 44 -5.295 -0.258 10.567 349 HB3 ARG 44 HB3 ARG 44 -4.761 0.267 12.184 350 HG2 ARG 44 HG2 ARG 44 -5.088 2.593 11.612 351 HG3 ARG 44 HG3 ARG 44 -5.255 2.198 9.890 352 HD2 ARG 44 HD2 ARG 44 -7.437 2.696 10.744 353 HD3 ARG 44 HD3 ARG 44 -7.350 0.969 10.385 354 HE ARG 44 HE ARG 44 -7.563 0.486 12.665 355 HH11 ARG 44 HH11 ARG 44 -7.043 3.973 12.250 356 HH12 ARG 44 HH12 ARG 44 -7.646 4.351 13.846 357 HH21 ARG 44 HH21 ARG 44 -8.336 1.046 14.743 358 HH22 ARG 44 HH22 ARG 44 -8.285 2.712 15.265 359 H GLU 45 H GLU 45 -3.207 3.167 10.188 360 HA GLU 45 HA GLU 45 -0.733 3.655 11.432 361 HB2 GLU 45 HB2 GLU 45 -1.560 6.077 11.514 362 HB3 GLU 45 HB3 GLU 45 -1.440 5.285 9.944 363 HG2 GLU 45 HG2 GLU 45 -3.444 6.597 10.024 364 HG3 GLU 45 HG3 GLU 45 -3.834 4.884 9.873 365 H GLU 46 H GLU 46 -3.772 3.025 12.985 366 HA GLU 46 HA GLU 46 -3.381 4.548 15.361 367 HB2 GLU 46 HB2 GLU 46 -5.463 3.325 14.526 368 HB3 GLU 46 HB3 GLU 46 -4.690 1.812 15.008 369 HG2 GLU 46 HG2 GLU 46 -6.114 2.387 16.819 370 HG3 GLU 46 HG3 GLU 46 -4.505 2.842 17.372 371 H ILE 47 H ILE 47 -2.499 1.185 14.463 372 HA ILE 47 HA ILE 47 -1.380 0.624 17.085 373 HB ILE 47 HB ILE 47 -1.046 -0.930 14.502 374 HG12 ILE 47 HG12 ILE 47 -3.402 -0.570 14.649 375 HG13 ILE 47 HG13 ILE 47 -3.068 -2.214 15.181 376 HG21 ILE 47 HG21 ILE 47 0.345 -1.699 16.359 377 HG22 ILE 47 HG22 ILE 47 -1.067 -1.755 17.439 378 HG23 ILE 47 HG23 ILE 47 -0.947 -2.870 16.058 379 HD11 ILE 47 HD11 ILE 47 -4.735 -1.178 16.642 380 HD12 ILE 47 HD12 ILE 47 -3.247 -1.471 17.560 381 HD13 ILE 47 HD13 ILE 47 -3.644 0.175 16.990 382 H TYR 48 H TYR 48 -0.217 1.831 14.001 383 HA TYR 48 HA TYR 48 2.539 1.124 14.264 384 HB2 TYR 48 HB2 TYR 48 1.327 1.754 12.185 385 HB3 TYR 48 HB3 TYR 48 1.188 3.404 12.784 386 HD1 TYR 48 HD2 TYR 48 3.620 0.784 11.717 387 HD2 TYR 48 HD1 TYR 48 2.999 4.953 12.588 388 HE1 TYR 48 HE2 TYR 48 5.794 1.331 10.658 389 HE2 TYR 48 HE1 TYR 48 5.129 5.515 11.507 390 HH TYR 48 HH TYR 48 6.988 4.705 10.384 391 H GLN 49 H GLN 49 0.585 3.817 15.505 392 HA GLN 49 HA GLN 49 2.807 5.535 16.126 393 HB2 GLN 49 HB2 GLN 49 -0.097 5.436 17.030 394 HB3 GLN 49 HB3 GLN 49 1.028 6.725 17.514 395 HG2 GLN 49 HG2 GLN 49 1.359 7.422 15.235 396 HG3 GLN 49 HG3 GLN 49 0.547 5.989 14.605 397 HE21 GLN 49 HE22 GLN 49 -1.388 6.416 13.775 398 HE22 GLN 49 HE21 GLN 49 -2.517 7.622 14.330 399 H ARG 50 H ARG 50 1.383 2.754 17.710 400 HA ARG 50 HA ARG 50 2.507 3.340 20.367 401 HB2 ARG 50 HB2 ARG 50 1.087 0.990 19.060 402 HB3 ARG 50 HB3 ARG 50 1.970 0.785 20.572 403 HG2 ARG 50 HG2 ARG 50 -0.317 1.196 21.126 404 HG3 ARG 50 HG3 ARG 50 0.620 2.621 21.596 405 HD2 ARG 50 HD2 ARG 50 -0.109 3.786 19.549 406 HD3 ARG 50 HD3 ARG 50 -0.991 2.331 19.033 407 HE ARG 50 HE ARG 50 -1.843 3.110 21.653 408 HH11 ARG 50 HH11 ARG 50 -2.138 4.117 18.281 409 HH12 ARG 50 HH12 ARG 50 -3.651 4.951 18.536 410 HH21 ARG 50 HH21 ARG 50 -3.816 4.220 21.966 411 HH22 ARG 50 HH22 ARG 50 -4.594 5.006 20.611 412 H ILE 51 H ILE 51 3.668 2.146 17.358 413 HA ILE 51 HA ILE 51 5.699 0.437 18.672 414 HB ILE 51 HB ILE 51 4.734 0.736 15.805 415 HG12 ILE 51 HG12 ILE 51 4.486 -1.589 17.764 416 HG13 ILE 51 HG13 ILE 51 3.236 -0.353 17.583 417 HG21 ILE 51 HG21 ILE 51 6.136 -1.217 15.295 418 HG22 ILE 51 HG22 ILE 51 7.146 0.107 15.904 419 HG23 ILE 51 HG23 ILE 51 6.720 -1.253 16.978 420 HD11 ILE 51 HD11 ILE 51 4.216 -2.201 15.376 421 HD12 ILE 51 HD12 ILE 51 2.669 -2.295 16.246 422 HD13 ILE 51 HD13 ILE 51 3.006 -0.906 15.191 423 H GLN 52 H GLN 52 5.414 3.186 16.332 424 HA GLN 52 HA GLN 52 8.278 3.481 16.142 425 HB2 GLN 52 HB2 GLN 52 6.004 5.360 15.405 426 HB3 GLN 52 HB3 GLN 52 7.698 5.597 14.955 427 HG2 GLN 52 HG2 GLN 52 5.855 3.357 14.081 428 HG3 GLN 52 HG3 GLN 52 6.673 4.581 13.088 429 HE21 GLN 52 HE22 GLN 52 6.762 1.376 14.008 430 HE22 GLN 52 HE21 GLN 52 8.453 1.037 13.723 431 H ALA 53 H ALA 53 6.404 3.954 18.802 432 HA ALA 53 HA ALA 53 7.287 6.504 19.735 433 HB1 ALA 53 HB1 ALA 53 6.432 4.001 21.248 434 HB2 ALA 53 HB2 ALA 53 6.531 5.643 21.930 435 HB3 ALA 53 HB3 ALA 53 5.350 5.281 20.651 436 H GLY 54 H GLY 54 9.007 3.510 19.306 437 HA2 GLY 54 HA2 GLY 54 11.510 4.394 19.722 438 HA3 GLY 54 HA3 GLY 54 10.991 4.141 21.397 439 H LEU 55 H LEU 55 9.704 1.928 18.953 440 HA LEU 55 HA LEU 55 11.684 -0.140 19.551 441 HB2 LEU 55 HB2 LEU 55 9.970 -1.545 20.778 442 HB3 LEU 55 HB3 LEU 55 10.578 -0.131 21.635 443 HG LEU 55 HG LEU 55 8.483 1.126 20.848 444 HD11 LEU 55 HD11 LEU 55 7.554 -1.727 20.317 445 HD12 LEU 55 HD12 LEU 55 6.511 -0.285 20.414 446 HD13 LEU 55 HD13 LEU 55 7.691 -0.430 19.100 447 HD21 LEU 55 HD21 LEU 55 7.176 0.186 22.689 448 HD22 LEU 55 HD22 LEU 55 8.233 -1.251 22.713 449 HD23 LEU 55 HD23 LEU 55 8.890 0.349 23.121 450 H THR 56 H THR 56 10.368 -2.399 19.011 451 HA THR 56 HA THR 56 8.709 -2.003 16.591 452 HB THR 56 HB THR 56 11.121 -3.842 16.522 453 HG1 THR 56 HG1 THR 56 10.874 -1.188 15.561 454 HG21 THR 56 HG21 THR 56 9.240 -2.688 14.419 455 HG22 THR 56 HG22 THR 56 10.752 -3.551 14.035 456 HG23 THR 56 HG23 THR 56 9.433 -4.396 14.856 457 H ALA 57 H ALA 57 9.030 -3.368 19.558 458 HA ALA 57 HA ALA 57 7.182 -5.568 18.924 459 HB1 ALA 57 HB1 ALA 57 9.868 -6.005 20.286 460 HB2 ALA 57 HB2 ALA 57 8.567 -7.212 20.143 461 HB3 ALA 57 HB3 ALA 57 9.388 -6.617 18.683 462 HA PRO 58 HA PRO 58 6.042 -3.010 22.617 463 HB2 PRO 58 HB2 PRO 58 3.457 -4.229 21.665 464 HB3 PRO 58 HB3 PRO 58 3.752 -2.593 22.347 465 HG2 PRO 58 HG2 PRO 58 3.490 -2.921 19.663 466 HG3 PRO 58 HG3 PRO 58 4.807 -1.884 20.299 467 HD2 PRO 58 HD2 PRO 58 4.975 -4.758 19.370 468 HD3 PRO 58 HD3 PRO 58 6.084 -3.400 19.017 469 H ASP 59 H ASP 59 4.472 -3.644 24.440 470 HA ASP 59 HA ASP 59 5.461 -5.918 25.779 471 HB2 ASP 59 HB2 ASP 59 4.588 -3.852 26.772 472 HB3 ASP 59 HB3 ASP 59 2.940 -4.281 26.267 473 H5' U 36 H5' U 36 -4.964 9.552 -17.304 474 H5'' U 36 H5'' U 36 -5.997 9.644 -15.864 475 H4' U 36 H4' U 36 -3.519 11.374 -16.286 476 H3' U 36 H3' U 36 -3.244 8.696 -15.978 477 H2' U 36 H2' U 36 -4.910 8.484 -14.289 478 HO2' U 36 HO2' U 36 -2.915 7.529 -13.530 479 H1' U 36 H1' U 36 -3.622 10.743 -12.774 480 H3 U 36 H3 U 36 -6.929 11.578 -9.839 481 H5 U 36 H5 U 36 -8.795 9.096 -12.675 482 H6 U 36 H6 U 36 -6.765 9.120 -13.967 483 HO5' U 36 HO5' U 36 -6.734 10.992 -17.568 484 H5' C 37 H5' C 37 -0.528 8.595 -18.473 485 H5'' C 37 H5'' C 37 -1.945 8.046 -17.554 486 H4' C 37 H4' C 37 0.752 6.640 -17.406 487 H3' C 37 H3' C 37 -0.594 6.735 -19.787 488 H2' C 37 H2' C 37 -2.700 6.134 -18.961 489 HO2' C 37 HO2' C 37 -1.380 3.712 -19.652 490 H1' C 37 H1' C 37 -1.517 3.942 -17.264 491 H41 C 37 H41 C 37 -7.197 4.314 -14.464 492 H42 C 37 H42 C 37 -7.491 5.925 -15.091 493 H5 C 37 H5 C 37 -5.834 7.134 -16.439 494 H6 C 37 H6 C 37 -3.621 6.987 -17.437 495 H5' A 38 H5' A 38 2.577 7.625 -18.190 496 H5'' A 38 H5'' A 38 4.103 6.954 -18.805 497 H4' A 38 H4' A 38 4.452 7.759 -16.551 498 H3' A 38 H3' A 38 5.260 5.245 -17.288 499 H2' A 38 H2' A 38 3.160 4.223 -16.651 500 HO2' A 38 HO2' A 38 4.941 4.012 -14.441 501 H1' A 38 H1' A 38 3.415 5.787 -14.069 502 H8 A 38 H8 A 38 1.327 3.534 -16.224 503 H61 A 38 H61 A 38 -3.314 4.551 -12.240 504 H62 A 38 H62 A 38 -2.769 3.570 -13.580 505 H2 A 38 H2 A 38 -0.046 7.445 -11.349 506 H5' G 39 H5' G 39 5.061 8.681 -14.648 507 H5'' G 39 H5'' G 39 6.418 9.671 -15.214 508 H4' G 39 H4' G 39 5.718 10.780 -13.292 509 H3' G 39 H3' G 39 8.243 9.875 -13.162 510 H2' G 39 H2' G 39 7.798 7.729 -12.277 511 HO2' G 39 HO2' G 39 8.120 9.444 -10.047 512 H1' G 39 H1' G 39 5.768 8.609 -10.280 513 H8 G 39 H8 G 39 3.553 7.106 -12.330 514 H1 G 39 H1 G 39 7.618 2.431 -10.690 515 H21 G 39 H21 G 39 9.463 3.274 -9.891 516 H22 G 39 H22 G 39 9.717 5.001 -9.710 517 H5' G 40 H5' G 40 7.046 11.071 -8.775 518 H5'' G 40 H5'' G 40 8.079 12.452 -8.400 519 H4' G 40 H4' G 40 7.689 11.022 -6.449 520 H3' G 40 H3' G 40 10.228 12.001 -7.253 521 H2' G 40 H2' G 40 10.920 9.775 -7.894 522 HO2' G 40 HO2' G 40 11.471 10.126 -5.117 523 H1' G 40 H1' G 40 9.348 8.889 -5.447 524 H8 G 40 H8 G 40 9.980 7.555 -9.047 525 H1 G 40 H1 G 40 11.732 3.603 -4.307 526 H21 G 40 H21 G 40 11.403 4.588 -2.343 527 H22 G 40 H22 G 40 10.708 6.190 -2.220 528 H5' A 41 H5' A 41 7.400 13.919 -3.959 529 H5'' A 41 H5'' A 41 7.153 12.648 -5.171 530 H4' A 41 H4' A 41 7.072 15.603 -5.901 531 H3' A 41 H3' A 41 5.017 13.905 -4.549 532 H2' A 41 H2' A 41 3.339 14.463 -6.084 533 HO2' A 41 HO2' A 41 3.642 16.739 -5.837 534 H1' A 41 H1' A 41 4.976 15.024 -8.323 535 H8 A 41 H8 A 41 4.313 11.896 -6.078 536 H61 A 41 H61 A 41 2.223 9.389 -11.375 537 H62 A 41 H62 A 41 2.408 9.108 -9.652 538 H2 A 41 H2 A 41 3.731 13.439 -12.273 539 H5' C 42 H5' C 42 1.932 14.879 -1.818 540 H5'' C 42 H5'' C 42 2.824 13.765 -2.863 541 H4' C 42 H4' C 42 1.152 13.949 -4.607 542 H3' C 42 H3' C 42 0.644 16.482 -3.969 543 H2' C 42 H2' C 42 -0.010 15.959 -1.673 544 HO2' C 42 HO2' C 42 -2.348 16.162 -3.297 545 H1' C 42 H1' C 42 -1.838 13.923 -2.967 546 H41 C 42 H41 C 42 -2.994 13.134 3.297 547 H42 C 42 H42 C 42 -1.340 12.599 3.557 548 H5 C 42 H5 C 42 0.325 12.561 1.770 549 H6 C 42 H6 C 42 0.716 13.090 -0.580 550 H5' A 43 H5' A 43 0.556 18.349 -5.773 551 H5'' A 43 H5'' A 43 -0.583 17.804 -4.527 552 H4' A 43 H4' A 43 -2.300 19.215 -6.001 553 H3' A 43 H3' A 43 -0.270 20.297 -7.305 554 H2' A 43 H2' A 43 1.234 20.331 -5.408 555 HO2' A 43 HO2' A 43 1.247 22.429 -6.372 556 H1' A 43 H1' A 43 -0.689 21.766 -3.635 557 H8 A 43 H8 A 43 -0.617 18.356 -2.530 558 H61 A 43 H61 A 43 4.631 19.461 0.597 559 H62 A 43 H62 A 43 3.295 18.343 0.386 560 H2 A 43 H2 A 43 4.012 22.792 -2.262 561 H5' U 44 H5' U 44 -4.033 18.853 -6.836 562 H5'' U 44 H5'' U 44 -5.533 19.783 -6.913 563 H4' U 44 H4' U 44 -5.737 18.043 -5.225 564 H3' U 44 H3' U 44 -5.399 20.780 -3.945 565 HO3' U 44 HO3' U 44 -7.218 20.622 -5.323 566 H2' U 44 H2' U 44 -6.025 19.656 -1.918 567 HO2' U 44 HO2' U 44 -7.716 18.361 -2.895 568 H1' U 44 H1' U 44 -4.514 17.397 -2.479 569 H3 U 44 H3 U 44 -2.308 19.141 1.055 570 H5 U 44 H5 U 44 -2.010 22.167 -1.844 571 H6 U 44 H6 U 44 -3.364 20.824 -3.317 572 H1 MET 1 H1 MET 1 0.845 -11.668 4.654 573 H2 MET 1 H2 MET 1 0.932 -12.723 3.394 574 H3 MET 1 H3 MET 1 -0.006 -13.072 4.704 575 HA MET 1 HA MET 1 -0.446 -10.865 2.816 576 HB2 MET 1 HB2 MET 1 -0.966 -13.114 1.877 577 HB3 MET 1 HB3 MET 1 -2.021 -13.426 3.274 578 HG2 MET 1 HG2 MET 1 -3.363 -12.714 1.374 579 HG3 MET 1 HG3 MET 1 -3.437 -11.511 2.655 580 HE1 MET 1 HE1 MET 1 -3.884 -9.520 -0.640 581 HE2 MET 1 HE2 MET 1 -4.409 -11.186 -0.282 582 HE3 MET 1 HE3 MET 1 -4.549 -9.931 0.967 583 H LEU 2 H LEU 2 -1.850 -9.295 3.508 584 HA LEU 2 HA LEU 2 -3.642 -9.916 5.778 585 HB2 LEU 2 HB2 LEU 2 -1.347 -8.150 5.877 586 HB3 LEU 2 HB3 LEU 2 -2.814 -7.166 5.939 587 HG LEU 2 HG LEU 2 -1.857 -9.271 7.875 588 HD11 LEU 2 HD11 LEU 2 -2.110 -7.486 9.484 589 HD12 LEU 2 HD12 LEU 2 -1.092 -6.962 8.134 590 HD13 LEU 2 HD13 LEU 2 -2.779 -6.403 8.228 591 HD21 LEU 2 HD21 LEU 2 -4.216 -9.828 7.589 592 HD22 LEU 2 HD22 LEU 2 -3.896 -9.099 9.141 593 HD23 LEU 2 HD23 LEU 2 -4.659 -8.111 7.856 594 H ILE 3 H ILE 3 -5.513 -8.522 5.835 595 HA ILE 3 HA ILE 3 -5.936 -6.829 3.427 596 HB ILE 3 HB ILE 3 -7.851 -8.956 4.487 597 HG12 ILE 3 HG12 ILE 3 -7.692 -9.562 1.935 598 HG13 ILE 3 HG13 ILE 3 -6.137 -8.706 1.996 599 HG21 ILE 3 HG21 ILE 3 -8.180 -6.876 2.287 600 HG22 ILE 3 HG22 ILE 3 -9.290 -8.221 2.594 601 HG23 ILE 3 HG23 ILE 3 -9.094 -6.956 3.818 602 HD11 ILE 3 HD11 ILE 3 -7.054 -11.060 3.688 603 HD12 ILE 3 HD12 ILE 3 -5.911 -11.146 2.318 604 HD13 ILE 3 HD13 ILE 3 -5.430 -10.328 3.803 605 H LEU 4 H LEU 4 -7.400 -5.115 3.775 606 HA LEU 4 HA LEU 4 -8.296 -4.560 6.547 607 HB2 LEU 4 HB2 LEU 4 -6.499 -2.753 4.879 608 HB3 LEU 4 HB3 LEU 4 -7.203 -2.340 6.440 609 HG LEU 4 HG LEU 4 -5.153 -4.555 5.996 610 HD11 LEU 4 HD11 LEU 4 -3.632 -2.900 7.052 611 HD12 LEU 4 HD12 LEU 4 -4.327 -2.269 5.541 612 HD13 LEU 4 HD13 LEU 4 -4.993 -1.729 7.093 613 HD21 LEU 4 HD21 LEU 4 -6.224 -3.249 8.548 614 HD22 LEU 4 HD22 LEU 4 -6.603 -4.903 8.013 615 HD23 LEU 4 HD23 LEU 4 -4.942 -4.478 8.459 616 H THR 5 H THR 5 -9.583 -2.451 6.570 617 HA THR 5 HA THR 5 -10.406 -1.588 3.867 618 HB THR 5 HB THR 5 -12.537 -1.912 5.990 619 HG1 THR 5 HG1 THR 5 -11.659 -3.780 4.044 620 HG21 THR 5 HG21 THR 5 -12.938 -0.433 4.082 621 HG22 THR 5 HG22 THR 5 -12.487 -1.743 2.959 622 HG23 THR 5 HG23 THR 5 -13.958 -1.880 3.958 623 H ARG 6 H ARG 6 -9.579 0.356 3.858 624 HA ARG 6 HA ARG 6 -10.035 2.239 6.131 625 HB2 ARG 6 HB2 ARG 6 -8.171 2.198 3.719 626 HB3 ARG 6 HB3 ARG 6 -8.357 3.622 4.744 627 HG2 ARG 6 HG2 ARG 6 -7.818 1.116 6.250 628 HG3 ARG 6 HG3 ARG 6 -6.522 1.608 5.142 629 HD2 ARG 6 HD2 ARG 6 -6.172 2.610 7.346 630 HD3 ARG 6 HD3 ARG 6 -6.484 3.857 6.128 631 HE ARG 6 HE ARG 6 -8.978 3.392 7.182 632 HH11 ARG 6 HH11 ARG 6 -5.809 4.202 8.530 633 HH12 ARG 6 HH12 ARG 6 -6.464 4.965 9.954 634 HH21 ARG 6 HH21 ARG 6 -9.824 4.407 9.068 635 HH22 ARG 6 HH22 ARG 6 -8.737 5.131 10.229 636 H LYS 7 H LYS 7 -10.371 4.616 5.227 637 HA LYS 7 HA LYS 7 -11.827 4.529 2.656 638 HB2 LYS 7 HB2 LYS 7 -13.458 6.182 3.428 639 HB3 LYS 7 HB3 LYS 7 -13.648 4.654 4.275 640 HG2 LYS 7 HG2 LYS 7 -12.512 5.589 6.249 641 HG3 LYS 7 HG3 LYS 7 -12.168 7.097 5.352 642 HD2 LYS 7 HD2 LYS 7 -14.641 7.362 4.978 643 HD3 LYS 7 HD3 LYS 7 -14.919 5.994 6.074 644 HE2 LYS 7 HE2 LYS 7 -13.470 8.578 6.787 645 HE3 LYS 7 HE3 LYS 7 -15.157 8.224 7.163 646 HZ1 LYS 7 HZ1 LYS 7 -14.414 6.356 8.482 647 HZ2 LYS 7 HZ2 LYS 7 -12.834 6.690 8.144 648 HZ3 LYS 7 HZ3 LYS 7 -13.727 7.748 9.024 649 H VAL 8 H VAL 8 -12.235 6.913 1.875 650 HA VAL 8 HA VAL 8 -9.625 7.730 1.234 651 HB VAL 8 HB VAL 8 -10.577 9.529 0.021 652 HG11 VAL 8 HG11 VAL 8 -12.445 7.105 -0.034 653 HG12 VAL 8 HG12 VAL 8 -12.185 8.250 -1.358 654 HG13 VAL 8 HG13 VAL 8 -10.860 7.188 -0.829 655 HG21 VAL 8 HG21 VAL 8 -12.944 10.063 0.009 656 HG22 VAL 8 HG22 VAL 8 -13.220 8.989 1.412 657 HG23 VAL 8 HG23 VAL 8 -12.216 10.454 1.577 658 H GLY 9 H GLY 9 -8.212 9.126 1.927 659 HA2 GLY 9 HA2 GLY 9 -7.493 11.122 2.986 660 HA3 GLY 9 HA3 GLY 9 -8.966 11.135 3.978 661 H GLU 10 H GLU 10 -7.948 7.974 4.052 662 HA GLU 10 HA GLU 10 -6.507 8.417 6.621 663 HB2 GLU 10 HB2 GLU 10 -7.992 5.990 5.553 664 HB3 GLU 10 HB3 GLU 10 -7.212 6.130 7.143 665 HG2 GLU 10 HG2 GLU 10 -9.529 7.847 6.150 666 HG3 GLU 10 HG3 GLU 10 -9.655 6.495 7.277 667 H SER 11 H SER 11 -5.151 6.207 7.107 668 HA SER 11 HA SER 11 -3.471 5.552 4.771 669 HB2 SER 11 HB2 SER 11 -1.416 6.156 6.152 670 HB3 SER 11 HB3 SER 11 -2.361 7.495 5.480 671 HG SER 11 HG SER 11 -1.822 7.805 7.697 672 H ILE 12 H ILE 12 -1.697 4.129 5.353 673 HA ILE 12 HA ILE 12 -2.129 2.217 7.579 674 HB ILE 12 HB ILE 12 -1.996 1.605 4.592 675 HG12 ILE 12 HG12 ILE 12 -4.250 2.117 5.350 676 HG13 ILE 12 HG13 ILE 12 -4.104 0.402 4.970 677 HG21 ILE 12 HG21 ILE 12 -1.750 -0.290 6.957 678 HG22 ILE 12 HG22 ILE 12 -2.119 -0.810 5.298 679 HG23 ILE 12 HG23 ILE 12 -0.576 -0.011 5.646 680 HD11 ILE 12 HD11 ILE 12 -3.789 -0.055 7.450 681 HD12 ILE 12 HD12 ILE 12 -4.153 1.654 7.748 682 HD13 ILE 12 HD13 ILE 12 -5.375 0.605 7.010 683 H ASN 13 H ASN 13 -0.072 0.773 7.705 684 HA ASN 13 HA ASN 13 2.303 2.299 6.739 685 HB2 ASN 13 HB2 ASN 13 1.758 1.437 9.606 686 HB3 ASN 13 HB3 ASN 13 3.255 2.171 9.022 687 HD21 ASN 13 HD22 ASN 13 3.301 4.441 8.572 688 HD22 ASN 13 HD21 ASN 13 1.955 5.483 9.009 689 H ILE 14 H ILE 14 4.265 1.136 6.714 690 HA ILE 14 HA ILE 14 4.135 -1.790 7.137 691 HB ILE 14 HB ILE 14 5.086 -0.507 4.549 692 HG12 ILE 14 HG12 ILE 14 2.534 -2.075 5.129 693 HG13 ILE 14 HG13 ILE 14 2.629 -0.357 4.716 694 HG21 ILE 14 HG21 ILE 14 4.704 -3.422 5.353 695 HG22 ILE 14 HG22 ILE 14 5.255 -2.840 3.761 696 HG23 ILE 14 HG23 ILE 14 6.270 -2.586 5.177 697 HD11 ILE 14 HD11 ILE 14 3.348 -2.684 2.900 698 HD12 ILE 14 HD12 ILE 14 1.980 -1.564 2.749 699 HD13 ILE 14 HD13 ILE 14 3.634 -0.972 2.502 700 H GLY 15 H GLY 15 6.188 -2.706 7.546 701 HA2 GLY 15 HA2 GLY 15 8.330 -2.716 8.413 702 HA3 GLY 15 HA3 GLY 15 8.691 -1.483 7.192 703 H ASP 16 H ASP 16 9.953 -0.116 8.376 704 HA ASP 16 HA ASP 16 8.577 1.372 10.554 705 HB2 ASP 16 HB2 ASP 16 11.502 0.523 10.463 706 HB3 ASP 16 HB3 ASP 16 10.784 1.598 11.671 707 H ASP 17 H ASP 17 9.344 1.562 7.479 708 HA ASP 17 HA ASP 17 10.104 4.413 7.591 709 HB2 ASP 17 HB2 ASP 17 11.574 2.333 5.913 710 HB3 ASP 17 HB3 ASP 17 11.815 4.083 5.846 711 H ILE 18 H ILE 18 7.747 2.373 6.651 712 HA ILE 18 HA ILE 18 7.365 3.842 4.088 713 HB ILE 18 HB ILE 18 6.655 0.927 4.551 714 HG12 ILE 18 HG12 ILE 18 8.366 0.843 2.485 715 HG13 ILE 18 HG13 ILE 18 9.064 2.231 3.325 716 HG21 ILE 18 HG21 ILE 18 6.453 2.755 2.121 717 HG22 ILE 18 HG22 ILE 18 6.187 0.997 2.097 718 HG23 ILE 18 HG23 ILE 18 5.106 2.041 3.029 719 HD11 ILE 18 HD11 ILE 18 8.461 -0.493 4.565 720 HD12 ILE 18 HD12 ILE 18 10.065 0.054 4.032 721 HD13 ILE 18 HD13 ILE 18 9.259 0.859 5.400 722 H THR 19 H THR 19 5.318 4.498 3.619 723 HA THR 19 HA THR 19 3.090 3.799 5.443 724 HB THR 19 HB THR 19 3.963 6.636 4.736 725 HG1 THR 19 HG1 THR 19 5.181 5.670 6.386 726 HG21 THR 19 HG21 THR 19 1.533 6.543 4.857 727 HG22 THR 19 HG22 THR 19 1.614 5.600 6.374 728 HG23 THR 19 HG23 THR 19 2.155 7.293 6.336 729 H ILE 20 H ILE 20 1.022 4.238 4.482 730 HA ILE 20 HA ILE 20 1.009 4.658 1.532 731 HB ILE 20 HB ILE 20 -0.452 2.499 3.116 732 HG12 ILE 20 HG12 ILE 20 1.955 2.003 2.785 733 HG13 ILE 20 HG13 ILE 20 0.883 0.859 1.968 734 HG21 ILE 20 HG21 ILE 20 -0.493 3.197 0.152 735 HG22 ILE 20 HG22 ILE 20 -1.163 1.704 0.845 736 HG23 ILE 20 HG23 ILE 20 -1.851 3.279 1.299 737 HD11 ILE 20 HD11 ILE 20 1.285 1.932 -0.187 738 HD12 ILE 20 HD12 ILE 20 2.275 3.194 0.594 739 HD13 ILE 20 HD13 ILE 20 2.830 1.506 0.577 740 H THR 21 H THR 21 -0.881 5.712 0.805 741 HA THR 21 HA THR 21 -2.859 6.503 2.884 742 HB THR 21 HB THR 21 -1.513 8.471 0.993 743 HG1 THR 21 HG1 THR 21 -0.062 7.764 2.563 744 HG21 THR 21 HG21 THR 21 -2.572 10.164 2.430 745 HG22 THR 21 HG22 THR 21 -3.814 9.098 1.759 746 HG23 THR 21 HG23 THR 21 -3.281 8.886 3.444 747 H ILE 22 H ILE 22 -4.921 6.904 2.090 748 HA ILE 22 HA ILE 22 -5.357 6.232 -0.774 749 HB ILE 22 HB ILE 22 -6.415 4.615 0.548 750 HG12 ILE 22 HG12 ILE 22 -8.802 4.903 0.217 751 HG13 ILE 22 HG13 ILE 22 -8.605 6.659 0.033 752 HG21 ILE 22 HG21 ILE 22 -7.934 5.105 2.432 753 HG22 ILE 22 HG22 ILE 22 -6.265 5.604 2.745 754 HG23 ILE 22 HG23 ILE 22 -7.494 6.826 2.324 755 HD11 ILE 22 HD11 ILE 22 -7.393 4.591 -1.821 756 HD12 ILE 22 HD12 ILE 22 -8.870 5.550 -2.129 757 HD13 ILE 22 HD13 ILE 22 -7.298 6.365 -1.983 758 H LEU 23 H LEU 23 -5.153 8.180 -1.790 759 HA LEU 23 HA LEU 23 -5.883 10.652 -0.556 760 HB2 LEU 23 HB2 LEU 23 -5.572 10.148 -3.534 761 HB3 LEU 23 HB3 LEU 23 -5.399 11.669 -2.668 762 HG LEU 23 HG LEU 23 -3.513 9.292 -2.686 763 HD11 LEU 23 HD11 LEU 23 -3.300 10.983 -4.477 764 HD12 LEU 23 HD12 LEU 23 -3.210 12.273 -3.259 765 HD13 LEU 23 HD13 LEU 23 -1.912 11.062 -3.363 766 HD21 LEU 23 HD21 LEU 23 -3.476 11.673 -0.795 767 HD22 LEU 23 HD22 LEU 23 -3.608 9.960 -0.346 768 HD23 LEU 23 HD23 LEU 23 -2.103 10.577 -1.084 769 H GLY 24 H GLY 24 -7.711 8.373 -2.590 770 HA2 GLY 24 HA2 GLY 24 -10.224 9.092 -1.848 771 HA3 GLY 24 HA3 GLY 24 -9.886 10.302 -3.070 772 H VAL 25 H VAL 25 -11.861 9.091 -3.999 773 HA VAL 25 HA VAL 25 -10.824 6.979 -5.821 774 HB VAL 25 HB VAL 25 -12.799 5.666 -5.620 775 HG11 VAL 25 HG11 VAL 25 -12.700 4.906 -3.317 776 HG12 VAL 25 HG12 VAL 25 -11.061 5.331 -3.863 777 HG13 VAL 25 HG13 VAL 25 -11.958 6.431 -2.794 778 HG21 VAL 25 HG21 VAL 25 -14.477 7.401 -5.387 779 HG22 VAL 25 HG22 VAL 25 -14.638 6.225 -4.077 780 HG23 VAL 25 HG23 VAL 25 -13.881 7.801 -3.750 781 H SER 26 H SER 26 -12.074 6.690 -7.762 782 HA SER 26 HA SER 26 -13.992 8.767 -8.541 783 HB2 SER 26 HB2 SER 26 -11.773 9.765 -9.079 784 HB3 SER 26 HB3 SER 26 -11.376 8.328 -10.052 785 HG SER 26 HG SER 26 -12.254 10.056 -11.306 786 H GLY 27 H GLY 27 -15.493 7.025 -8.669 787 HA2 GLY 27 HA2 GLY 27 -16.527 5.227 -9.700 788 HA3 GLY 27 HA3 GLY 27 -15.352 5.386 -11.028 789 H GLN 28 H GLN 28 -14.465 3.331 -11.285 790 HA GLN 28 HA GLN 28 -13.894 1.682 -8.927 791 HB2 GLN 28 HB2 GLN 28 -13.050 1.325 -11.842 792 HB3 GLN 28 HB3 GLN 28 -12.837 0.149 -10.544 793 HG2 GLN 28 HG2 GLN 28 -15.395 1.063 -11.836 794 HG3 GLN 28 HG3 GLN 28 -14.721 -0.580 -11.682 795 HE21 GLN 28 HE22 GLN 28 -14.263 -1.077 -9.110 796 HE22 GLN 28 HE21 GLN 28 -15.647 -0.736 -8.087 797 H GLN 29 H GLN 29 -12.293 4.190 -10.720 798 HA GLN 29 HA GLN 29 -9.599 3.349 -10.127 799 HB2 GLN 29 HB2 GLN 29 -10.916 5.544 -11.500 800 HB3 GLN 29 HB3 GLN 29 -9.778 6.185 -10.320 801 HG2 GLN 29 HG2 GLN 29 -8.574 5.881 -12.377 802 HG3 GLN 29 HG3 GLN 29 -8.026 4.600 -11.283 803 HE21 GLN 29 HE22 GLN 29 -10.977 4.903 -13.366 804 HE22 GLN 29 HE21 GLN 29 -10.673 3.428 -14.260 805 H VAL 30 H VAL 30 -8.250 4.056 -8.467 806 HA VAL 30 HA VAL 30 -9.484 5.416 -6.133 807 HB VAL 30 HB VAL 30 -7.956 2.769 -6.163 808 HG11 VAL 30 HG11 VAL 30 -9.130 4.309 -3.822 809 HG12 VAL 30 HG12 VAL 30 -8.265 2.752 -3.754 810 HG13 VAL 30 HG13 VAL 30 -7.395 4.233 -4.219 811 HG21 VAL 30 HG21 VAL 30 -10.321 2.482 -6.787 812 HG22 VAL 30 HG22 VAL 30 -10.036 1.849 -5.154 813 HG23 VAL 30 HG23 VAL 30 -10.828 3.427 -5.373 814 H ARG 31 H ARG 31 -8.177 7.119 -5.723 815 HA ARG 31 HA ARG 31 -5.473 7.112 -6.888 816 HB2 ARG 31 HB2 ARG 31 -7.197 9.047 -6.964 817 HB3 ARG 31 HB3 ARG 31 -6.728 9.359 -5.279 818 HG2 ARG 31 HG2 ARG 31 -4.376 9.638 -5.989 819 HG3 ARG 31 HG3 ARG 31 -4.813 9.145 -7.646 820 HD2 ARG 31 HD2 ARG 31 -6.484 11.103 -7.583 821 HD3 ARG 31 HD3 ARG 31 -5.572 11.697 -6.191 822 HE ARG 31 HE ARG 31 -4.524 11.295 -8.970 823 HH11 ARG 31 HH11 ARG 31 -4.188 12.863 -5.791 824 HH12 ARG 31 HH12 ARG 31 -2.883 13.889 -6.357 825 HH21 ARG 31 HH21 ARG 31 -2.851 12.664 -9.615 826 HH22 ARG 31 HH22 ARG 31 -2.139 13.767 -8.447 827 H ILE 32 H ILE 32 -3.676 6.758 -5.766 828 HA ILE 32 HA ILE 32 -3.903 6.424 -2.806 829 HB ILE 32 HB ILE 32 -2.430 4.485 -4.607 830 HG12 ILE 32 HG12 ILE 32 -5.339 4.368 -3.726 831 HG13 ILE 32 HG13 ILE 32 -4.688 4.367 -5.371 832 HG21 ILE 32 HG21 ILE 32 -2.563 3.004 -2.654 833 HG22 ILE 32 HG22 ILE 32 -1.859 4.546 -2.166 834 HG23 ILE 32 HG23 ILE 32 -3.562 4.198 -1.789 835 HD11 ILE 32 HD11 ILE 32 -4.385 2.136 -3.328 836 HD12 ILE 32 HD12 ILE 32 -5.363 2.123 -4.809 837 HD13 ILE 32 HD13 ILE 32 -3.595 2.175 -4.926 838 H GLY 33 H GLY 33 -1.868 6.557 -1.682 839 HA2 GLY 33 HA2 GLY 33 0.379 7.699 -3.267 840 HA3 GLY 33 HA3 GLY 33 -0.165 8.457 -1.762 841 H ILE 34 H ILE 34 2.440 7.447 -2.270 842 HA ILE 34 HA ILE 34 2.682 5.328 -0.203 843 HB ILE 34 HB ILE 34 4.080 5.329 -2.908 844 HG12 ILE 34 HG12 ILE 34 1.948 3.392 -1.910 845 HG13 ILE 34 HG13 ILE 34 1.655 4.704 -3.066 846 HG21 ILE 34 HG21 ILE 34 4.932 3.094 -2.157 847 HG22 ILE 34 HG22 ILE 34 5.470 4.404 -1.102 848 HG23 ILE 34 HG23 ILE 34 4.142 3.346 -0.583 849 HD11 ILE 34 HD11 ILE 34 3.370 3.755 -4.579 850 HD12 ILE 34 HD12 ILE 34 3.503 2.338 -3.501 851 HD13 ILE 34 HD13 ILE 34 1.966 2.697 -4.319 852 H ASN 35 H ASN 35 4.572 5.512 1.009 853 HA ASN 35 HA ASN 35 6.385 7.761 0.318 854 HB2 ASN 35 HB2 ASN 35 4.445 8.527 1.732 855 HB3 ASN 35 HB3 ASN 35 4.985 7.440 3.007 856 HD21 ASN 35 HD22 ASN 35 4.724 10.375 3.007 857 HD22 ASN 35 HD21 ASN 35 6.316 11.032 3.325 858 H ALA 36 H ALA 36 8.213 6.661 0.092 859 HA ALA 36 HA ALA 36 9.320 5.269 2.439 860 HB1 ALA 36 HB1 ALA 36 10.060 3.370 1.001 861 HB2 ALA 36 HB2 ALA 36 8.284 3.455 1.107 862 HB3 ALA 36 HB3 ALA 36 9.133 4.037 -0.349 863 HA PRO 37 HA PRO 37 13.005 7.308 1.051 864 HB2 PRO 37 HB2 PRO 37 14.919 5.413 1.710 865 HB3 PRO 37 HB3 PRO 37 14.112 6.499 2.904 866 HG2 PRO 37 HG2 PRO 37 13.458 3.625 2.179 867 HG3 PRO 37 HG3 PRO 37 13.589 4.359 3.814 868 HD2 PRO 37 HD2 PRO 37 11.188 3.998 2.616 869 HD3 PRO 37 HD3 PRO 37 11.536 5.482 3.561 870 H LYS 38 H LYS 38 14.644 7.218 -0.629 871 HA LYS 38 HA LYS 38 14.045 5.450 -2.835 872 HB2 LYS 38 HB2 LYS 38 16.372 7.354 -2.289 873 HB3 LYS 38 HB3 LYS 38 16.105 6.538 -3.840 874 HG2 LYS 38 HG2 LYS 38 14.056 8.359 -2.497 875 HG3 LYS 38 HG3 LYS 38 15.201 8.911 -3.725 876 HD2 LYS 38 HD2 LYS 38 13.352 6.551 -4.250 877 HD3 LYS 38 HD3 LYS 38 12.789 8.204 -4.412 878 HE2 LYS 38 HE2 LYS 38 15.251 7.087 -5.831 879 HE3 LYS 38 HE3 LYS 38 13.635 7.143 -6.552 880 HZ1 LYS 38 HZ1 LYS 38 14.936 9.034 -7.199 881 HZ2 LYS 38 HZ2 LYS 38 13.656 9.520 -6.284 882 HZ3 LYS 38 HZ3 LYS 38 15.166 9.489 -5.639 883 H ASP 39 H ASP 39 15.437 4.878 0.019 884 HA ASP 39 HA ASP 39 17.569 3.069 -0.568 885 HB2 ASP 39 HB2 ASP 39 16.838 4.185 1.648 886 HB3 ASP 39 HB3 ASP 39 15.609 2.928 1.751 887 H VAL 40 H VAL 40 14.218 2.923 -1.213 888 HA VAL 40 HA VAL 40 14.342 0.008 -1.725 889 HB VAL 40 HB VAL 40 12.155 -0.342 -0.761 890 HG11 VAL 40 HG11 VAL 40 13.848 1.229 1.235 891 HG12 VAL 40 HG12 VAL 40 12.618 -0.002 1.611 892 HG13 VAL 40 HG13 VAL 40 14.114 -0.474 0.788 893 HG21 VAL 40 HG21 VAL 40 11.198 1.904 -1.247 894 HG22 VAL 40 HG22 VAL 40 10.904 1.345 0.411 895 HG23 VAL 40 HG23 VAL 40 12.157 2.566 0.098 896 H ALA 41 H ALA 41 12.380 -0.639 -3.121 897 HA ALA 41 HA ALA 41 12.077 1.476 -5.194 898 HB1 ALA 41 HB1 ALA 41 11.878 -1.559 -5.391 899 HB2 ALA 41 HB2 ALA 41 11.760 -0.418 -6.745 900 HB3 ALA 41 HB3 ALA 41 13.291 -0.585 -5.854 901 H VAL 42 H VAL 42 10.038 1.645 -6.319 902 HA VAL 42 HA VAL 42 7.752 0.095 -5.379 903 HB VAL 42 HB VAL 42 7.507 1.635 -3.658 904 HG11 VAL 42 HG11 VAL 42 8.439 3.793 -5.573 905 HG12 VAL 42 HG12 VAL 42 7.757 4.117 -3.960 906 HG13 VAL 42 HG13 VAL 42 9.256 3.188 -4.113 907 HG21 VAL 42 HG21 VAL 42 5.638 3.100 -4.235 908 HG22 VAL 42 HG22 VAL 42 5.985 2.923 -5.962 909 HG23 VAL 42 HG23 VAL 42 5.444 1.514 -5.012 910 H HIS 43 H HIS 43 6.456 -0.287 -7.056 911 HA HIS 43 HA HIS 43 6.038 1.704 -9.152 912 HB2 HIS 43 HB2 HIS 43 6.979 -1.037 -10.040 913 HB3 HIS 43 HB3 HIS 43 6.865 0.446 -10.963 914 HD2 HIS 43 HD2 HIS 43 9.115 -1.292 -8.333 915 HE1 HIS 43 HE1 HIS 43 11.446 1.770 -10.139 916 HE2 HIS 43 HE2 HIS 43 11.488 -0.190 -8.528 917 H ARG 44 H ARG 44 4.395 0.737 -10.825 918 HA ARG 44 HA ARG 44 2.348 -0.748 -9.372 919 HB2 ARG 44 HB2 ARG 44 1.121 -0.638 -11.528 920 HB3 ARG 44 HB3 ARG 44 1.647 0.948 -10.952 921 HG2 ARG 44 HG2 ARG 44 3.558 0.905 -12.509 922 HG3 ARG 44 HG3 ARG 44 3.073 -0.710 -13.078 923 HD2 ARG 44 HD2 ARG 44 0.950 0.191 -13.899 924 HD3 ARG 44 HD3 ARG 44 1.329 1.780 -13.215 925 HE ARG 44 HE ARG 44 3.302 1.816 -14.797 926 HH11 ARG 44 HH11 ARG 44 0.393 -0.054 -15.572 927 HH12 ARG 44 HH12 ARG 44 0.663 0.045 -17.298 928 HH21 ARG 44 HH21 ARG 44 3.622 1.913 -17.037 929 HH22 ARG 44 HH22 ARG 44 2.487 1.152 -18.124 930 H GLU 45 H GLU 45 1.410 -2.777 -10.432 931 HA GLU 45 HA GLU 45 3.432 -4.724 -10.229 932 HB2 GLU 45 HB2 GLU 45 0.939 -4.863 -9.756 933 HB3 GLU 45 HB3 GLU 45 0.678 -5.104 -11.481 934 HG2 GLU 45 HG2 GLU 45 2.487 -6.857 -9.758 935 HG3 GLU 45 HG3 GLU 45 0.764 -7.178 -9.984 936 H GLU 46 H GLU 46 2.426 -2.876 -12.990 937 HA GLU 46 HA GLU 46 3.154 -4.743 -15.047 938 HB2 GLU 46 HB2 GLU 46 1.679 -2.680 -15.259 939 HB3 GLU 46 HB3 GLU 46 3.140 -1.696 -15.093 940 HG2 GLU 46 HG2 GLU 46 2.620 -1.911 -17.446 941 HG3 GLU 46 HG3 GLU 46 4.090 -2.843 -17.119 942 H ILE 47 H ILE 47 4.877 -1.979 -13.500 943 HA ILE 47 HA ILE 47 7.184 -2.274 -15.248 944 HB ILE 47 HB ILE 47 6.956 -0.734 -12.645 945 HG12 ILE 47 HG12 ILE 47 5.078 0.002 -13.894 946 HG13 ILE 47 HG13 ILE 47 6.325 1.239 -14.064 947 HG21 ILE 47 HG21 ILE 47 9.230 -0.879 -13.543 948 HG22 ILE 47 HG22 ILE 47 8.666 -0.333 -15.140 949 HG23 ILE 47 HG23 ILE 47 8.614 0.767 -13.741 950 HD11 ILE 47 HD11 ILE 47 5.582 -0.883 -16.119 951 HD12 ILE 47 HD12 ILE 47 5.225 0.852 -16.204 952 HD13 ILE 47 HD13 ILE 47 6.912 0.299 -16.299 953 H TYR 48 H TYR 48 6.187 -3.524 -12.133 954 HA TYR 48 HA TYR 48 8.702 -4.037 -10.949 955 HB2 TYR 48 HB2 TYR 48 6.489 -4.103 -9.848 956 HB3 TYR 48 HB3 TYR 48 6.064 -5.535 -10.783 957 HD1 TYR 48 HD1 TYR 48 8.521 -4.265 -8.253 958 HD2 TYR 48 HD2 TYR 48 6.614 -7.693 -10.028 959 HE1 TYR 48 HE1 TYR 48 9.417 -5.696 -6.442 960 HE2 TYR 48 HE2 TYR 48 7.502 -9.125 -8.247 961 HH TYR 48 HH TYR 48 9.508 -7.822 -5.554 962 H GLN 49 H GLN 49 6.914 -5.765 -13.476 963 HA GLN 49 HA GLN 49 8.346 -8.248 -13.234 964 HB2 GLN 49 HB2 GLN 49 6.737 -7.008 -15.505 965 HB3 GLN 49 HB3 GLN 49 7.325 -8.683 -15.502 966 HG2 GLN 49 HG2 GLN 49 6.009 -9.233 -13.548 967 HG3 GLN 49 HG3 GLN 49 5.561 -7.548 -13.297 968 HE21 GLN 49 HE22 GLN 49 3.321 -8.166 -13.374 969 HE22 GLN 49 HE21 GLN 49 2.521 -8.477 -14.886 970 H ARG 50 H ARG 50 9.130 -5.175 -14.735 971 HA ARG 50 HA ARG 50 11.127 -6.297 -16.577 972 HB2 ARG 50 HB2 ARG 50 10.263 -3.513 -15.721 973 HB3 ARG 50 HB3 ARG 50 11.778 -3.758 -16.593 974 HG2 ARG 50 HG2 ARG 50 10.068 -3.209 -18.193 975 HG3 ARG 50 HG3 ARG 50 10.545 -4.894 -18.423 976 HD2 ARG 50 HD2 ARG 50 8.543 -5.649 -17.207 977 HD3 ARG 50 HD3 ARG 50 8.074 -3.958 -16.914 978 HE ARG 50 HE ARG 50 8.475 -4.467 -19.727 979 HH11 ARG 50 HH11 ARG 50 6.169 -4.967 -17.088 980 HH12 ARG 50 HH12 ARG 50 4.795 -5.074 -18.161 981 HH21 ARG 50 HH21 ARG 50 6.644 -4.609 -21.096 982 HH22 ARG 50 HH22 ARG 50 5.060 -4.870 -20.405 983 H ILE 51 H ILE 51 10.932 -5.454 -13.248 984 HA ILE 51 HA ILE 51 13.843 -4.924 -13.006 985 HB ILE 51 HB ILE 51 11.481 -4.594 -11.120 986 HG12 ILE 51 HG12 ILE 51 13.153 -2.458 -12.511 987 HG13 ILE 51 HG13 ILE 51 11.653 -3.100 -13.199 988 HG21 ILE 51 HG21 ILE 51 14.363 -3.670 -10.773 989 HG22 ILE 51 HG22 ILE 51 13.008 -3.342 -9.664 990 HG23 ILE 51 HG23 ILE 51 13.583 -4.996 -9.874 991 HD11 ILE 51 HD11 ILE 51 11.906 -1.734 -10.507 992 HD12 ILE 51 HD12 ILE 51 11.159 -1.076 -11.990 993 HD13 ILE 51 HD13 ILE 51 10.421 -2.471 -11.175 994 H GLN 52 H GLN 52 11.299 -7.233 -12.105 995 HA GLN 52 HA GLN 52 13.203 -8.811 -10.509 996 HB2 GLN 52 HB2 GLN 52 10.286 -9.301 -11.274 997 HB3 GLN 52 HB3 GLN 52 11.232 -10.317 -10.180 998 HG2 GLN 52 HG2 GLN 52 10.396 -7.436 -9.758 999 HG3 GLN 52 HG3 GLN 52 9.993 -8.868 -8.785 1000 HE21 GLN 52 HE22 GLN 52 12.050 -6.180 -9.088 1001 HE22 GLN 52 HE21 GLN 52 13.272 -6.649 -7.932 1002 H ALA 53 H ALA 53 13.001 -8.371 -13.705 1003 HA ALA 53 HA ALA 53 12.740 -10.966 -14.799 1004 HB1 ALA 53 HB1 ALA 53 12.644 -8.882 -16.089 1005 HB2 ALA 53 HB2 ALA 53 14.367 -8.588 -15.757 1006 HB3 ALA 53 HB3 ALA 53 13.868 -9.984 -16.746 1007 H GLY 54 H GLY 54 15.283 -9.711 -12.791 1008 HA2 GLY 54 HA2 GLY 54 16.669 -11.723 -12.041 1009 HA3 GLY 54 HA3 GLY 54 17.132 -11.845 -13.759 1010 H LEU 55 H LEU 55 16.744 -8.739 -11.989 1011 HA LEU 55 HA LEU 55 19.663 -8.332 -12.102 1012 HB2 LEU 55 HB2 LEU 55 18.965 -6.238 -13.645 1013 HB3 LEU 55 HB3 LEU 55 19.515 -7.797 -14.290 1014 HG LEU 55 HG LEU 55 17.056 -8.470 -14.501 1015 HD11 LEU 55 HD11 LEU 55 15.419 -6.641 -14.598 1016 HD12 LEU 55 HD12 LEU 55 16.043 -6.857 -12.961 1017 HD13 LEU 55 HD13 LEU 55 16.634 -5.505 -13.967 1018 HD21 LEU 55 HD21 LEU 55 18.031 -6.055 -16.049 1019 HD22 LEU 55 HD22 LEU 55 18.421 -7.764 -16.377 1020 HD23 LEU 55 HD23 LEU 55 16.743 -7.191 -16.538 1021 H THR 56 H THR 56 16.489 -7.210 -11.116 1022 HA THR 56 HA THR 56 15.765 -5.297 -10.191 1023 HB THR 56 HB THR 56 18.121 -5.581 -8.310 1024 HG1 THR 56 HG1 THR 56 17.345 -7.639 -8.746 1025 HG21 THR 56 HG21 THR 56 15.159 -4.940 -7.950 1026 HG22 THR 56 HG22 THR 56 16.333 -5.115 -6.620 1027 HG23 THR 56 HG23 THR 56 16.498 -3.790 -7.780 1028 H ALA 57 H ALA 57 17.388 -4.669 -12.435 1029 HA ALA 57 HA ALA 57 17.961 -1.874 -11.726 1030 HB1 ALA 57 HB1 ALA 57 20.028 -3.694 -13.011 1031 HB2 ALA 57 HB2 ALA 57 20.171 -1.933 -12.814 1032 HB3 ALA 57 HB3 ALA 57 20.116 -2.988 -11.379 1033 HA PRO 58 HA PRO 58 15.773 -1.539 -15.659 1034 HB2 PRO 58 HB2 PRO 58 17.012 1.196 -15.428 1035 HB3 PRO 58 HB3 PRO 58 15.340 0.748 -15.896 1036 HG2 PRO 58 HG2 PRO 58 15.857 1.651 -13.390 1037 HG3 PRO 58 HG3 PRO 58 14.782 0.233 -13.625 1038 HD2 PRO 58 HD2 PRO 58 17.714 0.264 -12.869 1039 HD3 PRO 58 HD3 PRO 58 16.372 -0.702 -12.171 1040 H ASP 59 H ASP 59 16.339 -0.461 -17.849 1041 HA ASP 59 HA ASP 59 18.552 -1.775 -18.994 1042 HB2 ASP 59 HB2 ASP 59 16.408 -0.929 -20.083 1043 HB3 ASP 59 HB3 ASP 59 17.104 0.690 -20.035 1044 H5' U 36 H5' U 36 -18.252 -1.968 9.236 1045 H5'' U 36 H5'' U 36 -17.910 -2.496 7.574 1046 H4' U 36 H4' U 36 -16.459 -3.528 10.047 1047 H3' U 36 H3' U 36 -16.212 -0.997 8.742 1048 H2' U 36 H2' U 36 -14.391 -1.226 7.298 1049 HO2' U 36 HO2' U 36 -12.954 -1.755 9.003 1050 H1' U 36 H1' U 36 -14.301 -3.892 6.782 1051 H3 U 36 H3 U 36 -17.576 -4.421 3.578 1052 H5 U 36 H5 U 36 -17.530 -0.331 4.554 1053 H6 U 36 H6 U 36 -16.080 -0.835 6.400 1054 HO5' U 36 HO5' U 36 -19.599 -3.707 8.562 1055 H5' C 37 H5' C 37 -11.830 -0.034 12.263 1056 H5'' C 37 H5'' C 37 -12.388 -1.640 11.781 1057 H4' C 37 H4' C 37 -12.584 -0.371 14.550 1058 H3' C 37 H3' C 37 -10.429 -1.597 13.528 1059 H2' C 37 H2' C 37 -11.572 -3.412 12.520 1060 HO2' C 37 HO2' C 37 -9.989 -4.386 13.859 1061 H1' C 37 H1' C 37 -13.102 -3.930 15.047 1062 H41 C 37 H41 C 37 -16.651 -7.368 11.059 1063 H42 C 37 H42 C 37 -16.039 -6.493 9.661 1064 H5 C 37 H5 C 37 -14.470 -4.622 9.850 1065 H6 C 37 H6 C 37 -13.230 -3.260 11.389 1066 H5' A 38 H5' A 38 -9.692 -4.499 16.183 1067 H5'' A 38 H5'' A 38 -8.206 -4.188 17.085 1068 H4' A 38 H4' A 38 -8.212 -6.241 15.589 1069 H3' A 38 H3' A 38 -6.049 -4.741 16.242 1070 H2' A 38 H2' A 38 -6.371 -3.069 14.584 1071 HO2' A 38 HO2' A 38 -4.662 -5.060 13.510 1072 H1' A 38 H1' A 38 -6.811 -5.123 12.437 1073 H8 A 38 H8 A 38 -7.600 -1.635 13.808 1074 H61 A 38 H61 A 38 -10.180 -0.528 8.273 1075 H62 A 38 H62 A 38 -9.677 0.195 9.791 1076 H2 A 38 H2 A 38 -9.109 -4.822 8.456 1077 H5' G 39 H5' G 39 -7.055 -8.737 14.008 1078 H5'' G 39 H5'' G 39 -6.957 -10.110 15.114 1079 H4' G 39 H4' G 39 -5.487 -11.316 13.695 1080 H3' G 39 H3' G 39 -3.915 -9.261 13.219 1081 H2' G 39 H2' G 39 -5.835 -7.861 12.681 1082 HO2' G 39 HO2' G 39 -4.121 -7.463 11.190 1083 H1' G 39 H1' G 39 -6.548 -9.722 10.440 1084 H8 G 39 H8 G 39 -7.214 -6.729 11.542 1085 H1 G 39 H1 G 39 -12.821 -9.759 12.316 1086 H21 G 39 H21 G 39 -12.454 -11.946 12.453 1087 H22 G 39 H22 G 39 -10.841 -12.615 12.330 1088 H5' G 40 H5' G 40 -4.136 -12.157 9.152 1089 H5'' G 40 H5'' G 40 -3.635 -13.800 9.562 1090 H4' G 40 H4' G 40 -2.758 -12.952 7.363 1091 H3' G 40 H3' G 40 -1.328 -14.499 9.141 1092 H2' G 40 H2' G 40 -0.412 -12.529 10.266 1093 HO2' G 40 HO2' G 40 1.401 -13.422 8.255 1094 H1' G 40 H1' G 40 0.166 -11.449 7.503 1095 H8 G 40 H8 G 40 -1.472 -9.899 10.669 1096 H1 G 40 H1 G 40 4.473 -7.852 9.337 1097 H21 G 40 H21 G 40 5.233 -8.897 7.518 1098 H22 G 40 H22 G 40 4.254 -10.057 6.660 1099 H5' A 41 H5' A 41 -2.655 -15.183 4.573 1100 H5'' A 41 H5'' A 41 -2.948 -13.853 5.698 1101 H4' A 41 H4' A 41 -4.577 -16.414 5.773 1102 H3' A 41 H3' A 41 -4.830 -14.015 3.959 1103 H2' A 41 H2' A 41 -7.113 -13.832 4.369 1104 HO2' A 41 HO2' A 41 -8.371 -15.548 4.937 1105 H1' A 41 H1' A 41 -7.166 -14.768 7.007 1106 H8 A 41 H8 A 41 -5.293 -11.997 5.011 1107 H61 A 41 H61 A 41 -8.357 -8.176 8.858 1108 H62 A 41 H62 A 41 -7.360 -8.224 7.419 1109 H2 A 41 H2 A 41 -8.828 -12.294 10.343 1110 H5' C 42 H5' C 42 -7.015 -14.028 -0.127 1111 H5'' C 42 H5'' C 42 -5.760 -13.234 0.844 1112 H4' C 42 H4' C 42 -7.502 -12.467 2.428 1113 H3' C 42 H3' C 42 -9.317 -14.159 1.537 1114 H2' C 42 H2' C 42 -9.107 -13.608 -0.799 1115 HO2' C 42 HO2' C 42 -10.971 -12.293 -1.312 1116 H1' C 42 H1' C 42 -9.318 -10.678 -0.258 1117 H41 C 42 H41 C 42 -7.305 -11.140 -6.291 1118 H42 C 42 H42 C 42 -5.718 -11.653 -5.743 1119 H5 C 42 H5 C 42 -5.223 -12.095 -3.372 1120 H6 C 42 H6 C 42 -6.166 -12.115 -1.143 1121 H5' A 43 H5' A 43 -12.259 -12.083 1.582 1122 H5'' A 43 H5'' A 43 -13.088 -11.841 3.106 1123 H4' A 43 H4' A 43 -14.573 -12.597 1.302 1124 H3' A 43 H3' A 43 -14.912 -13.613 3.739 1125 H2' A 43 H2' A 43 -13.124 -15.232 3.583 1126 HO2' A 43 HO2' A 43 -14.160 -17.269 3.436 1127 H1' A 43 H1' A 43 -14.161 -16.243 0.958 1128 H8 A 43 H8 A 43 -11.225 -14.916 -0.160 1129 H61 A 43 H61 A 43 -7.760 -19.304 2.568 1130 H62 A 43 H62 A 43 -7.737 -17.994 1.403 1131 H2 A 43 H2 A 43 -11.802 -19.428 4.366 1132 H5' U 44 H5' U 44 -15.716 -11.180 0.476 1133 H5'' U 44 H5'' U 44 -17.174 -11.252 -0.521 1134 H4' U 44 H4' U 44 -15.232 -10.763 -1.914 1135 H3' U 44 H3' U 44 -16.196 -13.618 -2.297 1136 HO3' U 44 HO3' U 44 -17.314 -12.588 -4.049 1137 H2' U 44 H2' U 44 -14.742 -13.603 -4.215 1138 HO2' U 44 HO2' U 44 -15.268 -11.436 -4.902 1139 H1' U 44 H1' U 44 -12.715 -12.259 -2.861 1140 H3 U 44 H3 U 44 -10.866 -16.335 -3.407 1141 H5 U 44 H5 U 44 -14.272 -17.148 -1.082 1142 H6 U 44 H6 U 44 -14.828 -14.797 -1.170 Start of MODEL 12 1 H1 MET 1 H1 MET 1 8.477 10.063 -1.061 2 H2 MET 1 H2 MET 1 8.570 10.641 -2.597 3 H3 MET 1 H3 MET 1 8.573 9.022 -2.337 4 HA MET 1 HA MET 1 6.353 9.091 -1.473 5 HB2 MET 1 HB2 MET 1 6.449 11.427 -0.621 6 HB3 MET 1 HB3 MET 1 6.566 12.027 -2.276 7 HG2 MET 1 HG2 MET 1 4.297 12.321 -1.553 8 HG3 MET 1 HG3 MET 1 4.305 11.051 -2.759 9 HE1 MET 1 HE1 MET 1 1.912 10.353 -2.111 10 HE2 MET 1 HE2 MET 1 1.363 10.089 -0.437 11 HE3 MET 1 HE3 MET 1 1.904 11.706 -0.966 12 H LEU 2 H LEU 2 4.813 8.333 -2.911 13 HA LEU 2 HA LEU 2 5.024 9.223 -5.733 14 HB2 LEU 2 HB2 LEU 2 5.558 6.543 -4.587 15 HB3 LEU 2 HB3 LEU 2 4.368 6.529 -5.899 16 HG LEU 2 HG LEU 2 7.153 7.713 -6.062 17 HD11 LEU 2 HD11 LEU 2 7.107 5.253 -5.909 18 HD12 LEU 2 HD12 LEU 2 5.956 5.176 -7.262 19 HD13 LEU 2 HD13 LEU 2 7.606 5.788 -7.536 20 HD21 LEU 2 HD21 LEU 2 4.959 7.326 -8.158 21 HD22 LEU 2 HD22 LEU 2 5.631 8.876 -7.600 22 HD23 LEU 2 HD23 LEU 2 6.654 7.759 -8.515 23 H ILE 3 H ILE 3 3.072 9.048 -6.896 24 HA ILE 3 HA ILE 3 0.665 8.232 -5.356 25 HB ILE 3 HB ILE 3 0.999 10.833 -6.924 26 HG12 ILE 3 HG12 ILE 3 0.043 11.676 -4.642 27 HG13 ILE 3 HG13 ILE 3 0.684 10.164 -3.983 28 HG21 ILE 3 HG21 ILE 3 -1.436 9.604 -5.571 29 HG22 ILE 3 HG22 ILE 3 -1.350 11.241 -6.256 30 HG23 ILE 3 HG23 ILE 3 -1.217 9.834 -7.332 31 HD11 ILE 3 HD11 ILE 3 2.240 12.301 -5.498 32 HD12 ILE 3 HD12 ILE 3 2.238 12.074 -3.732 33 HD13 ILE 3 HD13 ILE 3 2.962 10.839 -4.775 34 H LEU 4 H LEU 4 -0.955 7.358 -6.624 35 HA LEU 4 HA LEU 4 -0.500 6.973 -9.530 36 HB2 LEU 4 HB2 LEU 4 -0.734 4.735 -7.475 37 HB3 LEU 4 HB3 LEU 4 -0.753 4.512 -9.230 38 HG LEU 4 HG LEU 4 1.609 5.617 -7.641 39 HD11 LEU 4 HD11 LEU 4 1.036 2.887 -8.834 40 HD12 LEU 4 HD12 LEU 4 2.567 3.379 -8.060 41 HD13 LEU 4 HD13 LEU 4 1.063 3.277 -7.105 42 HD21 LEU 4 HD21 LEU 4 1.576 6.363 -10.021 43 HD22 LEU 4 HD22 LEU 4 2.854 5.170 -9.734 44 HD23 LEU 4 HD23 LEU 4 1.345 4.675 -10.536 45 H THR 5 H THR 5 -2.416 5.862 -10.536 46 HA THR 5 HA THR 5 -4.790 5.829 -8.748 47 HB THR 5 HB THR 5 -5.109 6.820 -11.581 48 HG1 THR 5 HG1 THR 5 -3.626 8.231 -10.595 49 HG21 THR 5 HG21 THR 5 -7.098 7.834 -10.598 50 HG22 THR 5 HG22 THR 5 -7.041 6.102 -10.191 51 HG23 THR 5 HG23 THR 5 -6.581 7.326 -8.972 52 H ARG 6 H ARG 6 -4.837 3.705 -8.556 53 HA ARG 6 HA ARG 6 -4.900 1.892 -10.906 54 HB2 ARG 6 HB2 ARG 6 -5.000 1.542 -7.867 55 HB3 ARG 6 HB3 ARG 6 -5.134 0.189 -8.987 56 HG2 ARG 6 HG2 ARG 6 -2.777 1.931 -9.475 57 HG3 ARG 6 HG3 ARG 6 -2.799 1.132 -7.893 58 HD2 ARG 6 HD2 ARG 6 -1.661 -0.282 -9.524 59 HD3 ARG 6 HD3 ARG 6 -3.145 -1.059 -8.954 60 HE ARG 6 HE ARG 6 -4.092 0.070 -11.163 61 HH11 ARG 6 HH11 ARG 6 -1.037 -1.637 -10.663 62 HH12 ARG 6 HH12 ARG 6 -0.878 -2.102 -12.337 63 HH21 ARG 6 HH21 ARG 6 -3.867 -0.541 -13.338 64 HH22 ARG 6 HH22 ARG 6 -2.482 -1.469 -13.865 65 H LYS 7 H LYS 7 -6.694 0.100 -10.630 66 HA LYS 7 HA LYS 7 -9.109 1.168 -9.296 67 HB2 LYS 7 HB2 LYS 7 -10.584 0.296 -11.062 68 HB3 LYS 7 HB3 LYS 7 -9.621 1.652 -11.630 69 HG2 LYS 7 HG2 LYS 7 -8.132 0.146 -12.839 70 HG3 LYS 7 HG3 LYS 7 -8.906 -1.279 -12.096 71 HD2 LYS 7 HD2 LYS 7 -11.096 -0.482 -13.125 72 HD3 LYS 7 HD3 LYS 7 -10.156 0.696 -14.050 73 HE2 LYS 7 HE2 LYS 7 -9.813 -2.326 -14.098 74 HE3 LYS 7 HE3 LYS 7 -10.624 -1.356 -15.340 75 HZ1 LYS 7 HZ1 LYS 7 -8.386 -1.837 -15.988 76 HZ2 LYS 7 HZ2 LYS 7 -8.516 -0.226 -15.708 77 HZ3 LYS 7 HZ3 LYS 7 -7.773 -1.202 -14.608 78 H VAL 8 H VAL 8 -10.862 -0.713 -9.263 79 HA VAL 8 HA VAL 8 -9.643 -2.506 -7.451 80 HB VAL 8 HB VAL 8 -11.771 -3.550 -7.204 81 HG11 VAL 8 HG11 VAL 8 -12.119 -0.563 -7.747 82 HG12 VAL 8 HG12 VAL 8 -13.110 -1.564 -6.668 83 HG13 VAL 8 HG13 VAL 8 -11.400 -1.269 -6.276 84 HG21 VAL 8 HG21 VAL 8 -13.726 -2.967 -8.512 85 HG22 VAL 8 HG22 VAL 8 -12.714 -2.049 -9.668 86 HG23 VAL 8 HG23 VAL 8 -12.530 -3.818 -9.505 87 H GLY 9 H GLY 9 -8.881 -4.488 -7.504 88 HA2 GLY 9 HA2 GLY 9 -8.647 -6.686 -8.349 89 HA3 GLY 9 HA3 GLY 9 -9.215 -6.143 -9.936 90 H GLU 10 H GLU 10 -7.040 -3.802 -8.957 91 HA GLU 10 HA GLU 10 -4.859 -5.104 -10.506 92 HB2 GLU 10 HB2 GLU 10 -5.357 -2.179 -9.878 93 HB3 GLU 10 HB3 GLU 10 -4.078 -2.842 -10.925 94 HG2 GLU 10 HG2 GLU 10 -5.800 -3.834 -12.399 95 HG3 GLU 10 HG3 GLU 10 -7.081 -3.144 -11.391 96 H SER 11 H SER 11 -2.613 -3.879 -9.793 97 HA SER 11 HA SER 11 -2.332 -4.157 -6.854 98 HB2 SER 11 HB2 SER 11 -0.848 -5.870 -8.886 99 HB3 SER 11 HB3 SER 11 -0.531 -5.824 -7.139 100 HG SER 11 HG SER 11 -1.914 -7.546 -7.749 101 H ILE 12 H ILE 12 -0.084 -3.800 -6.158 102 HA ILE 12 HA ILE 12 1.624 -2.070 -7.853 103 HB ILE 12 HB ILE 12 0.474 -1.344 -5.124 104 HG12 ILE 12 HG12 ILE 12 -1.060 -0.833 -6.999 105 HG13 ILE 12 HG13 ILE 12 -0.476 0.612 -6.189 106 HG21 ILE 12 HG21 ILE 12 1.788 0.801 -5.435 107 HG22 ILE 12 HG22 ILE 12 2.761 -0.634 -5.086 108 HG23 ILE 12 HG23 ILE 12 2.672 0.003 -6.745 109 HD11 ILE 12 HD11 ILE 12 0.492 -0.460 -8.862 110 HD12 ILE 12 HD12 ILE 12 -0.431 1.028 -8.553 111 HD13 ILE 12 HD13 ILE 12 1.248 0.896 -8.003 112 H ASN 13 H ASN 13 3.829 -1.828 -6.667 113 HA ASN 13 HA ASN 13 4.332 -4.126 -4.846 114 HB2 ASN 13 HB2 ASN 13 5.906 -3.524 -7.384 115 HB3 ASN 13 HB3 ASN 13 6.243 -4.814 -6.226 116 HD21 ASN 13 HD22 ASN 13 4.728 -6.634 -6.081 117 HD22 ASN 13 HD21 ASN 13 3.646 -6.970 -7.418 118 H ILE 14 H ILE 14 6.255 -3.988 -3.624 119 HA ILE 14 HA ILE 14 7.765 -1.446 -3.727 120 HB ILE 14 HB ILE 14 6.559 -2.583 -1.172 121 HG12 ILE 14 HG12 ILE 14 5.787 -0.100 -2.760 122 HG13 ILE 14 HG13 ILE 14 4.808 -1.568 -2.573 123 HG21 ILE 14 HG21 ILE 14 8.098 -0.000 -1.689 124 HG22 ILE 14 HG22 ILE 14 7.446 -0.537 -0.126 125 HG23 ILE 14 HG23 ILE 14 8.759 -1.436 -0.880 126 HD11 ILE 14 HD11 ILE 14 5.566 0.385 -0.368 127 HD12 ILE 14 HD12 ILE 14 3.965 0.109 -1.071 128 HD13 ILE 14 HD13 ILE 14 4.740 -1.173 -0.109 129 H GLY 15 H GLY 15 9.882 -1.642 -2.934 130 HA2 GLY 15 HA2 GLY 15 11.897 -2.747 -2.696 131 HA3 GLY 15 HA3 GLY 15 11.018 -3.774 -1.548 132 H ASP 16 H ASP 16 11.819 -5.763 -2.093 133 HA ASP 16 HA ASP 16 11.120 -6.772 -4.804 134 HB2 ASP 16 HB2 ASP 16 13.637 -7.370 -3.194 135 HB3 ASP 16 HB3 ASP 16 13.174 -8.178 -4.700 136 H ASP 17 H ASP 17 10.123 -6.792 -1.792 137 HA ASP 17 HA ASP 17 9.405 -9.659 -1.781 138 HB2 ASP 17 HB2 ASP 17 10.613 -8.188 0.599 139 HB3 ASP 17 HB3 ASP 17 9.948 -9.821 0.618 140 H ILE 18 H ILE 18 8.163 -6.669 -2.003 141 HA ILE 18 HA ILE 18 5.887 -7.394 -0.228 142 HB ILE 18 HB ILE 18 6.963 -4.581 -0.630 143 HG12 ILE 18 HG12 ILE 18 7.136 -4.895 2.013 144 HG13 ILE 18 HG13 ILE 18 7.374 -6.591 1.584 145 HG21 ILE 18 HG21 ILE 18 5.290 -4.036 1.151 146 HG22 ILE 18 HG22 ILE 18 4.540 -4.619 -0.339 147 HG23 ILE 18 HG23 ILE 18 4.689 -5.709 1.058 148 HD11 ILE 18 HD11 ILE 18 8.969 -4.222 0.503 149 HD12 ILE 18 HD12 ILE 18 9.516 -5.333 1.780 150 HD13 ILE 18 HD13 ILE 18 9.291 -5.922 0.123 151 H THR 19 H THR 19 3.868 -6.997 -1.003 152 HA THR 19 HA THR 19 3.551 -5.642 -3.615 153 HB THR 19 HB THR 19 2.615 -8.470 -2.950 154 HG1 THR 19 HG1 THR 19 4.762 -8.295 -3.663 155 HG21 THR 19 HG21 THR 19 2.044 -6.706 -5.367 156 HG22 THR 19 HG22 THR 19 1.759 -8.464 -5.303 157 HG23 THR 19 HG23 THR 19 0.857 -7.383 -4.224 158 H ILE 20 H ILE 20 1.351 -4.992 -3.997 159 HA ILE 20 HA ILE 20 -0.419 -4.915 -1.605 160 HB ILE 20 HB ILE 20 0.383 -2.583 -3.392 161 HG12 ILE 20 HG12 ILE 20 2.146 -3.176 -1.755 162 HG13 ILE 20 HG13 ILE 20 1.449 -1.576 -1.492 163 HG21 ILE 20 HG21 ILE 20 -1.557 -2.723 -1.049 164 HG22 ILE 20 HG22 ILE 20 -0.974 -1.217 -1.791 165 HG23 ILE 20 HG23 ILE 20 -1.938 -2.358 -2.748 166 HD11 ILE 20 HD11 ILE 20 1.805 -2.814 0.627 167 HD12 ILE 20 HD12 ILE 20 0.102 -2.397 0.367 168 HD13 ILE 20 HD13 ILE 20 0.669 -4.063 0.078 169 H THR 21 H THR 21 -2.645 -4.782 -2.176 170 HA THR 21 HA THR 21 -3.301 -4.848 -5.075 171 HB THR 21 HB THR 21 -4.238 -6.947 -3.085 172 HG1 THR 21 HG1 THR 21 -2.333 -7.101 -5.173 173 HG21 THR 21 HG21 THR 21 -4.519 -6.749 -6.114 174 HG22 THR 21 HG22 THR 21 -5.068 -8.104 -5.100 175 HG23 THR 21 HG23 THR 21 -5.828 -6.509 -4.936 176 H ILE 22 H ILE 22 -5.375 -4.128 -5.543 177 HA ILE 22 HA ILE 22 -6.901 -2.947 -3.275 178 HB ILE 22 HB ILE 22 -6.226 -1.232 -4.713 179 HG12 ILE 22 HG12 ILE 22 -8.253 -0.370 -5.757 180 HG13 ILE 22 HG13 ILE 22 -8.998 -1.981 -5.727 181 HG21 ILE 22 HG21 ILE 22 -7.043 -2.933 -7.089 182 HG22 ILE 22 HG22 ILE 22 -6.540 -1.236 -7.163 183 HG23 ILE 22 HG23 ILE 22 -5.391 -2.456 -6.608 184 HD11 ILE 22 HD11 ILE 22 -8.163 -0.428 -3.259 185 HD12 ILE 22 HD12 ILE 22 -9.826 -0.570 -3.911 186 HD13 ILE 22 HD13 ILE 22 -8.987 -2.010 -3.306 187 H LEU 23 H LEU 23 -8.130 -4.672 -2.601 188 HA LEU 23 HA LEU 23 -9.126 -6.673 -4.363 189 HB2 LEU 23 HB2 LEU 23 -10.266 -5.923 -1.649 190 HB3 LEU 23 HB3 LEU 23 -10.393 -7.465 -2.486 191 HG LEU 23 HG LEU 23 -7.965 -6.264 -1.125 192 HD11 LEU 23 HD11 LEU 23 -9.477 -8.907 -0.915 193 HD12 LEU 23 HD12 LEU 23 -8.057 -8.452 0.061 194 HD13 LEU 23 HD13 LEU 23 -9.587 -7.561 0.233 195 HD21 LEU 23 HD21 LEU 23 -8.053 -8.654 -3.005 196 HD22 LEU 23 HD22 LEU 23 -7.102 -7.167 -3.221 197 HD23 LEU 23 HD23 LEU 23 -6.711 -8.285 -1.895 198 H GLY 24 H GLY 24 -10.506 -3.568 -3.302 199 HA2 GLY 24 HA2 GLY 24 -12.219 -3.137 -5.353 200 HA3 GLY 24 HA3 GLY 24 -13.173 -4.226 -4.355 201 H VAL 25 H VAL 25 -14.573 -2.176 -4.396 202 HA VAL 25 HA VAL 25 -13.829 -0.527 -2.027 203 HB VAL 25 HB VAL 25 -14.745 1.443 -3.008 204 HG11 VAL 25 HG11 VAL 25 -12.981 0.128 -5.104 205 HG12 VAL 25 HG12 VAL 25 -13.210 1.869 -4.839 206 HG13 VAL 25 HG13 VAL 25 -12.406 0.890 -3.598 207 HG21 VAL 25 HG21 VAL 25 -16.610 0.512 -4.255 208 HG22 VAL 25 HG22 VAL 25 -15.615 1.521 -5.309 209 HG23 VAL 25 HG23 VAL 25 -15.488 -0.253 -5.416 210 H SER 26 H SER 26 -15.626 0.446 -0.927 211 HA SER 26 HA SER 26 -18.327 -0.645 -1.347 212 HB2 SER 26 HB2 SER 26 -16.742 -1.080 1.227 213 HB3 SER 26 HB3 SER 26 -18.479 -1.392 1.013 214 HG SER 26 HG SER 26 -17.898 -2.903 -0.617 215 H GLY 27 H GLY 27 -18.884 1.528 -1.808 216 HA2 GLY 27 HA2 GLY 27 -19.480 3.708 -1.258 217 HA3 GLY 27 HA3 GLY 27 -19.261 3.264 0.449 218 H GLN 28 H GLN 28 -18.030 5.061 1.142 219 HA GLN 28 HA GLN 28 -15.714 5.967 -0.353 220 HB2 GLN 28 HB2 GLN 28 -16.590 6.371 2.537 221 HB3 GLN 28 HB3 GLN 28 -15.133 7.088 1.846 222 HG2 GLN 28 HG2 GLN 28 -18.014 7.670 1.158 223 HG3 GLN 28 HG3 GLN 28 -16.731 8.780 1.683 224 HE21 GLN 28 HE22 GLN 28 -14.708 8.726 0.073 225 HE22 GLN 28 HE21 GLN 28 -15.139 8.818 -1.624 226 H GLN 29 H GLN 29 -16.342 3.243 1.697 227 HA GLN 29 HA GLN 29 -13.617 3.010 2.634 228 HB2 GLN 29 HB2 GLN 29 -16.086 1.838 3.260 229 HB3 GLN 29 HB3 GLN 29 -15.156 0.516 2.530 230 HG2 GLN 29 HG2 GLN 29 -13.286 1.026 4.119 231 HG3 GLN 29 HG3 GLN 29 -14.206 2.394 4.740 232 HE21 GLN 29 HE22 GLN 29 -14.577 1.830 6.825 233 HE22 GLN 29 HE21 GLN 29 -15.443 0.390 7.317 234 H VAL 30 H VAL 30 -12.065 1.511 1.931 235 HA VAL 30 HA VAL 30 -12.388 0.411 -0.808 236 HB VAL 30 HB VAL 30 -10.074 2.093 0.267 237 HG11 VAL 30 HG11 VAL 30 -10.489 0.814 -2.460 238 HG12 VAL 30 HG12 VAL 30 -9.103 1.809 -1.964 239 HG13 VAL 30 HG13 VAL 30 -9.359 0.219 -1.213 240 HG21 VAL 30 HG21 VAL 30 -12.002 3.475 -0.406 241 HG22 VAL 30 HG22 VAL 30 -10.685 3.630 -1.592 242 HG23 VAL 30 HG23 VAL 30 -12.096 2.607 -1.954 243 H ARG 31 H ARG 31 -11.823 -1.673 -0.788 244 HA ARG 31 HA ARG 31 -10.587 -2.747 1.666 245 HB2 ARG 31 HB2 ARG 31 -12.760 -3.564 0.698 246 HB3 ARG 31 HB3 ARG 31 -11.853 -4.220 -0.676 247 HG2 ARG 31 HG2 ARG 31 -10.573 -5.680 0.828 248 HG3 ARG 31 HG3 ARG 31 -11.306 -4.915 2.252 249 HD2 ARG 31 HD2 ARG 31 -12.871 -6.401 0.113 250 HD3 ARG 31 HD3 ARG 31 -12.360 -7.107 1.653 251 HE ARG 31 HE ARG 31 -13.858 -5.706 2.837 252 HH11 ARG 31 HH11 ARG 31 -14.159 -5.332 -0.677 253 HH12 ARG 31 HH12 ARG 31 -15.681 -4.471 -0.555 254 HH21 ARG 31 HH21 ARG 31 -15.878 -4.627 2.923 255 HH22 ARG 31 HH22 ARG 31 -16.630 -4.081 1.440 256 H ILE 32 H ILE 32 -8.550 -3.447 1.706 257 HA ILE 32 HA ILE 32 -7.013 -3.491 -0.857 258 HB ILE 32 HB ILE 32 -5.991 -2.181 1.676 259 HG12 ILE 32 HG12 ILE 32 -7.650 -0.868 -0.513 260 HG13 ILE 32 HG13 ILE 32 -8.011 -0.968 1.215 261 HG21 ILE 32 HG21 ILE 32 -5.299 -1.795 -1.267 262 HG22 ILE 32 HG22 ILE 32 -4.460 -1.052 0.121 263 HG23 ILE 32 HG23 ILE 32 -4.372 -2.795 -0.120 264 HD11 ILE 32 HD11 ILE 32 -5.758 0.607 -0.063 265 HD12 ILE 32 HD12 ILE 32 -7.212 1.252 0.725 266 HD13 ILE 32 HD13 ILE 32 -5.988 0.413 1.697 267 H GLY 33 H GLY 33 -4.997 -4.672 -0.723 268 HA2 GLY 33 HA2 GLY 33 -4.777 -6.474 1.639 269 HA3 GLY 33 HA3 GLY 33 -4.687 -7.104 -0.015 270 H ILE 34 H ILE 34 -2.665 -7.361 1.947 271 HA ILE 34 HA ILE 34 -0.401 -5.897 0.696 272 HB ILE 34 HB ILE 34 -0.879 -6.171 3.697 273 HG12 ILE 34 HG12 ILE 34 -0.958 -3.632 2.009 274 HG13 ILE 34 HG13 ILE 34 -2.389 -4.480 2.625 275 HG21 ILE 34 HG21 ILE 34 1.324 -4.768 2.113 276 HG22 ILE 34 HG22 ILE 34 1.150 -4.735 3.883 277 HG23 ILE 34 HG23 ILE 34 1.495 -6.258 3.072 278 HD11 ILE 34 HD11 ILE 34 -1.527 -4.210 4.945 279 HD12 ILE 34 HD12 ILE 34 -0.205 -3.200 4.305 280 HD13 ILE 34 HD13 ILE 34 -1.887 -2.667 4.127 281 H ASN 35 H ASN 35 1.484 -7.116 0.642 282 HA ASN 35 HA ASN 35 1.367 -9.801 1.897 283 HB2 ASN 35 HB2 ASN 35 0.378 -9.831 -0.414 284 HB3 ASN 35 HB3 ASN 35 1.936 -9.304 -1.050 285 HD21 ASN 35 HD22 ASN 35 0.364 -11.796 -1.496 286 HD22 ASN 35 HD21 ASN 35 1.416 -13.121 -1.048 287 H ALA 36 H ALA 36 3.067 -9.653 3.201 288 HA ALA 36 HA ALA 36 5.737 -9.191 2.029 289 HB1 ALA 36 HB1 ALA 36 6.328 -7.669 3.899 290 HB2 ALA 36 HB2 ALA 36 5.059 -6.968 2.865 291 HB3 ALA 36 HB3 ALA 36 4.642 -7.682 4.440 292 HA PRO 37 HA PRO 37 6.777 -12.476 4.794 293 HB2 PRO 37 HB2 PRO 37 9.360 -11.730 5.512 294 HB3 PRO 37 HB3 PRO 37 8.920 -12.512 3.950 295 HG2 PRO 37 HG2 PRO 37 9.391 -9.588 4.572 296 HG3 PRO 37 HG3 PRO 37 9.940 -10.524 3.150 297 HD2 PRO 37 HD2 PRO 37 7.752 -8.905 3.082 298 HD3 PRO 37 HD3 PRO 37 7.796 -10.446 2.175 299 H LYS 38 H LYS 38 7.184 -12.955 7.042 300 HA LYS 38 HA LYS 38 6.255 -10.915 8.882 301 HB2 LYS 38 HB2 LYS 38 7.373 -13.731 9.264 302 HB3 LYS 38 HB3 LYS 38 6.729 -12.739 10.593 303 HG2 LYS 38 HG2 LYS 38 5.120 -13.362 8.079 304 HG3 LYS 38 HG3 LYS 38 5.068 -14.383 9.524 305 HD2 LYS 38 HD2 LYS 38 4.596 -11.402 9.781 306 HD3 LYS 38 HD3 LYS 38 3.325 -12.442 9.138 307 HE2 LYS 38 HE2 LYS 38 4.771 -12.894 11.792 308 HE3 LYS 38 HE3 LYS 38 3.219 -12.058 11.630 309 HZ1 LYS 38 HZ1 LYS 38 3.732 -14.841 10.825 310 HZ2 LYS 38 HZ2 LYS 38 2.931 -14.383 12.181 311 HZ3 LYS 38 HZ3 LYS 38 2.293 -14.048 10.703 312 H ASP 39 H ASP 39 9.118 -11.329 7.390 313 HA ASP 39 HA ASP 39 10.997 -10.588 9.461 314 HB2 ASP 39 HB2 ASP 39 11.000 -10.397 6.427 315 HB3 ASP 39 HB3 ASP 39 12.370 -9.912 7.429 316 H VAL 40 H VAL 40 8.404 -8.910 8.067 317 HA VAL 40 HA VAL 40 9.528 -6.316 8.960 318 HB VAL 40 HB VAL 40 8.584 -5.180 7.010 319 HG11 VAL 40 HG11 VAL 40 10.298 -7.531 6.106 320 HG12 VAL 40 HG12 VAL 40 10.116 -5.970 5.284 321 HG13 VAL 40 HG13 VAL 40 10.929 -6.044 6.862 322 HG21 VAL 40 HG21 VAL 40 7.635 -6.335 5.141 323 HG22 VAL 40 HG22 VAL 40 7.959 -7.921 5.888 324 HG23 VAL 40 HG23 VAL 40 6.739 -6.829 6.598 325 H ALA 41 H ALA 41 7.662 -4.662 9.107 326 HA ALA 41 HA ALA 41 5.392 -6.112 10.381 327 HB1 ALA 41 HB1 ALA 41 6.548 -3.356 10.979 328 HB2 ALA 41 HB2 ALA 41 5.232 -4.150 11.862 329 HB3 ALA 41 HB3 ALA 41 6.868 -4.841 11.916 330 H VAL 42 H VAL 42 3.290 -5.198 10.255 331 HA VAL 42 HA VAL 42 2.791 -2.876 8.548 332 HB VAL 42 HB VAL 42 2.848 -4.349 6.739 333 HG11 VAL 42 HG11 VAL 42 1.514 -6.424 8.508 334 HG12 VAL 42 HG12 VAL 42 1.754 -6.611 6.754 335 HG13 VAL 42 HG13 VAL 42 3.158 -6.458 7.827 336 HG21 VAL 42 HG21 VAL 42 0.699 -3.123 6.832 337 HG22 VAL 42 HG22 VAL 42 0.542 -4.705 6.022 338 HG23 VAL 42 HG23 VAL 42 -0.043 -4.505 7.679 339 H HIS 43 H HIS 43 1.134 -1.770 9.395 340 HA HIS 43 HA HIS 43 -1.082 -3.167 10.708 341 HB2 HIS 43 HB2 HIS 43 0.386 -1.055 12.316 342 HB3 HIS 43 HB3 HIS 43 -0.851 -2.183 12.843 343 HD2 HIS 43 HD2 HIS 43 2.913 -2.024 12.054 344 HE1 HIS 43 HE1 HIS 43 2.238 -5.660 14.156 345 HE2 HIS 43 HE2 HIS 43 4.017 -4.106 13.217 346 H ARG 44 H ARG 44 -2.686 -1.454 11.588 347 HA ARG 44 HA ARG 44 -3.243 0.508 9.564 348 HB2 ARG 44 HB2 ARG 44 -4.887 -0.781 11.002 349 HB3 ARG 44 HB3 ARG 44 -4.348 0.168 12.390 350 HG2 ARG 44 HG2 ARG 44 -5.152 2.245 11.263 351 HG3 ARG 44 HG3 ARG 44 -5.714 1.255 9.892 352 HD2 ARG 44 HD2 ARG 44 -7.141 -0.062 11.443 353 HD3 ARG 44 HD3 ARG 44 -6.582 0.936 12.796 354 HE ARG 44 HE ARG 44 -7.870 2.354 10.547 355 HH11 ARG 44 HH11 ARG 44 -8.178 0.989 13.794 356 HH12 ARG 44 HH12 ARG 44 -9.636 1.886 14.162 357 HH21 ARG 44 HH21 ARG 44 -9.796 3.483 11.042 358 HH22 ARG 44 HH22 ARG 44 -10.532 3.299 12.617 359 H GLU 45 H GLU 45 -3.239 2.874 9.919 360 HA GLU 45 HA GLU 45 -0.793 3.754 11.011 361 HB2 GLU 45 HB2 GLU 45 -2.217 4.820 9.240 362 HB3 GLU 45 HB3 GLU 45 -3.301 5.420 10.487 363 HG2 GLU 45 HG2 GLU 45 -0.313 6.038 10.324 364 HG3 GLU 45 HG3 GLU 45 -1.568 7.046 9.598 365 H GLU 46 H GLU 46 -3.853 3.115 12.534 366 HA GLU 46 HA GLU 46 -3.590 4.746 14.874 367 HB2 GLU 46 HB2 GLU 46 -5.683 3.623 14.000 368 HB3 GLU 46 HB3 GLU 46 -4.977 2.065 14.435 369 HG2 GLU 46 HG2 GLU 46 -6.526 2.781 16.166 370 HG3 GLU 46 HG3 GLU 46 -4.884 2.803 16.821 371 H ILE 47 H ILE 47 -2.680 1.341 14.110 372 HA ILE 47 HA ILE 47 -1.853 0.809 16.847 373 HB ILE 47 HB ILE 47 -1.241 -0.773 14.334 374 HG12 ILE 47 HG12 ILE 47 -3.586 -0.437 14.189 375 HG13 ILE 47 HG13 ILE 47 -3.327 -2.075 14.797 376 HG21 ILE 47 HG21 ILE 47 -1.622 -1.596 17.244 377 HG22 ILE 47 HG22 ILE 47 -1.289 -2.701 15.892 378 HG23 ILE 47 HG23 ILE 47 -0.079 -1.498 16.364 379 HD11 ILE 47 HD11 ILE 47 -5.170 -0.987 15.985 380 HD12 ILE 47 HD12 ILE 47 -3.816 -1.281 17.104 381 HD13 ILE 47 HD13 ILE 47 -4.113 0.356 16.455 382 H TYR 48 H TYR 48 -0.353 1.894 13.862 383 HA TYR 48 HA TYR 48 2.318 1.110 14.310 384 HB2 TYR 48 HB2 TYR 48 1.326 1.953 12.197 385 HB3 TYR 48 HB3 TYR 48 1.176 3.551 12.905 386 HD1 TYR 48 HD2 TYR 48 3.680 0.957 11.910 387 HD2 TYR 48 HD1 TYR 48 2.987 5.079 12.931 388 HE1 TYR 48 HE2 TYR 48 5.931 1.535 11.068 389 HE2 TYR 48 HE1 TYR 48 5.203 5.679 12.082 390 HH TYR 48 HH TYR 48 7.156 4.915 11.080 391 H GLN 49 H GLN 49 0.434 3.752 15.705 392 HA GLN 49 HA GLN 49 2.675 5.341 16.537 393 HB2 GLN 49 HB2 GLN 49 -0.230 5.215 17.413 394 HB3 GLN 49 HB3 GLN 49 0.916 6.454 17.970 395 HG2 GLN 49 HG2 GLN 49 1.264 7.263 15.721 396 HG3 GLN 49 HG3 GLN 49 0.376 5.912 15.023 397 HE21 GLN 49 HE22 GLN 49 -1.044 7.388 13.947 398 HE22 GLN 49 HE21 GLN 49 -2.320 8.211 14.796 399 H ARG 50 H ARG 50 1.166 2.456 17.851 400 HA ARG 50 HA ARG 50 2.182 2.829 20.575 401 HB2 ARG 50 HB2 ARG 50 0.815 0.607 19.018 402 HB3 ARG 50 HB3 ARG 50 1.606 0.266 20.553 403 HG2 ARG 50 HG2 ARG 50 -0.712 0.662 20.995 404 HG3 ARG 50 HG3 ARG 50 0.218 2.016 21.656 405 HD2 ARG 50 HD2 ARG 50 -0.383 3.388 19.688 406 HD3 ARG 50 HD3 ARG 50 -1.267 2.010 18.994 407 HE ARG 50 HE ARG 50 -2.189 2.614 21.662 408 HH11 ARG 50 HH11 ARG 50 -2.449 3.732 18.307 409 HH12 ARG 50 HH12 ARG 50 -3.988 4.504 18.577 410 HH21 ARG 50 HH21 ARG 50 -4.196 3.628 21.962 411 HH22 ARG 50 HH22 ARG 50 -4.975 4.433 20.619 412 H ILE 51 H ILE 51 3.414 1.806 17.537 413 HA ILE 51 HA ILE 51 5.449 0.004 18.723 414 HB ILE 51 HB ILE 51 4.531 0.592 15.883 415 HG12 ILE 51 HG12 ILE 51 4.158 -1.897 17.602 416 HG13 ILE 51 HG13 ILE 51 2.943 -0.611 17.474 417 HG21 ILE 51 HG21 ILE 51 6.480 -1.525 16.887 418 HG22 ILE 51 HG22 ILE 51 5.890 -1.348 15.216 419 HG23 ILE 51 HG23 ILE 51 6.900 -0.083 15.925 420 HD11 ILE 51 HD11 ILE 51 3.995 -2.279 15.172 421 HD12 ILE 51 HD12 ILE 51 2.383 -2.368 15.933 422 HD13 ILE 51 HD13 ILE 51 2.857 -0.907 15.038 423 H GLN 52 H GLN 52 5.053 3.074 16.949 424 HA GLN 52 HA GLN 52 7.954 3.515 16.890 425 HB2 GLN 52 HB2 GLN 52 5.601 5.313 16.152 426 HB3 GLN 52 HB3 GLN 52 7.307 5.705 15.889 427 HG2 GLN 52 HG2 GLN 52 5.700 3.486 14.597 428 HG3 GLN 52 HG3 GLN 52 6.502 4.864 13.828 429 HE21 GLN 52 HE22 GLN 52 6.749 1.577 14.534 430 HE22 GLN 52 HE21 GLN 52 8.471 1.373 14.306 431 H ALA 53 H ALA 53 5.828 3.491 19.372 432 HA ALA 53 HA ALA 53 6.198 5.996 20.649 433 HB1 ALA 53 HB1 ALA 53 5.449 4.782 22.664 434 HB2 ALA 53 HB2 ALA 53 4.461 4.346 21.258 435 HB3 ALA 53 HB3 ALA 53 5.722 3.231 21.837 436 H GLY 54 H GLY 54 8.451 3.325 20.229 437 HA2 GLY 54 HA2 GLY 54 10.738 4.510 20.830 438 HA3 GLY 54 HA3 GLY 54 10.115 4.293 22.483 439 H LEU 55 H LEU 55 9.587 1.868 19.874 440 HA LEU 55 HA LEU 55 11.637 0.153 21.125 441 HB2 LEU 55 HB2 LEU 55 9.739 -1.612 21.449 442 HB3 LEU 55 HB3 LEU 55 10.067 -0.386 22.669 443 HG LEU 55 HG LEU 55 8.131 0.983 21.510 444 HD11 LEU 55 HD11 LEU 55 7.479 -1.875 20.654 445 HD12 LEU 55 HD12 LEU 55 6.337 -0.512 20.671 446 HD13 LEU 55 HD13 LEU 55 7.705 -0.484 19.561 447 HD21 LEU 55 HD21 LEU 55 8.119 0.099 23.767 448 HD22 LEU 55 HD22 LEU 55 6.542 -0.150 22.985 449 HD23 LEU 55 HD23 LEU 55 7.673 -1.517 23.166 450 H THR 56 H THR 56 9.146 0.531 18.612 451 HA THR 56 HA THR 56 8.541 -0.808 16.927 452 HB THR 56 HB THR 56 11.472 -0.707 16.162 453 HG1 THR 56 HG1 THR 56 11.049 1.407 15.536 454 HG21 THR 56 HG21 THR 56 10.041 -1.768 14.486 455 HG22 THR 56 HG22 THR 56 8.816 -0.499 14.665 456 HG23 THR 56 HG23 THR 56 10.392 -0.116 13.936 457 H ALA 57 H ALA 57 9.201 -2.451 19.270 458 HA ALA 57 HA ALA 57 9.301 -5.008 17.868 459 HB1 ALA 57 HB1 ALA 57 11.455 -4.266 19.884 460 HB2 ALA 57 HB2 ALA 57 11.188 -5.882 19.184 461 HB3 ALA 57 HB3 ALA 57 11.697 -4.534 18.140 462 HA PRO 58 HA PRO 58 6.497 -4.620 21.639 463 HB2 PRO 58 HB2 PRO 58 4.847 -6.094 19.606 464 HB3 PRO 58 HB3 PRO 58 4.320 -4.903 20.839 465 HG2 PRO 58 HG2 PRO 58 4.599 -4.174 18.231 466 HG3 PRO 58 HG3 PRO 58 5.194 -3.092 19.535 467 HD2 PRO 58 HD2 PRO 58 6.797 -5.001 17.810 468 HD3 PRO 58 HD3 PRO 58 7.165 -3.325 18.319 469 H ASP 59 H ASP 59 5.177 -6.510 22.578 470 HA ASP 59 HA ASP 59 6.888 -8.712 23.104 471 HB2 ASP 59 HB2 ASP 59 5.013 -7.679 24.522 472 HB3 ASP 59 HB3 ASP 59 3.877 -8.541 23.499 473 H5' U 36 H5' U 36 -7.751 9.637 -17.428 474 H5'' U 36 H5'' U 36 -8.413 9.773 -15.788 475 H4' U 36 H4' U 36 -5.451 10.026 -16.486 476 H3' U 36 H3' U 36 -7.079 7.653 -16.248 477 H2' U 36 H2' U 36 -6.588 6.837 -14.132 478 HO2' U 36 HO2' U 36 -4.290 6.826 -14.619 479 H1' U 36 H1' U 36 -5.989 9.063 -12.719 480 H3 U 36 H3 U 36 -10.153 10.822 -11.830 481 H5 U 36 H5 U 36 -10.829 7.429 -14.203 482 H6 U 36 H6 U 36 -8.462 7.284 -14.603 483 HO5' U 36 HO5' U 36 -7.463 11.871 -15.698 484 H5' C 37 H5' C 37 -2.699 5.947 -18.816 485 H5'' C 37 H5'' C 37 -2.486 6.978 -17.403 486 H4' C 37 H4' C 37 -1.424 7.358 -20.225 487 H3' C 37 H3' C 37 -0.222 6.179 -18.126 488 H2' C 37 H2' C 37 -0.693 7.821 -16.486 489 HO2' C 37 HO2' C 37 1.633 7.654 -16.586 490 H1' C 37 H1' C 37 0.098 10.066 -18.293 491 H41 C 37 H41 C 37 -3.412 13.406 -14.214 492 H42 C 37 H42 C 37 -4.262 11.976 -13.656 493 H5 C 37 H5 C 37 -3.857 9.739 -14.610 494 H6 C 37 H6 C 37 -2.598 8.516 -16.236 495 H5' A 38 H5' A 38 3.368 8.238 -18.094 496 H5'' A 38 H5'' A 38 4.652 7.167 -18.687 497 H4' A 38 H4' A 38 5.088 7.980 -16.396 498 H3' A 38 H3' A 38 5.599 5.446 -17.210 499 H2' A 38 H2' A 38 3.404 4.602 -16.754 500 HO2' A 38 HO2' A 38 4.998 4.148 -14.445 501 H1' A 38 H1' A 38 3.501 5.922 -14.045 502 H8 A 38 H8 A 38 1.392 4.355 -16.797 503 H61 A 38 H61 A 38 -3.386 5.229 -12.933 504 H62 A 38 H62 A 38 -2.861 4.464 -14.419 505 H2 A 38 H2 A 38 0.109 7.493 -11.354 506 H5' G 39 H5' G 39 5.472 8.725 -14.559 507 H5'' G 39 H5'' G 39 6.911 9.621 -15.068 508 H4' G 39 H4' G 39 6.111 10.820 -13.210 509 H3' G 39 H3' G 39 8.603 9.858 -12.912 510 H2' G 39 H2' G 39 8.078 7.735 -12.014 511 HO2' G 39 HO2' G 39 8.259 9.503 -9.818 512 H1' G 39 H1' G 39 5.916 8.623 -10.176 513 H8 G 39 H8 G 39 3.761 7.251 -12.282 514 H1 G 39 H1 G 39 7.684 2.398 -10.806 515 H21 G 39 H21 G 39 9.566 3.157 -9.984 516 H22 G 39 H22 G 39 9.867 4.871 -9.761 517 H5' G 40 H5' G 40 7.253 11.237 -8.574 518 H5'' G 40 H5'' G 40 8.401 12.503 -8.118 519 H4' G 40 H4' G 40 7.803 10.975 -6.246 520 H3' G 40 H3' G 40 10.402 11.928 -6.757 521 H2' G 40 H2' G 40 10.866 9.802 -7.895 522 HO2' G 40 HO2' G 40 12.564 10.307 -6.530 523 H1' G 40 H1' G 40 9.433 8.739 -5.419 524 H8 G 40 H8 G 40 10.119 7.546 -9.092 525 H1 G 40 H1 G 40 11.592 3.414 -4.415 526 H21 G 40 H21 G 40 11.190 4.347 -2.435 527 H22 G 40 H22 G 40 10.500 5.949 -2.295 528 H5' A 41 H5' A 41 7.585 13.541 -3.457 529 H5'' A 41 H5'' A 41 7.345 12.413 -4.801 530 H4' A 41 H4' A 41 7.521 15.416 -5.228 531 H3' A 41 H3' A 41 5.258 13.742 -4.206 532 H2' A 41 H2' A 41 3.728 14.563 -5.785 533 HO2' A 41 HO2' A 41 4.190 16.790 -5.407 534 H1' A 41 H1' A 41 5.485 15.044 -7.904 535 H8 A 41 H8 A 41 4.586 11.949 -5.702 536 H61 A 41 H61 A 41 2.785 9.508 -11.138 537 H62 A 41 H62 A 41 2.800 9.248 -9.403 538 H2 A 41 H2 A 41 4.564 13.480 -11.927 539 H5' C 42 H5' C 42 1.743 15.126 -1.853 540 H5'' C 42 H5'' C 42 2.684 13.789 -2.535 541 H4' C 42 H4' C 42 1.533 14.023 -4.680 542 H3' C 42 H3' C 42 0.905 16.571 -4.126 543 H2' C 42 H2' C 42 -0.216 16.132 -2.056 544 HO2' C 42 HO2' C 42 -2.214 16.057 -4.090 545 H1' C 42 H1' C 42 -1.800 13.886 -3.293 546 H41 C 42 H41 C 42 -2.891 13.392 2.984 547 H42 C 42 H42 C 42 -1.189 13.101 3.282 548 H5 C 42 H5 C 42 0.499 13.203 1.510 549 H6 C 42 H6 C 42 0.836 13.604 -0.877 550 H5' A 43 H5' A 43 -2.193 14.695 -6.792 551 H5'' A 43 H5'' A 43 -2.309 14.763 -8.554 552 H4' A 43 H4' A 43 -4.081 16.044 -7.242 553 H3' A 43 H3' A 43 -3.117 16.732 -9.666 554 H2' A 43 H2' A 43 -1.159 17.832 -8.856 555 HO2' A 43 HO2' A 43 -1.524 20.058 -9.210 556 H1' A 43 H1' A 43 -2.848 19.383 -6.904 557 H8 A 43 H8 A 43 -0.994 17.952 -4.512 558 H61 A 43 H61 A 43 4.196 21.034 -5.925 559 H62 A 43 H62 A 43 3.375 20.101 -4.689 560 H2 A 43 H2 A 43 1.469 21.275 -9.416 561 H5' U 44 H5' U 44 -7.454 18.310 -6.492 562 H5'' U 44 H5'' U 44 -5.757 18.809 -6.505 563 H4' U 44 H4' U 44 -6.887 16.600 -4.726 564 H3' U 44 H3' U 44 -6.334 19.544 -4.231 565 HO3' U 44 HO3' U 44 -8.536 18.925 -4.487 566 H2' U 44 H2' U 44 -5.817 18.969 -1.953 567 HO2' U 44 HO2' U 44 -7.467 17.290 -1.762 568 H1' U 44 H1' U 44 -4.166 16.942 -2.647 569 H3 U 44 H3 U 44 -1.682 20.644 -1.550 570 H5 U 44 H5 U 44 -2.758 21.194 -5.581 571 H6 U 44 H6 U 44 -4.184 19.261 -5.406 572 H1 MET 1 H1 MET 1 0.822 -11.650 5.150 573 H2 MET 1 H2 MET 1 0.934 -12.814 3.992 574 H3 MET 1 H3 MET 1 -0.082 -13.022 5.269 575 HA MET 1 HA MET 1 -0.345 -10.969 3.189 576 HB2 MET 1 HB2 MET 1 -0.891 -13.276 2.392 577 HB3 MET 1 HB3 MET 1 -2.024 -13.452 3.750 578 HG2 MET 1 HG2 MET 1 -3.274 -12.857 1.769 579 HG3 MET 1 HG3 MET 1 -3.319 -11.517 2.904 580 HE1 MET 1 HE1 MET 1 -4.362 -11.008 0.234 581 HE2 MET 1 HE2 MET 1 -4.038 -9.679 1.366 582 HE3 MET 1 HE3 MET 1 -3.517 -9.535 -0.331 583 H LEU 2 H LEU 2 -1.709 -9.267 3.684 584 HA LEU 2 HA LEU 2 -3.582 -9.657 5.957 585 HB2 LEU 2 HB2 LEU 2 -1.341 -7.726 5.668 586 HB3 LEU 2 HB3 LEU 2 -2.882 -6.995 6.135 587 HG LEU 2 HG LEU 2 -1.560 -9.305 7.588 588 HD11 LEU 2 HD11 LEU 2 -1.819 -6.351 8.324 589 HD12 LEU 2 HD12 LEU 2 -1.106 -7.630 9.330 590 HD13 LEU 2 HD13 LEU 2 -0.331 -7.169 7.794 591 HD21 LEU 2 HD21 LEU 2 -4.026 -9.315 7.858 592 HD22 LEU 2 HD22 LEU 2 -3.253 -8.743 9.347 593 HD23 LEU 2 HD23 LEU 2 -4.001 -7.577 8.230 594 H ILE 3 H ILE 3 -5.441 -8.336 5.874 595 HA ILE 3 HA ILE 3 -5.895 -6.831 3.354 596 HB ILE 3 HB ILE 3 -7.774 -8.918 4.552 597 HG12 ILE 3 HG12 ILE 3 -7.630 -9.618 2.013 598 HG13 ILE 3 HG13 ILE 3 -6.093 -8.747 2.030 599 HG21 ILE 3 HG21 ILE 3 -8.172 -7.032 2.201 600 HG22 ILE 3 HG22 ILE 3 -9.259 -8.349 2.684 601 HG23 ILE 3 HG23 ILE 3 -9.041 -6.957 3.763 602 HD11 ILE 3 HD11 ILE 3 -6.911 -11.085 3.813 603 HD12 ILE 3 HD12 ILE 3 -5.797 -11.156 2.431 604 HD13 ILE 3 HD13 ILE 3 -5.324 -10.268 3.889 605 H LEU 4 H LEU 4 -7.418 -5.132 3.571 606 HA LEU 4 HA LEU 4 -8.173 -4.318 6.328 607 HB2 LEU 4 HB2 LEU 4 -6.462 -2.707 4.397 608 HB3 LEU 4 HB3 LEU 4 -7.091 -2.118 5.936 609 HG LEU 4 HG LEU 4 -5.129 -4.449 5.675 610 HD11 LEU 4 HD11 LEU 4 -4.170 -2.355 4.847 611 HD12 LEU 4 HD12 LEU 4 -4.785 -1.493 6.264 612 HD13 LEU 4 HD13 LEU 4 -3.495 -2.714 6.460 613 HD21 LEU 4 HD21 LEU 4 -6.439 -4.478 7.784 614 HD22 LEU 4 HD22 LEU 4 -4.759 -3.993 8.079 615 HD23 LEU 4 HD23 LEU 4 -6.042 -2.761 8.054 616 H THR 5 H THR 5 -9.565 -2.352 6.290 617 HA THR 5 HA THR 5 -10.582 -1.613 3.620 618 HB THR 5 HB THR 5 -12.628 -2.032 5.780 619 HG1 THR 5 HG1 THR 5 -11.596 -4.021 5.669 620 HG21 THR 5 HG21 THR 5 -12.654 -2.375 2.743 621 HG22 THR 5 HG22 THR 5 -14.067 -2.454 3.816 622 HG23 THR 5 HG23 THR 5 -13.204 -0.920 3.601 623 H ARG 6 H ARG 6 -9.667 0.374 3.726 624 HA ARG 6 HA ARG 6 -10.276 2.192 6.044 625 HB2 ARG 6 HB2 ARG 6 -8.140 2.195 3.868 626 HB3 ARG 6 HB3 ARG 6 -8.429 3.560 4.941 627 HG2 ARG 6 HG2 ARG 6 -8.175 1.204 6.583 628 HG3 ARG 6 HG3 ARG 6 -6.837 1.231 5.413 629 HD2 ARG 6 HD2 ARG 6 -6.168 2.468 7.379 630 HD3 ARG 6 HD3 ARG 6 -6.396 3.620 6.049 631 HE ARG 6 HE ARG 6 -8.805 3.777 7.187 632 HH11 ARG 6 HH11 ARG 6 -5.592 3.767 8.674 633 HH12 ARG 6 HH12 ARG 6 -6.128 4.621 10.104 634 HH21 ARG 6 HH21 ARG 6 -9.461 4.888 9.048 635 HH22 ARG 6 HH22 ARG 6 -8.311 5.266 10.314 636 H LYS 7 H LYS 7 -10.480 4.492 5.460 637 HA LYS 7 HA LYS 7 -12.237 4.746 3.066 638 HB2 LYS 7 HB2 LYS 7 -12.292 6.024 5.810 639 HB3 LYS 7 HB3 LYS 7 -12.962 6.859 4.398 640 HG2 LYS 7 HG2 LYS 7 -14.228 4.671 3.892 641 HG3 LYS 7 HG3 LYS 7 -13.859 4.234 5.579 642 HD2 LYS 7 HD2 LYS 7 -15.270 6.770 4.642 643 HD3 LYS 7 HD3 LYS 7 -16.083 5.346 5.290 644 HE2 LYS 7 HE2 LYS 7 -14.040 7.046 6.790 645 HE3 LYS 7 HE3 LYS 7 -15.796 7.149 6.983 646 HZ1 LYS 7 HZ1 LYS 7 -14.821 5.792 8.677 647 HZ2 LYS 7 HZ2 LYS 7 -15.784 4.859 7.725 648 HZ3 LYS 7 HZ3 LYS 7 -14.145 4.787 7.569 649 H VAL 8 H VAL 8 -12.332 7.005 2.171 650 HA VAL 8 HA VAL 8 -9.665 7.555 1.259 651 HB VAL 8 HB VAL 8 -10.599 9.375 -0.013 652 HG11 VAL 8 HG11 VAL 8 -10.875 7.026 -0.773 653 HG12 VAL 8 HG12 VAL 8 -12.461 6.958 0.031 654 HG13 VAL 8 HG13 VAL 8 -12.208 8.069 -1.326 655 HG21 VAL 8 HG21 VAL 8 -13.221 8.873 1.445 656 HG22 VAL 8 HG22 VAL 8 -12.199 10.334 1.570 657 HG23 VAL 8 HG23 VAL 8 -12.968 9.925 0.027 658 H GLY 9 H GLY 9 -8.172 9.006 1.796 659 HA2 GLY 9 HA2 GLY 9 -7.308 10.934 2.808 660 HA3 GLY 9 HA3 GLY 9 -8.794 11.136 3.748 661 H GLU 10 H GLU 10 -7.785 7.864 3.903 662 HA GLU 10 HA GLU 10 -6.508 8.385 6.547 663 HB2 GLU 10 HB2 GLU 10 -8.003 5.919 5.585 664 HB3 GLU 10 HB3 GLU 10 -7.349 6.218 7.209 665 HG2 GLU 10 HG2 GLU 10 -8.821 8.186 7.444 666 HG3 GLU 10 HG3 GLU 10 -9.526 7.857 5.851 667 H SER 11 H SER 11 -5.200 6.170 7.175 668 HA SER 11 HA SER 11 -3.347 5.605 4.923 669 HB2 SER 11 HB2 SER 11 -2.547 6.895 7.552 670 HB3 SER 11 HB3 SER 11 -1.417 6.326 6.307 671 HG SER 11 HG SER 11 -2.229 7.852 4.903 672 H ILE 12 H ILE 12 -1.586 4.180 5.552 673 HA ILE 12 HA ILE 12 -2.015 2.263 7.765 674 HB ILE 12 HB ILE 12 -1.883 1.601 4.786 675 HG12 ILE 12 HG12 ILE 12 -4.153 2.186 5.537 676 HG13 ILE 12 HG13 ILE 12 -4.026 0.488 5.095 677 HG21 ILE 12 HG21 ILE 12 -1.719 -0.277 7.171 678 HG22 ILE 12 HG22 ILE 12 -2.053 -0.796 5.509 679 HG23 ILE 12 HG23 ILE 12 -0.506 -0.036 5.894 680 HD11 ILE 12 HD11 ILE 12 -4.070 1.619 7.924 681 HD12 ILE 12 HD12 ILE 12 -5.328 0.646 7.132 682 HD13 ILE 12 HD13 ILE 12 -3.780 -0.097 7.538 683 H ASN 13 H ASN 13 0.054 0.849 7.938 684 HA ASN 13 HA ASN 13 2.401 2.282 6.794 685 HB2 ASN 13 HB2 ASN 13 1.794 1.755 9.711 686 HB3 ASN 13 HB3 ASN 13 3.456 1.908 9.130 687 HD21 ASN 13 HD22 ASN 13 0.311 3.570 8.963 688 HD22 ASN 13 HD21 ASN 13 0.964 5.209 9.060 689 H ILE 14 H ILE 14 4.325 1.188 6.816 690 HA ILE 14 HA ILE 14 4.314 -1.738 7.276 691 HB ILE 14 HB ILE 14 5.175 -0.460 4.647 692 HG12 ILE 14 HG12 ILE 14 2.721 -2.153 5.295 693 HG13 ILE 14 HG13 ILE 14 2.714 -0.442 4.846 694 HG21 ILE 14 HG21 ILE 14 6.480 -2.470 5.299 695 HG22 ILE 14 HG22 ILE 14 4.964 -3.379 5.505 696 HG23 ILE 14 HG23 ILE 14 5.467 -2.800 3.903 697 HD11 ILE 14 HD11 ILE 14 3.750 -1.059 2.640 698 HD12 ILE 14 HD12 ILE 14 3.525 -2.772 3.072 699 HD13 ILE 14 HD13 ILE 14 2.119 -1.712 2.896 700 H GLY 15 H GLY 15 6.393 -2.576 7.673 701 HA2 GLY 15 HA2 GLY 15 8.523 -2.496 8.557 702 HA3 GLY 15 HA3 GLY 15 8.856 -1.298 7.291 703 H ASP 16 H ASP 16 10.102 0.111 8.456 704 HA ASP 16 HA ASP 16 8.666 1.670 10.530 705 HB2 ASP 16 HB2 ASP 16 10.688 1.883 11.825 706 HB3 ASP 16 HB3 ASP 16 10.286 0.179 11.620 707 H ASP 17 H ASP 17 9.545 1.752 7.485 708 HA ASP 17 HA ASP 17 10.169 4.640 7.557 709 HB2 ASP 17 HB2 ASP 17 11.678 2.594 5.874 710 HB3 ASP 17 HB3 ASP 17 11.817 4.343 5.714 711 H ILE 18 H ILE 18 7.862 2.520 6.695 712 HA ILE 18 HA ILE 18 7.374 3.963 4.142 713 HB ILE 18 HB ILE 18 6.721 1.040 4.637 714 HG12 ILE 18 HG12 ILE 18 8.385 0.953 2.528 715 HG13 ILE 18 HG13 ILE 18 9.085 2.364 3.336 716 HG21 ILE 18 HG21 ILE 18 5.123 2.104 3.154 717 HG22 ILE 18 HG22 ILE 18 6.436 2.845 2.206 718 HG23 ILE 18 HG23 ILE 18 6.203 1.082 2.196 719 HD11 ILE 18 HD11 ILE 18 8.554 -0.355 4.613 720 HD12 ILE 18 HD12 ILE 18 10.145 0.223 4.058 721 HD13 ILE 18 HD13 ILE 18 9.340 1.020 5.423 722 H THR 19 H THR 19 5.327 4.593 3.721 723 HA THR 19 HA THR 19 3.133 3.849 5.570 724 HB THR 19 HB THR 19 3.857 6.708 4.793 725 HG1 THR 19 HG1 THR 19 4.051 5.375 7.287 726 HG21 THR 19 HG21 THR 19 1.724 5.584 6.648 727 HG22 THR 19 HG22 THR 19 2.148 7.306 6.500 728 HG23 THR 19 HG23 THR 19 1.446 6.454 5.119 729 H ILE 20 H ILE 20 1.040 4.260 4.613 730 HA ILE 20 HA ILE 20 1.021 4.630 1.660 731 HB ILE 20 HB ILE 20 -0.418 2.478 3.270 732 HG12 ILE 20 HG12 ILE 20 1.996 1.994 2.955 733 HG13 ILE 20 HG13 ILE 20 0.934 0.835 2.153 734 HG21 ILE 20 HG21 ILE 20 -0.455 3.124 0.297 735 HG22 ILE 20 HG22 ILE 20 -1.128 1.645 1.021 736 HG23 ILE 20 HG23 ILE 20 -1.816 3.228 1.433 737 HD11 ILE 20 HD11 ILE 20 1.332 1.864 -0.018 738 HD12 ILE 20 HD12 ILE 20 2.314 3.146 0.732 739 HD13 ILE 20 HD13 ILE 20 2.881 1.468 0.752 740 H THR 21 H THR 21 -0.869 5.637 0.897 741 HA THR 21 HA THR 21 -2.911 6.413 2.913 742 HB THR 21 HB THR 21 -1.423 8.382 1.128 743 HG1 THR 21 HG1 THR 21 -0.609 9.120 3.122 744 HG21 THR 21 HG21 THR 21 -2.643 10.094 2.407 745 HG22 THR 21 HG22 THR 21 -3.793 9.014 1.596 746 HG23 THR 21 HG23 THR 21 -3.474 8.833 3.339 747 H ILE 22 H ILE 22 -4.928 6.802 2.033 748 HA ILE 22 HA ILE 22 -5.251 6.138 -0.849 749 HB ILE 22 HB ILE 22 -6.380 4.530 0.402 750 HG12 ILE 22 HG12 ILE 22 -8.768 4.888 0.058 751 HG13 ILE 22 HG13 ILE 22 -8.523 6.637 -0.105 752 HG21 ILE 22 HG21 ILE 22 -7.439 6.724 2.212 753 HG22 ILE 22 HG22 ILE 22 -7.909 5.011 2.280 754 HG23 ILE 22 HG23 ILE 22 -6.236 5.470 2.622 755 HD11 ILE 22 HD11 ILE 22 -8.781 5.553 -2.291 756 HD12 ILE 22 HD12 ILE 22 -7.182 6.302 -2.113 757 HD13 ILE 22 HD13 ILE 22 -7.352 4.533 -1.948 758 H LEU 23 H LEU 23 -5.102 8.052 -1.929 759 HA LEU 23 HA LEU 23 -5.828 10.538 -0.708 760 HB2 LEU 23 HB2 LEU 23 -5.450 9.992 -3.669 761 HB3 LEU 23 HB3 LEU 23 -5.318 11.537 -2.834 762 HG LEU 23 HG LEU 23 -3.417 9.175 -2.717 763 HD11 LEU 23 HD11 LEU 23 -3.170 10.808 -4.566 764 HD12 LEU 23 HD12 LEU 23 -3.090 12.135 -3.387 765 HD13 LEU 23 HD13 LEU 23 -1.800 10.922 -3.432 766 HD21 LEU 23 HD21 LEU 23 -2.059 10.545 -1.124 767 HD22 LEU 23 HD22 LEU 23 -3.437 11.653 -0.942 768 HD23 LEU 23 HD23 LEU 23 -3.580 9.961 -0.406 769 H GLY 24 H GLY 24 -7.628 8.235 -2.736 770 HA2 GLY 24 HA2 GLY 24 -10.108 8.826 -1.883 771 HA3 GLY 24 HA3 GLY 24 -9.890 10.104 -3.071 772 H VAL 25 H VAL 25 -11.867 8.847 -3.927 773 HA VAL 25 HA VAL 25 -10.882 6.808 -5.860 774 HB VAL 25 HB VAL 25 -12.752 5.386 -5.511 775 HG11 VAL 25 HG11 VAL 25 -12.500 4.674 -3.203 776 HG12 VAL 25 HG12 VAL 25 -10.914 5.190 -3.831 777 HG13 VAL 25 HG13 VAL 25 -11.838 6.254 -2.739 778 HG21 VAL 25 HG21 VAL 25 -13.869 7.504 -3.642 779 HG22 VAL 25 HG22 VAL 25 -14.525 6.996 -5.223 780 HG23 VAL 25 HG23 VAL 25 -14.532 5.865 -3.864 781 H SER 26 H SER 26 -12.284 6.510 -7.718 782 HA SER 26 HA SER 26 -14.306 8.571 -8.281 783 HB2 SER 26 HB2 SER 26 -11.771 8.236 -9.951 784 HB3 SER 26 HB3 SER 26 -13.195 9.182 -10.423 785 HG SER 26 HG SER 26 -11.580 10.475 -9.452 786 H GLY 27 H GLY 27 -15.774 6.795 -8.345 787 HA2 GLY 27 HA2 GLY 27 -16.971 5.195 -9.527 788 HA3 GLY 27 HA3 GLY 27 -15.802 5.349 -10.857 789 H GLN 28 H GLN 28 -14.225 3.778 -11.098 790 HA GLN 28 HA GLN 28 -14.003 1.752 -8.901 791 HB2 GLN 28 HB2 GLN 28 -13.179 1.551 -11.831 792 HB3 GLN 28 HB3 GLN 28 -12.992 0.297 -10.605 793 HG2 GLN 28 HG2 GLN 28 -15.520 1.329 -11.866 794 HG3 GLN 28 HG3 GLN 28 -14.855 -0.320 -11.835 795 HE21 GLN 28 HE22 GLN 28 -14.365 -0.912 -9.236 796 HE22 GLN 28 HE21 GLN 28 -15.782 -0.694 -8.227 797 H GLN 29 H GLN 29 -12.357 4.314 -10.623 798 HA GLN 29 HA GLN 29 -9.701 3.380 -10.074 799 HB2 GLN 29 HB2 GLN 29 -10.855 6.122 -10.732 800 HB3 GLN 29 HB3 GLN 29 -9.158 5.872 -10.318 801 HG2 GLN 29 HG2 GLN 29 -9.293 5.815 -12.703 802 HG3 GLN 29 HG3 GLN 29 -8.890 4.218 -12.085 803 HE21 GLN 29 HE22 GLN 29 -9.729 2.886 -13.603 804 HE22 GLN 29 HE21 GLN 29 -11.443 2.852 -14.016 805 H VAL 30 H VAL 30 -8.285 4.033 -8.490 806 HA VAL 30 HA VAL 30 -9.361 5.262 -6.028 807 HB VAL 30 HB VAL 30 -7.848 2.609 -6.222 808 HG11 VAL 30 HG11 VAL 30 -8.995 4.032 -3.792 809 HG12 VAL 30 HG12 VAL 30 -8.044 2.527 -3.809 810 HG13 VAL 30 HG13 VAL 30 -7.277 4.069 -4.259 811 HG21 VAL 30 HG21 VAL 30 -10.701 3.226 -5.327 812 HG22 VAL 30 HG22 VAL 30 -10.234 2.304 -6.777 813 HG23 VAL 30 HG23 VAL 30 -9.889 1.645 -5.168 814 H ARG 31 H ARG 31 -8.063 7.021 -5.934 815 HA ARG 31 HA ARG 31 -5.345 6.907 -7.047 816 HB2 ARG 31 HB2 ARG 31 -6.874 8.868 -7.355 817 HB3 ARG 31 HB3 ARG 31 -6.763 9.184 -5.606 818 HG2 ARG 31 HG2 ARG 31 -4.322 9.422 -5.790 819 HG3 ARG 31 HG3 ARG 31 -4.391 9.043 -7.527 820 HD2 ARG 31 HD2 ARG 31 -5.955 11.329 -6.300 821 HD3 ARG 31 HD3 ARG 31 -4.277 11.532 -6.868 822 HE ARG 31 HE ARG 31 -5.901 10.340 -8.914 823 HH11 ARG 31 HH11 ARG 31 -5.228 13.417 -7.297 824 HH12 ARG 31 HH12 ARG 31 -5.682 14.375 -8.688 825 HH21 ARG 31 HH21 ARG 31 -6.542 11.664 -10.710 826 HH22 ARG 31 HH22 ARG 31 -6.405 13.401 -10.578 827 H ILE 32 H ILE 32 -3.577 6.474 -5.880 828 HA ILE 32 HA ILE 32 -3.872 6.300 -2.911 829 HB ILE 32 HB ILE 32 -2.309 4.315 -4.587 830 HG12 ILE 32 HG12 ILE 32 -5.244 4.200 -3.820 831 HG13 ILE 32 HG13 ILE 32 -4.528 4.142 -5.443 832 HG21 ILE 32 HG21 ILE 32 -2.517 2.910 -2.573 833 HG22 ILE 32 HG22 ILE 32 -1.831 4.471 -2.136 834 HG23 ILE 32 HG23 ILE 32 -3.547 4.133 -1.799 835 HD11 ILE 32 HD11 ILE 32 -3.427 1.980 -4.850 836 HD12 ILE 32 HD12 ILE 32 -4.319 2.003 -3.298 837 HD13 ILE 32 HD13 ILE 32 -5.206 1.918 -4.829 838 H GLY 33 H GLY 33 -1.895 6.511 -1.731 839 HA2 GLY 33 HA2 GLY 33 0.394 7.642 -3.275 840 HA3 GLY 33 HA3 GLY 33 -0.193 8.386 -1.779 841 H ILE 34 H ILE 34 2.432 7.362 -2.264 842 HA ILE 34 HA ILE 34 2.630 5.239 -0.191 843 HB ILE 34 HB ILE 34 4.019 5.227 -2.912 844 HG12 ILE 34 HG12 ILE 34 1.913 3.287 -1.861 845 HG13 ILE 34 HG13 ILE 34 1.593 4.596 -3.020 846 HG21 ILE 34 HG21 ILE 34 4.901 3.017 -2.160 847 HG22 ILE 34 HG22 ILE 34 5.431 4.330 -1.101 848 HG23 ILE 34 HG23 ILE 34 4.112 3.249 -0.587 849 HD11 ILE 34 HD11 ILE 34 1.893 2.570 -4.259 850 HD12 ILE 34 HD12 ILE 34 3.288 3.635 -4.554 851 HD13 ILE 34 HD13 ILE 34 3.446 2.232 -3.463 852 H ASN 35 H ASN 35 4.387 5.533 1.124 853 HA ASN 35 HA ASN 35 6.183 7.795 0.412 854 HB2 ASN 35 HB2 ASN 35 4.218 8.516 1.787 855 HB3 ASN 35 HB3 ASN 35 4.768 7.448 3.074 856 HD21 ASN 35 HD22 ASN 35 4.448 10.302 3.294 857 HD22 ASN 35 HD21 ASN 35 6.028 11.008 3.547 858 H ALA 36 H ALA 36 7.911 6.582 0.049 859 HA ALA 36 HA ALA 36 9.230 5.399 2.417 860 HB1 ALA 36 HB1 ALA 36 8.976 4.053 -0.311 861 HB2 ALA 36 HB2 ALA 36 10.036 3.515 0.998 862 HB3 ALA 36 HB3 ALA 36 8.269 3.466 1.217 863 HA PRO 37 HA PRO 37 12.587 7.727 0.758 864 HB2 PRO 37 HB2 PRO 37 14.718 6.054 1.413 865 HB3 PRO 37 HB3 PRO 37 13.907 7.180 2.561 866 HG2 PRO 37 HG2 PRO 37 13.513 4.208 2.214 867 HG3 PRO 37 HG3 PRO 37 13.565 5.161 3.724 868 HD2 PRO 37 HD2 PRO 37 11.238 4.340 2.572 869 HD3 PRO 37 HD3 PRO 37 11.356 5.912 3.428 870 H LYS 38 H LYS 38 13.998 7.752 -1.087 871 HA LYS 38 HA LYS 38 13.340 5.943 -3.214 872 HB2 LYS 38 HB2 LYS 38 15.319 8.168 -2.756 873 HB3 LYS 38 HB3 LYS 38 15.536 7.094 -4.146 874 HG2 LYS 38 HG2 LYS 38 14.287 8.985 -4.802 875 HG3 LYS 38 HG3 LYS 38 13.269 7.539 -4.924 876 HD2 LYS 38 HD2 LYS 38 11.837 9.268 -4.044 877 HD3 LYS 38 HD3 LYS 38 12.169 8.230 -2.724 878 HE2 LYS 38 HE2 LYS 38 12.362 10.556 -2.050 879 HE3 LYS 38 HE3 LYS 38 13.991 9.832 -1.984 880 HZ1 LYS 38 HZ1 LYS 38 12.887 11.532 -4.121 881 HZ2 LYS 38 HZ2 LYS 38 14.023 11.975 -3.032 882 HZ3 LYS 38 HZ3 LYS 38 14.378 10.834 -4.169 883 H ASP 39 H ASP 39 15.253 5.609 -0.574 884 HA ASP 39 HA ASP 39 17.395 3.909 -1.418 885 HB2 ASP 39 HB2 ASP 39 15.862 4.216 1.188 886 HB3 ASP 39 HB3 ASP 39 17.222 3.111 1.019 887 H VAL 40 H VAL 40 14.028 3.346 -1.473 888 HA VAL 40 HA VAL 40 14.502 0.429 -1.838 889 HB VAL 40 HB VAL 40 12.388 -0.067 -0.708 890 HG11 VAL 40 HG11 VAL 40 14.482 0.087 0.671 891 HG12 VAL 40 HG12 VAL 40 14.109 1.794 1.002 892 HG13 VAL 40 HG13 VAL 40 13.026 0.516 1.599 893 HG21 VAL 40 HG21 VAL 40 11.063 1.571 0.392 894 HG22 VAL 40 HG22 VAL 40 12.225 2.856 0.013 895 HG23 VAL 40 HG23 VAL 40 11.269 2.097 -1.297 896 H ALA 41 H ALA 41 12.525 -0.534 -3.087 897 HA ALA 41 HA ALA 41 12.068 1.406 -5.285 898 HB1 ALA 41 HB1 ALA 41 11.942 -1.638 -5.242 899 HB2 ALA 41 HB2 ALA 41 11.749 -0.612 -6.679 900 HB3 ALA 41 HB3 ALA 41 13.309 -0.656 -5.828 901 H VAL 42 H VAL 42 10.038 1.544 -6.348 902 HA VAL 42 HA VAL 42 7.787 -0.041 -5.450 903 HB VAL 42 HB VAL 42 7.450 1.438 -3.696 904 HG11 VAL 42 HG11 VAL 42 9.216 2.994 -4.029 905 HG12 VAL 42 HG12 VAL 42 8.441 3.665 -5.495 906 HG13 VAL 42 HG13 VAL 42 7.717 3.920 -3.882 907 HG21 VAL 42 HG21 VAL 42 5.430 1.394 -5.145 908 HG22 VAL 42 HG22 VAL 42 5.616 2.933 -4.261 909 HG23 VAL 42 HG23 VAL 42 6.017 2.855 -5.980 910 H HIS 43 H HIS 43 6.447 -0.346 -7.146 911 HA HIS 43 HA HIS 43 6.146 1.694 -9.225 912 HB2 HIS 43 HB2 HIS 43 6.980 -1.065 -10.138 913 HB3 HIS 43 HB3 HIS 43 6.961 0.454 -11.035 914 HD2 HIS 43 HD2 HIS 43 9.075 -1.528 -8.484 915 HE1 HIS 43 HE1 HIS 43 11.583 1.508 -10.091 916 HE2 HIS 43 HE2 HIS 43 11.512 -0.559 -8.614 917 H ARG 44 H ARG 44 4.538 0.885 -10.934 918 HA ARG 44 HA ARG 44 2.359 -0.639 -9.765 919 HB2 ARG 44 HB2 ARG 44 2.962 0.187 -12.642 920 HB3 ARG 44 HB3 ARG 44 1.422 -0.478 -12.065 921 HG2 ARG 44 HG2 ARG 44 1.168 1.465 -10.532 922 HG3 ARG 44 HG3 ARG 44 2.687 2.143 -11.158 923 HD2 ARG 44 HD2 ARG 44 0.162 1.573 -12.767 924 HD3 ARG 44 HD3 ARG 44 0.724 3.164 -12.248 925 HE ARG 44 HE ARG 44 2.710 2.862 -13.687 926 HH11 ARG 44 HH11 ARG 44 -0.107 0.813 -14.340 927 HH12 ARG 44 HH12 ARG 44 0.366 0.510 -15.996 928 HH21 ARG 44 HH21 ARG 44 3.268 2.464 -15.833 929 HH22 ARG 44 HH22 ARG 44 2.264 1.440 -16.839 930 H GLU 45 H GLU 45 1.628 -2.771 -10.617 931 HA GLU 45 HA GLU 45 3.801 -4.587 -10.875 932 HB2 GLU 45 HB2 GLU 45 2.013 -6.235 -11.587 933 HB3 GLU 45 HB3 GLU 45 1.826 -5.471 -10.010 934 HG2 GLU 45 HG2 GLU 45 -0.317 -5.590 -11.101 935 HG3 GLU 45 HG3 GLU 45 0.169 -3.913 -10.882 936 H GLU 46 H GLU 46 2.231 -2.587 -13.246 937 HA GLU 46 HA GLU 46 2.824 -4.119 -15.585 938 HB2 GLU 46 HB2 GLU 46 1.272 -2.124 -15.381 939 HB3 GLU 46 HB3 GLU 46 2.698 -1.094 -15.187 940 HG2 GLU 46 HG2 GLU 46 3.490 -1.812 -17.443 941 HG3 GLU 46 HG3 GLU 46 2.019 -2.788 -17.627 942 H ILE 47 H ILE 47 4.770 -2.063 -13.475 943 HA ILE 47 HA ILE 47 6.973 -1.978 -15.466 944 HB ILE 47 HB ILE 47 6.826 -0.662 -12.747 945 HG12 ILE 47 HG12 ILE 47 4.885 0.198 -13.836 946 HG13 ILE 47 HG13 ILE 47 6.143 1.430 -13.945 947 HG21 ILE 47 HG21 ILE 47 8.419 -0.045 -15.271 948 HG22 ILE 47 HG22 ILE 47 8.450 0.916 -13.772 949 HG23 ILE 47 HG23 ILE 47 9.044 -0.755 -13.768 950 HD11 ILE 47 HD11 ILE 47 5.266 -0.463 -16.155 951 HD12 ILE 47 HD12 ILE 47 4.955 1.280 -16.052 952 HD13 ILE 47 HD13 ILE 47 6.619 0.697 -16.287 953 H TYR 48 H TYR 48 6.028 -3.313 -12.311 954 HA TYR 48 HA TYR 48 8.600 -4.065 -11.392 955 HB2 TYR 48 HB2 TYR 48 6.514 -3.955 -10.056 956 HB3 TYR 48 HB3 TYR 48 5.892 -5.357 -10.931 957 HD1 TYR 48 HD1 TYR 48 8.537 -4.219 -8.559 958 HD2 TYR 48 HD2 TYR 48 6.529 -7.578 -10.347 959 HE1 TYR 48 HE1 TYR 48 9.597 -5.722 -6.905 960 HE2 TYR 48 HE2 TYR 48 7.587 -9.094 -8.699 961 HH TYR 48 HH TYR 48 9.817 -7.898 -6.171 962 H GLN 49 H GLN 49 6.346 -5.591 -13.655 963 HA GLN 49 HA GLN 49 7.434 -8.214 -13.668 964 HB2 GLN 49 HB2 GLN 49 5.804 -6.587 -15.645 965 HB3 GLN 49 HB3 GLN 49 6.194 -8.303 -15.899 966 HG2 GLN 49 HG2 GLN 49 5.007 -8.982 -13.942 967 HG3 GLN 49 HG3 GLN 49 4.918 -7.347 -13.321 968 HE21 GLN 49 HE22 GLN 49 2.585 -7.846 -13.100 969 HE22 GLN 49 HE21 GLN 49 1.542 -7.596 -14.484 970 H ARG 50 H ARG 50 8.671 -5.273 -15.018 971 HA ARG 50 HA ARG 50 10.263 -6.603 -17.113 972 HB2 ARG 50 HB2 ARG 50 9.918 -3.756 -16.094 973 HB3 ARG 50 HB3 ARG 50 11.229 -4.172 -17.182 974 HG2 ARG 50 HG2 ARG 50 9.331 -3.299 -18.438 975 HG3 ARG 50 HG3 ARG 50 9.629 -4.988 -18.872 976 HD2 ARG 50 HD2 ARG 50 7.751 -5.717 -17.482 977 HD3 ARG 50 HD3 ARG 50 7.540 -4.070 -16.862 978 HE ARG 50 HE ARG 50 6.470 -3.448 -18.829 979 HH11 ARG 50 HH11 ARG 50 7.913 -6.658 -19.226 980 HH12 ARG 50 HH12 ARG 50 7.092 -6.965 -20.737 981 HH21 ARG 50 HH21 ARG 50 5.431 -3.876 -20.807 982 HH22 ARG 50 HH22 ARG 50 5.695 -5.400 -21.627 983 H ILE 51 H ILE 51 10.595 -6.134 -13.745 984 HA ILE 51 HA ILE 51 13.502 -5.556 -13.910 985 HB ILE 51 HB ILE 51 11.344 -5.315 -11.807 986 HG12 ILE 51 HG12 ILE 51 13.141 -3.210 -13.086 987 HG13 ILE 51 HG13 ILE 51 11.562 -3.671 -13.749 988 HG21 ILE 51 HG21 ILE 51 13.401 -6.016 -10.686 989 HG22 ILE 51 HG22 ILE 51 14.291 -4.673 -11.482 990 HG23 ILE 51 HG23 ILE 51 13.003 -4.330 -10.311 991 HD11 ILE 51 HD11 ILE 51 11.286 -1.716 -12.360 992 HD12 ILE 51 HD12 ILE 51 10.485 -3.116 -11.611 993 HD13 ILE 51 HD13 ILE 51 12.049 -2.539 -10.975 994 H GLN 52 H GLN 52 11.459 -7.576 -11.698 995 HA GLN 52 HA GLN 52 13.630 -9.222 -10.881 996 HB2 GLN 52 HB2 GLN 52 11.728 -10.758 -10.115 997 HB3 GLN 52 HB3 GLN 52 11.783 -9.135 -9.437 998 HG2 GLN 52 HG2 GLN 52 9.484 -10.041 -10.195 999 HG3 GLN 52 HG3 GLN 52 9.932 -8.393 -10.653 1000 HE21 GLN 52 HE22 GLN 52 10.127 -7.813 -12.744 1001 HE22 GLN 52 HE21 GLN 52 9.973 -8.872 -14.116 1002 H ALA 53 H ALA 53 12.562 -9.077 -13.975 1003 HA ALA 53 HA ALA 53 11.946 -11.777 -14.621 1004 HB1 ALA 53 HB1 ALA 53 13.032 -9.515 -16.341 1005 HB2 ALA 53 HB2 ALA 53 12.262 -11.000 -16.939 1006 HB3 ALA 53 HB3 ALA 53 11.317 -9.830 -15.989 1007 H GLY 54 H GLY 54 15.022 -10.316 -13.885 1008 HA2 GLY 54 HA2 GLY 54 16.560 -12.497 -13.741 1009 HA3 GLY 54 HA3 GLY 54 16.521 -12.286 -15.500 1010 H LEU 55 H LEU 55 16.410 -9.391 -13.499 1011 HA LEU 55 HA LEU 55 19.297 -8.922 -13.875 1012 HB2 LEU 55 HB2 LEU 55 18.540 -6.683 -15.044 1013 HB3 LEU 55 HB3 LEU 55 18.820 -8.179 -15.961 1014 HG LEU 55 HG LEU 55 16.202 -8.518 -15.663 1015 HD11 LEU 55 HD11 LEU 55 16.447 -5.485 -15.527 1016 HD12 LEU 55 HD12 LEU 55 14.954 -6.441 -15.664 1017 HD13 LEU 55 HD13 LEU 55 15.903 -6.498 -14.172 1018 HD21 LEU 55 HD21 LEU 55 17.389 -8.262 -17.774 1019 HD22 LEU 55 HD22 LEU 55 15.882 -7.315 -17.769 1020 HD23 LEU 55 HD23 LEU 55 17.454 -6.499 -17.548 1021 H THR 56 H THR 56 16.202 -7.950 -12.518 1022 HA THR 56 HA THR 56 15.580 -6.257 -11.248 1023 HB THR 56 HB THR 56 17.965 -6.973 -9.512 1024 HG1 THR 56 HG1 THR 56 16.767 -8.796 -8.924 1025 HG21 THR 56 HG21 THR 56 15.015 -6.417 -8.933 1026 HG22 THR 56 HG22 THR 56 16.251 -6.815 -7.715 1027 HG23 THR 56 HG23 THR 56 16.352 -5.291 -8.618 1028 H ALA 57 H ALA 57 17.266 -5.261 -13.346 1029 HA ALA 57 HA ALA 57 17.898 -2.651 -12.171 1030 HB1 ALA 57 HB1 ALA 57 19.995 -4.337 -13.583 1031 HB2 ALA 57 HB2 ALA 57 20.182 -2.625 -13.125 1032 HB3 ALA 57 HB3 ALA 57 20.009 -3.871 -11.869 1033 HA PRO 58 HA PRO 58 15.760 -2.007 -16.132 1034 HB2 PRO 58 HB2 PRO 58 16.235 0.782 -15.101 1035 HB3 PRO 58 HB3 PRO 58 14.769 0.106 -15.886 1036 HG2 PRO 58 HG2 PRO 58 14.853 0.406 -13.196 1037 HG3 PRO 58 HG3 PRO 58 14.208 -1.118 -13.896 1038 HD2 PRO 58 HD2 PRO 58 16.968 -0.588 -12.774 1039 HD3 PRO 58 HD3 PRO 58 15.892 -2.000 -12.507 1040 H ASP 59 H ASP 59 16.142 -0.263 -17.900 1041 HA ASP 59 HA ASP 59 18.653 -0.700 -19.078 1042 HB2 ASP 59 HB2 ASP 59 16.515 -0.210 -20.196 1043 HB3 ASP 59 HB3 ASP 59 16.608 1.473 -19.642 1044 H5' U 36 H5' U 36 -19.384 0.607 10.550 1045 H5'' U 36 H5'' U 36 -19.870 0.457 8.846 1046 H4' U 36 H4' U 36 -19.897 -1.952 10.696 1047 H3' U 36 H3' U 36 -17.598 -0.607 10.693 1048 H2' U 36 H2' U 36 -17.869 0.034 8.416 1049 HO2' U 36 HO2' U 36 -16.017 -2.113 8.466 1050 H1' U 36 H1' U 36 -18.153 -2.891 7.670 1051 H3 U 36 H3 U 36 -20.899 -2.088 3.922 1052 H5 U 36 H5 U 36 -18.216 1.118 4.341 1053 H6 U 36 H6 U 36 -17.677 0.296 6.558 1054 HO5' U 36 HO5' U 36 -21.644 0.970 10.217 1055 H5' C 37 H5' C 37 -15.377 -4.891 11.652 1056 H5'' C 37 H5'' C 37 -15.828 -4.947 13.353 1057 H4' C 37 H4' C 37 -13.692 -4.666 13.919 1058 H3' C 37 H3' C 37 -14.284 -2.061 13.632 1059 H2' C 37 H2' C 37 -14.275 -1.924 11.280 1060 HO2' C 37 HO2' C 37 -11.596 -1.385 12.020 1061 H1' C 37 H1' C 37 -11.758 -3.455 10.827 1062 H41 C 37 H41 C 37 -14.730 -5.712 5.685 1063 H42 C 37 H42 C 37 -16.232 -4.935 6.158 1064 H5 C 37 H5 C 37 -16.486 -3.692 8.274 1065 H6 C 37 H6 C 37 -15.357 -2.995 10.259 1066 H5' A 38 H5' A 38 -11.741 -5.294 14.157 1067 H5'' A 38 H5'' A 38 -11.408 -5.787 15.827 1068 H4' A 38 H4' A 38 -9.811 -6.939 14.530 1069 H3' A 38 H3' A 38 -8.734 -5.292 16.397 1070 H2' A 38 H2' A 38 -8.768 -3.298 15.038 1071 HO2' A 38 HO2' A 38 -6.251 -4.551 14.699 1072 H1' A 38 H1' A 38 -7.540 -4.818 12.756 1073 H8 A 38 H8 A 38 -9.369 -1.761 13.908 1074 H61 A 38 H61 A 38 -10.177 -0.386 7.905 1075 H62 A 38 H62 A 38 -10.250 0.233 9.549 1076 H2 A 38 H2 A 38 -8.701 -4.576 8.196 1077 H5' G 39 H5' G 39 -8.409 -8.185 13.136 1078 H5'' G 39 H5'' G 39 -8.575 -9.749 13.952 1079 H4' G 39 H4' G 39 -7.930 -10.451 11.877 1080 H3' G 39 H3' G 39 -5.953 -10.869 13.682 1081 H2' G 39 H2' G 39 -4.795 -8.833 13.352 1082 HO2' G 39 HO2' G 39 -3.723 -10.670 11.476 1083 H1' G 39 H1' G 39 -5.034 -8.895 10.363 1084 H8 G 39 H8 G 39 -7.127 -6.252 11.107 1085 H1 G 39 H1 G 39 -1.223 -4.342 12.737 1086 H21 G 39 H21 G 39 0.108 -6.051 12.917 1087 H22 G 39 H22 G 39 -0.406 -7.695 12.578 1088 H5' G 40 H5' G 40 -4.472 -11.724 9.291 1089 H5'' G 40 H5'' G 40 -4.190 -13.469 9.294 1090 H4' G 40 H4' G 40 -2.709 -12.300 7.757 1091 H3' G 40 H3' G 40 -1.829 -14.228 9.652 1092 H2' G 40 H2' G 40 -0.587 -12.548 10.867 1093 HO2' G 40 HO2' G 40 1.041 -13.459 8.715 1094 H1' G 40 H1' G 40 -0.076 -11.341 8.120 1095 H8 G 40 H8 G 40 -0.948 -9.926 11.630 1096 H1 G 40 H1 G 40 4.687 -7.997 9.232 1097 H21 G 40 H21 G 40 5.087 -9.040 7.302 1098 H22 G 40 H22 G 40 3.940 -10.147 6.599 1099 H5' A 41 H5' A 41 -2.981 -15.102 5.119 1100 H5'' A 41 H5'' A 41 -3.234 -13.712 6.187 1101 H4' A 41 H4' A 41 -5.016 -16.171 6.315 1102 H3' A 41 H3' A 41 -4.982 -13.928 4.339 1103 H2' A 41 H2' A 41 -7.264 -13.458 4.623 1104 HO2' A 41 HO2' A 41 -7.891 -15.675 4.291 1105 H1' A 41 H1' A 41 -7.552 -14.335 7.291 1106 H8 A 41 H8 A 41 -5.302 -11.675 5.515 1107 H61 A 41 H61 A 41 -8.566 -7.632 8.947 1108 H62 A 41 H62 A 41 -7.334 -7.768 7.708 1109 H2 A 41 H2 A 41 -9.915 -11.716 9.972 1110 H5' C 42 H5' C 42 -6.346 -13.811 0.264 1111 H5'' C 42 H5'' C 42 -5.608 -13.057 1.686 1112 H4' C 42 H4' C 42 -7.737 -12.147 2.403 1113 H3' C 42 H3' C 42 -9.188 -14.064 1.312 1114 H2' C 42 H2' C 42 -8.162 -13.797 -0.904 1115 HO2' C 42 HO2' C 42 -9.915 -12.905 -2.176 1116 H1' C 42 H1' C 42 -8.956 -10.900 -0.657 1117 H41 C 42 H41 C 42 -5.791 -11.028 -6.232 1118 H42 C 42 H42 C 42 -4.305 -11.459 -5.394 1119 H5 C 42 H5 C 42 -4.225 -11.922 -3.000 1120 H6 C 42 H6 C 42 -5.574 -12.059 -0.961 1121 H5' A 43 H5' A 43 -11.383 -15.047 2.507 1122 H5'' A 43 H5'' A 43 -11.140 -14.196 0.974 1123 H4' A 43 H4' A 43 -13.735 -13.864 1.031 1124 H3' A 43 H3' A 43 -13.922 -15.452 3.153 1125 H2' A 43 H2' A 43 -12.275 -17.047 2.514 1126 HO2' A 43 HO2' A 43 -14.225 -18.206 2.933 1127 H1' A 43 H1' A 43 -13.253 -17.490 -0.245 1128 H8 A 43 H8 A 43 -10.446 -15.283 -0.611 1129 H61 A 43 H61 A 43 -6.595 -20.093 0.176 1130 H62 A 43 H62 A 43 -6.711 -18.414 -0.329 1131 H2 A 43 H2 A 43 -10.633 -21.333 1.517 1132 H5' U 44 H5' U 44 -16.939 -13.927 -1.201 1133 H5'' U 44 H5'' U 44 -15.584 -15.050 -0.990 1134 H4' U 44 H4' U 44 -15.291 -12.062 -1.590 1135 H3' U 44 H3' U 44 -15.246 -14.529 -3.353 1136 HO3' U 44 HO3' U 44 -16.186 -11.882 -3.830 1137 H2' U 44 H2' U 44 -13.661 -13.395 -4.758 1138 HO2' U 44 HO2' U 44 -13.107 -11.201 -4.302 1139 H1' U 44 H1' U 44 -12.096 -12.609 -2.686 1140 H3 U 44 H3 U 44 -9.930 -16.161 -4.527 1141 H5 U 44 H5 U 44 -13.120 -17.891 -2.397 1142 H6 U 44 H6 U 44 -13.967 -15.684 -1.976 Start of MODEL 13 1 H1 MET 1 H1 MET 1 8.501 10.930 -2.651 2 H2 MET 1 H2 MET 1 8.556 9.331 -2.260 3 H3 MET 1 H3 MET 1 8.430 10.466 -1.073 4 HA MET 1 HA MET 1 6.327 9.386 -1.422 5 HB2 MET 1 HB2 MET 1 6.372 11.759 -0.704 6 HB3 MET 1 HB3 MET 1 6.430 12.274 -2.395 7 HG2 MET 1 HG2 MET 1 4.146 12.463 -1.603 8 HG3 MET 1 HG3 MET 1 4.235 11.174 -2.793 9 HE1 MET 1 HE1 MET 1 2.058 9.979 -2.225 10 HE2 MET 1 HE2 MET 1 1.404 9.931 -0.565 11 HE3 MET 1 HE3 MET 1 1.813 11.493 -1.350 12 H LEU 2 H LEU 2 4.779 8.552 -2.848 13 HA LEU 2 HA LEU 2 4.960 9.345 -5.696 14 HB2 LEU 2 HB2 LEU 2 5.616 6.712 -4.528 15 HB3 LEU 2 HB3 LEU 2 4.393 6.622 -5.801 16 HG LEU 2 HG LEU 2 7.142 7.874 -6.060 17 HD11 LEU 2 HD11 LEU 2 7.118 5.416 -5.902 18 HD12 LEU 2 HD12 LEU 2 5.941 5.319 -7.223 19 HD13 LEU 2 HD13 LEU 2 7.576 5.964 -7.537 20 HD21 LEU 2 HD21 LEU 2 6.596 7.954 -8.498 21 HD22 LEU 2 HD22 LEU 2 4.929 7.454 -8.130 22 HD23 LEU 2 HD23 LEU 2 5.545 9.027 -7.572 23 H ILE 3 H ILE 3 3.019 8.995 -6.863 24 HA ILE 3 HA ILE 3 0.656 8.082 -5.319 25 HB ILE 3 HB ILE 3 0.824 10.705 -6.888 26 HG12 ILE 3 HG12 ILE 3 -0.191 11.515 -4.619 27 HG13 ILE 3 HG13 ILE 3 0.515 10.045 -3.940 28 HG21 ILE 3 HG21 ILE 3 -1.316 9.516 -7.252 29 HG22 ILE 3 HG22 ILE 3 -1.533 9.381 -5.490 30 HG23 ILE 3 HG23 ILE 3 -1.531 10.979 -6.263 31 HD11 ILE 3 HD11 ILE 3 1.939 12.345 -5.344 32 HD12 ILE 3 HD12 ILE 3 1.973 11.951 -3.608 33 HD13 ILE 3 HD13 ILE 3 2.773 10.879 -4.765 34 H LEU 4 H LEU 4 -0.959 7.185 -6.620 35 HA LEU 4 HA LEU 4 -0.404 6.772 -9.505 36 HB2 LEU 4 HB2 LEU 4 -0.759 4.600 -7.401 37 HB3 LEU 4 HB3 LEU 4 -0.822 4.317 -9.141 38 HG LEU 4 HG LEU 4 1.625 5.337 -7.640 39 HD11 LEU 4 HD11 LEU 4 1.030 3.026 -7.079 40 HD12 LEU 4 HD12 LEU 4 0.845 2.625 -8.798 41 HD13 LEU 4 HD13 LEU 4 2.454 3.030 -8.146 42 HD21 LEU 4 HD21 LEU 4 1.217 4.418 -10.525 43 HD22 LEU 4 HD22 LEU 4 1.581 6.086 -10.001 44 HD23 LEU 4 HD23 LEU 4 2.784 4.804 -9.777 45 H THR 5 H THR 5 -2.301 5.668 -10.556 46 HA THR 5 HA THR 5 -4.749 5.747 -8.882 47 HB THR 5 HB THR 5 -4.971 6.611 -11.756 48 HG1 THR 5 HG1 THR 5 -3.533 8.063 -10.799 49 HG21 THR 5 HG21 THR 5 -6.951 5.927 -10.458 50 HG22 THR 5 HG22 THR 5 -6.514 7.083 -9.179 51 HG23 THR 5 HG23 THR 5 -6.993 7.676 -10.793 52 H ARG 6 H ARG 6 -4.927 3.621 -8.650 53 HA ARG 6 HA ARG 6 -4.919 1.861 -11.060 54 HB2 ARG 6 HB2 ARG 6 -4.721 1.379 -8.054 55 HB3 ARG 6 HB3 ARG 6 -4.933 0.053 -9.198 56 HG2 ARG 6 HG2 ARG 6 -2.697 1.938 -9.826 57 HG3 ARG 6 HG3 ARG 6 -2.506 0.970 -8.360 58 HD2 ARG 6 HD2 ARG 6 -1.543 -0.208 -10.250 59 HD3 ARG 6 HD3 ARG 6 -2.926 -1.094 -9.591 60 HE ARG 6 HE ARG 6 -4.078 0.379 -11.594 61 HH11 ARG 6 HH11 ARG 6 -1.338 -1.849 -11.447 62 HH12 ARG 6 HH12 ARG 6 -1.477 -2.319 -13.129 63 HH21 ARG 6 HH21 ARG 6 -4.210 -0.220 -13.809 64 HH22 ARG 6 HH22 ARG 6 -3.111 -1.419 -14.443 65 H LYS 7 H LYS 7 -6.641 -0.036 -10.715 66 HA LYS 7 HA LYS 7 -9.032 1.062 -9.374 67 HB2 LYS 7 HB2 LYS 7 -10.514 0.222 -11.143 68 HB3 LYS 7 HB3 LYS 7 -9.508 1.545 -11.699 69 HG2 LYS 7 HG2 LYS 7 -8.060 0.016 -12.919 70 HG3 LYS 7 HG3 LYS 7 -8.893 -1.398 -12.197 71 HD2 LYS 7 HD2 LYS 7 -11.035 -0.578 -13.213 72 HD3 LYS 7 HD3 LYS 7 -10.124 0.686 -14.054 73 HE2 LYS 7 HE2 LYS 7 -9.675 -2.317 -14.339 74 HE3 LYS 7 HE3 LYS 7 -10.607 -1.312 -15.460 75 HZ1 LYS 7 HZ1 LYS 7 -7.742 -0.988 -14.849 76 HZ2 LYS 7 HZ2 LYS 7 -8.357 -1.636 -16.227 77 HZ3 LYS 7 HZ3 LYS 7 -8.605 -0.048 -15.890 78 H VAL 8 H VAL 8 -10.793 -0.749 -9.249 79 HA VAL 8 HA VAL 8 -9.596 -2.531 -7.431 80 HB VAL 8 HB VAL 8 -11.733 -3.540 -7.132 81 HG11 VAL 8 HG11 VAL 8 -12.039 -0.562 -7.756 82 HG12 VAL 8 HG12 VAL 8 -13.034 -1.506 -6.638 83 HG13 VAL 8 HG13 VAL 8 -11.311 -1.229 -6.278 84 HG21 VAL 8 HG21 VAL 8 -12.664 -2.078 -9.626 85 HG22 VAL 8 HG22 VAL 8 -12.512 -3.846 -9.430 86 HG23 VAL 8 HG23 VAL 8 -13.689 -2.944 -8.448 87 H GLY 9 H GLY 9 -8.818 -4.496 -7.445 88 HA2 GLY 9 HA2 GLY 9 -8.624 -6.728 -8.247 89 HA3 GLY 9 HA3 GLY 9 -9.111 -6.194 -9.863 90 H GLU 10 H GLU 10 -7.058 -3.799 -9.185 91 HA GLU 10 HA GLU 10 -4.794 -5.123 -10.518 92 HB2 GLU 10 HB2 GLU 10 -5.295 -2.225 -9.739 93 HB3 GLU 10 HB3 GLU 10 -3.936 -2.815 -10.708 94 HG2 GLU 10 HG2 GLU 10 -6.876 -3.029 -11.474 95 HG3 GLU 10 HG3 GLU 10 -5.704 -1.891 -12.145 96 H SER 11 H SER 11 -2.561 -3.984 -9.712 97 HA SER 11 HA SER 11 -2.362 -4.217 -6.769 98 HB2 SER 11 HB2 SER 11 -0.817 -5.966 -8.732 99 HB3 SER 11 HB3 SER 11 -0.541 -5.890 -6.982 100 HG SER 11 HG SER 11 -1.904 -7.625 -7.586 101 H ILE 12 H ILE 12 -0.129 -3.803 -6.021 102 HA ILE 12 HA ILE 12 1.553 -2.095 -7.748 103 HB ILE 12 HB ILE 12 0.547 -1.259 -4.995 104 HG12 ILE 12 HG12 ILE 12 -0.211 -0.131 -7.724 105 HG13 ILE 12 HG13 ILE 12 -1.254 -1.133 -6.704 106 HG21 ILE 12 HG21 ILE 12 2.819 -0.384 -5.514 107 HG22 ILE 12 HG22 ILE 12 2.210 0.283 -7.043 108 HG23 ILE 12 HG23 ILE 12 1.637 0.916 -5.494 109 HD11 ILE 12 HD11 ILE 12 -1.114 0.594 -4.902 110 HD12 ILE 12 HD12 ILE 12 -0.239 1.651 -6.048 111 HD13 ILE 12 HD13 ILE 12 -1.900 1.151 -6.390 112 H ASN 13 H ASN 13 3.750 -1.754 -6.541 113 HA ASN 13 HA ASN 13 4.302 -4.029 -4.709 114 HB2 ASN 13 HB2 ASN 13 5.660 -3.447 -7.366 115 HB3 ASN 13 HB3 ASN 13 6.361 -4.482 -6.116 116 HD21 ASN 13 HD22 ASN 13 5.429 -6.519 -5.641 117 HD22 ASN 13 HD21 ASN 13 4.254 -7.253 -6.713 118 H ILE 14 H ILE 14 6.195 -3.878 -3.504 119 HA ILE 14 HA ILE 14 7.680 -1.319 -3.552 120 HB ILE 14 HB ILE 14 6.415 -2.512 -1.046 121 HG12 ILE 14 HG12 ILE 14 5.728 0.025 -2.590 122 HG13 ILE 14 HG13 ILE 14 4.724 -1.438 -2.502 123 HG21 ILE 14 HG21 ILE 14 8.593 -1.421 -0.636 124 HG22 ILE 14 HG22 ILE 14 8.013 0.045 -1.473 125 HG23 ILE 14 HG23 ILE 14 7.280 -0.473 0.055 126 HD11 ILE 14 HD11 ILE 14 5.408 0.422 -0.196 127 HD12 ILE 14 HD12 ILE 14 3.836 0.187 -0.973 128 HD13 ILE 14 HD13 ILE 14 4.557 -1.134 -0.024 129 H GLY 15 H GLY 15 9.808 -1.529 -2.692 130 HA2 GLY 15 HA2 GLY 15 11.803 -2.664 -2.424 131 HA3 GLY 15 HA3 GLY 15 10.886 -3.749 -1.367 132 H ASP 16 H ASP 16 11.803 -5.662 -2.003 133 HA ASP 16 HA ASP 16 11.005 -6.588 -4.704 134 HB2 ASP 16 HB2 ASP 16 13.056 -7.843 -4.935 135 HB3 ASP 16 HB3 ASP 16 13.425 -6.138 -4.692 136 H ASP 17 H ASP 17 10.173 -6.752 -1.663 137 HA ASP 17 HA ASP 17 9.430 -9.619 -1.786 138 HB2 ASP 17 HB2 ASP 17 10.557 -8.212 0.668 139 HB3 ASP 17 HB3 ASP 17 9.867 -9.834 0.641 140 H ILE 18 H ILE 18 8.165 -6.616 -1.952 141 HA ILE 18 HA ILE 18 5.883 -7.402 -0.213 142 HB ILE 18 HB ILE 18 6.895 -4.562 -0.606 143 HG12 ILE 18 HG12 ILE 18 7.112 -4.889 2.036 144 HG13 ILE 18 HG13 ILE 18 7.380 -6.580 1.587 145 HG21 ILE 18 HG21 ILE 18 4.671 -5.770 1.092 146 HG22 ILE 18 HG22 ILE 18 5.225 -4.080 1.189 147 HG23 ILE 18 HG23 ILE 18 4.474 -4.674 -0.293 148 HD11 ILE 18 HD11 ILE 18 9.265 -5.855 0.109 149 HD12 ILE 18 HD12 ILE 18 8.900 -4.158 0.499 150 HD13 ILE 18 HD13 ILE 18 9.491 -5.260 1.767 151 H THR 19 H THR 19 3.858 -7.010 -0.970 152 HA THR 19 HA THR 19 3.520 -5.693 -3.605 153 HB THR 19 HB THR 19 2.413 -8.434 -2.875 154 HG1 THR 19 HG1 THR 19 4.601 -8.521 -3.381 155 HG21 THR 19 HG21 THR 19 2.223 -6.751 -5.407 156 HG22 THR 19 HG22 THR 19 1.765 -8.465 -5.303 157 HG23 THR 19 HG23 THR 19 0.876 -7.266 -4.352 158 H ILE 20 H ILE 20 1.327 -4.999 -3.937 159 HA ILE 20 HA ILE 20 -0.431 -4.927 -1.530 160 HB ILE 20 HB ILE 20 0.317 -2.612 -3.354 161 HG12 ILE 20 HG12 ILE 20 2.126 -3.159 -1.732 162 HG13 ILE 20 HG13 ILE 20 1.410 -1.569 -1.483 163 HG21 ILE 20 HG21 ILE 20 -1.568 -2.754 -0.969 164 HG22 ILE 20 HG22 ILE 20 -1.027 -1.248 -1.748 165 HG23 ILE 20 HG23 ILE 20 -1.993 -2.411 -2.662 166 HD11 ILE 20 HD11 ILE 20 0.663 -4.044 0.130 167 HD12 ILE 20 HD12 ILE 20 1.826 -2.809 0.640 168 HD13 ILE 20 HD13 ILE 20 0.119 -2.372 0.421 169 H THR 21 H THR 21 -2.665 -4.785 -2.072 170 HA THR 21 HA THR 21 -3.339 -4.974 -4.968 171 HB THR 21 HB THR 21 -4.342 -6.944 -2.876 172 HG1 THR 21 HG1 THR 21 -2.144 -7.284 -3.305 173 HG21 THR 21 HG21 THR 21 -4.510 -6.906 -5.918 174 HG22 THR 21 HG22 THR 21 -5.098 -8.216 -4.864 175 HG23 THR 21 HG23 THR 21 -5.862 -6.617 -4.798 176 H ILE 22 H ILE 22 -5.390 -4.252 -5.474 177 HA ILE 22 HA ILE 22 -6.896 -2.966 -3.249 178 HB ILE 22 HB ILE 22 -6.232 -1.308 -4.765 179 HG12 ILE 22 HG12 ILE 22 -8.284 -0.538 -5.888 180 HG13 ILE 22 HG13 ILE 22 -9.028 -2.133 -5.638 181 HG21 ILE 22 HG21 ILE 22 -7.090 -3.097 -7.071 182 HG22 ILE 22 HG22 ILE 22 -6.541 -1.414 -7.209 183 HG23 ILE 22 HG23 ILE 22 -5.426 -2.646 -6.613 184 HD11 ILE 22 HD11 ILE 22 -8.098 -0.257 -3.448 185 HD12 ILE 22 HD12 ILE 22 -9.780 -0.562 -3.956 186 HD13 ILE 22 HD13 ILE 22 -8.834 -1.873 -3.213 187 H LEU 23 H LEU 23 -8.186 -4.606 -2.488 188 HA LEU 23 HA LEU 23 -9.243 -6.633 -4.207 189 HB2 LEU 23 HB2 LEU 23 -10.280 -5.857 -1.465 190 HB3 LEU 23 HB3 LEU 23 -10.482 -7.396 -2.307 191 HG LEU 23 HG LEU 23 -8.011 -6.280 -0.968 192 HD11 LEU 23 HD11 LEU 23 -9.597 -7.628 0.364 193 HD12 LEU 23 HD12 LEU 23 -9.499 -8.938 -0.837 194 HD13 LEU 23 HD13 LEU 23 -8.074 -8.510 0.131 195 HD21 LEU 23 HD21 LEU 23 -6.785 -8.278 -1.815 196 HD22 LEU 23 HD22 LEU 23 -8.127 -8.582 -2.946 197 HD23 LEU 23 HD23 LEU 23 -7.157 -7.093 -3.088 198 H GLY 24 H GLY 24 -10.503 -3.457 -3.187 199 HA2 GLY 24 HA2 GLY 24 -12.172 -3.032 -5.274 200 HA3 GLY 24 HA3 GLY 24 -13.192 -4.027 -4.248 201 H VAL 25 H VAL 25 -14.492 -1.906 -4.423 202 HA VAL 25 HA VAL 25 -13.798 -0.244 -2.057 203 HB VAL 25 HB VAL 25 -14.330 1.795 -3.147 204 HG11 VAL 25 HG11 VAL 25 -12.031 0.956 -3.564 205 HG12 VAL 25 HG12 VAL 25 -12.592 0.236 -5.097 206 HG13 VAL 25 HG13 VAL 25 -12.635 1.993 -4.875 207 HG21 VAL 25 HG21 VAL 25 -16.190 1.108 -4.541 208 HG22 VAL 25 HG22 VAL 25 -14.987 1.936 -5.533 209 HG23 VAL 25 HG23 VAL 25 -15.103 0.159 -5.589 210 H SER 26 H SER 26 -15.624 0.993 -1.227 211 HA SER 26 HA SER 26 -18.327 0.217 -2.066 212 HB2 SER 26 HB2 SER 26 -17.654 -1.589 -0.483 213 HB3 SER 26 HB3 SER 26 -17.301 -0.352 0.745 214 HG SER 26 HG SER 26 -19.800 -0.897 -0.488 215 H GLY 27 H GLY 27 -18.525 2.448 -2.591 216 HA2 GLY 27 HA2 GLY 27 -19.314 4.570 -2.074 217 HA3 GLY 27 HA3 GLY 27 -19.304 4.126 -0.362 218 H GLN 28 H GLN 28 -17.416 4.470 0.891 219 HA GLN 28 HA GLN 28 -15.222 6.031 -0.444 220 HB2 GLN 28 HB2 GLN 28 -16.222 6.167 2.426 221 HB3 GLN 28 HB3 GLN 28 -14.802 7.008 1.806 222 HG2 GLN 28 HG2 GLN 28 -17.658 7.491 0.902 223 HG3 GLN 28 HG3 GLN 28 -16.702 8.458 2.058 224 HE21 GLN 28 HE22 GLN 28 -16.575 7.248 -1.379 225 HE22 GLN 28 HE21 GLN 28 -15.753 8.654 -1.996 226 H GLN 29 H GLN 29 -16.148 3.231 1.487 227 HA GLN 29 HA GLN 29 -13.487 2.830 2.547 228 HB2 GLN 29 HB2 GLN 29 -15.795 0.851 2.198 229 HB3 GLN 29 HB3 GLN 29 -14.252 0.525 2.978 230 HG2 GLN 29 HG2 GLN 29 -15.854 1.034 4.705 231 HG3 GLN 29 HG3 GLN 29 -14.606 2.280 4.618 232 HE21 GLN 29 HE22 GLN 29 -15.380 4.248 4.918 233 HE22 GLN 29 HE21 GLN 29 -16.928 4.830 4.306 234 H VAL 30 H VAL 30 -11.954 1.358 1.852 235 HA VAL 30 HA VAL 30 -12.103 0.410 -0.956 236 HB VAL 30 HB VAL 30 -9.857 2.042 0.329 237 HG11 VAL 30 HG11 VAL 30 -9.088 0.243 -1.233 238 HG12 VAL 30 HG12 VAL 30 -10.117 0.958 -2.502 239 HG13 VAL 30 HG13 VAL 30 -8.754 1.879 -1.836 240 HG21 VAL 30 HG21 VAL 30 -10.355 3.681 -1.473 241 HG22 VAL 30 HG22 VAL 30 -11.767 2.709 -1.945 242 HG23 VAL 30 HG23 VAL 30 -11.713 3.491 -0.347 243 H ARG 31 H ARG 31 -11.936 -1.763 -0.638 244 HA ARG 31 HA ARG 31 -10.555 -2.762 1.741 245 HB2 ARG 31 HB2 ARG 31 -12.692 -3.729 0.718 246 HB3 ARG 31 HB3 ARG 31 -11.666 -4.401 -0.572 247 HG2 ARG 31 HG2 ARG 31 -10.328 -5.598 1.160 248 HG3 ARG 31 HG3 ARG 31 -11.268 -4.810 2.432 249 HD2 ARG 31 HD2 ARG 31 -13.344 -5.878 1.390 250 HD3 ARG 31 HD3 ARG 31 -12.230 -6.892 0.454 251 HE ARG 31 HE ARG 31 -12.251 -6.741 3.451 252 HH11 ARG 31 HH11 ARG 31 -12.070 -8.699 0.498 253 HH12 ARG 31 HH12 ARG 31 -11.830 -10.186 1.395 254 HH21 ARG 31 HH21 ARG 31 -11.946 -8.688 4.548 255 HH22 ARG 31 HH22 ARG 31 -11.768 -10.177 3.641 256 H ILE 32 H ILE 32 -8.498 -3.364 1.823 257 HA ILE 32 HA ILE 32 -6.971 -3.475 -0.745 258 HB ILE 32 HB ILE 32 -5.938 -2.231 1.820 259 HG12 ILE 32 HG12 ILE 32 -7.431 -0.901 -0.461 260 HG13 ILE 32 HG13 ILE 32 -7.811 -0.897 1.269 261 HG21 ILE 32 HG21 ILE 32 -5.050 -1.947 -1.084 262 HG22 ILE 32 HG22 ILE 32 -4.259 -1.231 0.342 263 HG23 ILE 32 HG23 ILE 32 -4.255 -2.976 0.138 264 HD11 ILE 32 HD11 ILE 32 -5.465 0.494 -0.069 265 HD12 ILE 32 HD12 ILE 32 -6.880 1.253 0.682 266 HD13 ILE 32 HD13 ILE 32 -5.702 0.389 1.696 267 H GLY 33 H GLY 33 -5.023 -4.737 -0.674 268 HA2 GLY 33 HA2 GLY 33 -4.814 -6.609 1.643 269 HA3 GLY 33 HA3 GLY 33 -4.715 -7.170 -0.039 270 H ILE 34 H ILE 34 -2.686 -7.447 1.968 271 HA ILE 34 HA ILE 34 -0.450 -5.929 0.739 272 HB ILE 34 HB ILE 34 -0.938 -6.240 3.731 273 HG12 ILE 34 HG12 ILE 34 -1.071 -3.688 2.073 274 HG13 ILE 34 HG13 ILE 34 -2.487 -4.583 2.658 275 HG21 ILE 34 HG21 ILE 34 1.049 -4.749 3.930 276 HG22 ILE 34 HG22 ILE 34 1.450 -6.258 3.112 277 HG23 ILE 34 HG23 ILE 34 1.226 -4.771 2.160 278 HD11 ILE 34 HD11 ILE 34 -1.667 -4.342 4.985 279 HD12 ILE 34 HD12 ILE 34 -0.371 -3.267 4.389 280 HD13 ILE 34 HD13 ILE 34 -2.073 -2.801 4.193 281 H ASN 35 H ASN 35 1.434 -7.124 0.637 282 HA ASN 35 HA ASN 35 1.371 -9.825 1.860 283 HB2 ASN 35 HB2 ASN 35 0.346 -9.824 -0.447 284 HB3 ASN 35 HB3 ASN 35 1.894 -9.281 -1.090 285 HD21 ASN 35 HD22 ASN 35 0.429 -11.748 -1.685 286 HD22 ASN 35 HD21 ASN 35 1.462 -13.082 -1.206 287 H ALA 36 H ALA 36 3.058 -9.618 3.156 288 HA ALA 36 HA ALA 36 5.726 -9.183 1.965 289 HB1 ALA 36 HB1 ALA 36 4.657 -7.739 4.428 290 HB2 ALA 36 HB2 ALA 36 6.337 -7.722 3.873 291 HB3 ALA 36 HB3 ALA 36 5.064 -6.968 2.873 292 HA PRO 37 HA PRO 37 6.657 -12.604 4.540 293 HB2 PRO 37 HB2 PRO 37 9.211 -11.936 5.434 294 HB3 PRO 37 HB3 PRO 37 8.840 -12.629 3.810 295 HG2 PRO 37 HG2 PRO 37 9.298 -9.741 4.594 296 HG3 PRO 37 HG3 PRO 37 9.915 -10.615 3.162 297 HD2 PRO 37 HD2 PRO 37 7.746 -8.987 3.028 298 HD3 PRO 37 HD3 PRO 37 7.790 -10.527 2.100 299 H LYS 38 H LYS 38 6.782 -13.221 6.758 300 HA LYS 38 HA LYS 38 5.658 -11.352 8.614 301 HB2 LYS 38 HB2 LYS 38 7.053 -14.015 9.106 302 HB3 LYS 38 HB3 LYS 38 5.952 -13.211 10.232 303 HG2 LYS 38 HG2 LYS 38 5.091 -14.088 7.428 304 HG3 LYS 38 HG3 LYS 38 4.985 -15.125 8.864 305 HD2 LYS 38 HD2 LYS 38 3.499 -13.426 9.904 306 HD3 LYS 38 HD3 LYS 38 3.584 -12.448 8.423 307 HE2 LYS 38 HE2 LYS 38 1.624 -13.734 8.158 308 HE3 LYS 38 HE3 LYS 38 2.840 -14.512 7.132 309 HZ1 LYS 38 HZ1 LYS 38 3.154 -16.135 8.870 310 HZ2 LYS 38 HZ2 LYS 38 2.076 -15.358 9.852 311 HZ3 LYS 38 HZ3 LYS 38 1.555 -16.066 8.470 312 H ASP 39 H ASP 39 8.716 -11.590 7.406 313 HA ASP 39 HA ASP 39 10.385 -10.992 9.676 314 HB2 ASP 39 HB2 ASP 39 10.649 -10.771 6.655 315 HB3 ASP 39 HB3 ASP 39 11.951 -10.305 7.748 316 H VAL 40 H VAL 40 8.064 -9.079 8.041 317 HA VAL 40 HA VAL 40 9.365 -6.604 9.076 318 HB VAL 40 HB VAL 40 8.558 -5.361 7.127 319 HG11 VAL 40 HG11 VAL 40 10.156 -7.815 6.270 320 HG12 VAL 40 HG12 VAL 40 10.101 -6.249 5.436 321 HG13 VAL 40 HG13 VAL 40 10.846 -6.365 7.043 322 HG21 VAL 40 HG21 VAL 40 7.598 -6.437 5.205 323 HG22 VAL 40 HG22 VAL 40 7.761 -8.036 5.966 324 HG23 VAL 40 HG23 VAL 40 6.621 -6.828 6.638 325 H ALA 41 H ALA 41 7.653 -4.777 9.187 326 HA ALA 41 HA ALA 41 5.305 -6.051 10.467 327 HB1 ALA 41 HB1 ALA 41 6.550 -3.295 10.878 328 HB2 ALA 41 HB2 ALA 41 5.192 -3.979 11.800 329 HB3 ALA 41 HB3 ALA 41 6.806 -4.716 11.920 330 H VAL 42 H VAL 42 3.216 -5.133 10.246 331 HA VAL 42 HA VAL 42 2.754 -2.872 8.464 332 HB VAL 42 HB VAL 42 2.774 -4.342 6.660 333 HG11 VAL 42 HG11 VAL 42 1.806 -6.646 6.714 334 HG12 VAL 42 HG12 VAL 42 3.224 -6.427 7.747 335 HG13 VAL 42 HG13 VAL 42 1.600 -6.463 8.481 336 HG21 VAL 42 HG21 VAL 42 -0.077 -4.636 7.685 337 HG22 VAL 42 HG22 VAL 42 0.567 -3.228 6.811 338 HG23 VAL 42 HG23 VAL 42 0.473 -4.825 6.019 339 H HIS 43 H HIS 43 1.091 -1.734 9.276 340 HA HIS 43 HA HIS 43 -1.170 -3.076 10.564 341 HB2 HIS 43 HB2 HIS 43 0.273 -0.956 12.170 342 HB3 HIS 43 HB3 HIS 43 -0.952 -2.110 12.683 343 HD2 HIS 43 HD2 HIS 43 2.828 -1.897 11.897 344 HE1 HIS 43 HE1 HIS 43 2.216 -5.460 14.127 345 HE2 HIS 43 HE2 HIS 43 3.966 -3.915 13.119 346 H ARG 44 H ARG 44 -2.765 -1.316 11.370 347 HA ARG 44 HA ARG 44 -3.213 0.686 9.346 348 HB2 ARG 44 HB2 ARG 44 -4.987 -0.456 10.661 349 HB3 ARG 44 HB3 ARG 44 -4.357 0.274 12.146 350 HG2 ARG 44 HG2 ARG 44 -4.886 2.532 11.256 351 HG3 ARG 44 HG3 ARG 44 -5.542 1.784 9.779 352 HD2 ARG 44 HD2 ARG 44 -7.229 0.595 11.122 353 HD3 ARG 44 HD3 ARG 44 -6.497 1.205 12.616 354 HE ARG 44 HE ARG 44 -7.274 3.367 10.856 355 HH11 ARG 44 HH11 ARG 44 -8.523 1.031 13.193 356 HH12 ARG 44 HH12 ARG 44 -9.856 2.055 13.680 357 HH21 ARG 44 HH21 ARG 44 -9.016 4.683 11.506 358 HH22 ARG 44 HH22 ARG 44 -10.142 4.110 12.717 359 H GLU 45 H GLU 45 -3.150 3.053 9.740 360 HA GLU 45 HA GLU 45 -0.679 3.854 10.825 361 HB2 GLU 45 HB2 GLU 45 -2.092 4.983 9.083 362 HB3 GLU 45 HB3 GLU 45 -3.154 5.577 10.358 363 HG2 GLU 45 HG2 GLU 45 -0.162 6.157 10.196 364 HG3 GLU 45 HG3 GLU 45 -1.401 7.190 9.473 365 H GLU 46 H GLU 46 -3.752 3.282 12.357 366 HA GLU 46 HA GLU 46 -3.436 4.897 14.698 367 HB2 GLU 46 HB2 GLU 46 -5.550 3.808 13.815 368 HB3 GLU 46 HB3 GLU 46 -4.884 2.243 14.288 369 HG2 GLU 46 HG2 GLU 46 -6.416 3.010 16.005 370 HG3 GLU 46 HG3 GLU 46 -4.779 3.054 16.669 371 H ILE 47 H ILE 47 -2.689 1.440 13.964 372 HA ILE 47 HA ILE 47 -1.818 0.912 16.677 373 HB ILE 47 HB ILE 47 -1.343 -0.731 14.169 374 HG12 ILE 47 HG12 ILE 47 -3.682 -0.292 14.109 375 HG13 ILE 47 HG13 ILE 47 -3.470 -1.931 14.737 376 HG21 ILE 47 HG21 ILE 47 -1.484 -2.638 15.773 377 HG22 ILE 47 HG22 ILE 47 -0.146 -1.532 16.134 378 HG23 ILE 47 HG23 ILE 47 -1.635 -1.476 17.110 379 HD11 ILE 47 HD11 ILE 47 -4.071 0.568 16.380 380 HD12 ILE 47 HD12 ILE 47 -5.205 -0.735 15.998 381 HD13 ILE 47 HD13 ILE 47 -3.808 -1.059 17.054 382 H TYR 48 H TYR 48 -0.329 2.013 13.706 383 HA TYR 48 HA TYR 48 2.335 1.150 14.103 384 HB2 TYR 48 HB2 TYR 48 1.340 2.029 12.020 385 HB3 TYR 48 HB3 TYR 48 1.209 3.628 12.753 386 HD1 TYR 48 HD2 TYR 48 3.640 1.026 11.663 387 HD2 TYR 48 HD1 TYR 48 3.031 5.137 12.772 388 HE1 TYR 48 HE2 TYR 48 5.898 1.590 10.798 389 HE2 TYR 48 HE1 TYR 48 5.246 5.726 11.892 390 HH TYR 48 HH TYR 48 7.166 4.949 10.846 391 H GLN 49 H GLN 49 0.503 3.811 15.553 392 HA GLN 49 HA GLN 49 2.806 5.313 16.408 393 HB2 GLN 49 HB2 GLN 49 -0.114 5.308 17.276 394 HB3 GLN 49 HB3 GLN 49 1.081 6.505 17.820 395 HG2 GLN 49 HG2 GLN 49 1.447 7.283 15.558 396 HG3 GLN 49 HG3 GLN 49 0.480 5.973 14.883 397 HE21 GLN 49 HE22 GLN 49 -0.868 7.516 13.819 398 HE22 GLN 49 HE21 GLN 49 -2.099 8.398 14.675 399 H ARG 50 H ARG 50 1.149 2.493 17.682 400 HA ARG 50 HA ARG 50 2.092 2.805 20.437 401 HB2 ARG 50 HB2 ARG 50 0.820 0.578 18.799 402 HB3 ARG 50 HB3 ARG 50 1.549 0.243 20.365 403 HG2 ARG 50 HG2 ARG 50 -0.798 0.594 20.698 404 HG3 ARG 50 HG3 ARG 50 0.077 1.953 21.427 405 HD2 ARG 50 HD2 ARG 50 -0.430 3.345 19.463 406 HD3 ARG 50 HD3 ARG 50 -1.246 1.969 18.687 407 HE ARG 50 HE ARG 50 -2.382 2.421 21.270 408 HH11 ARG 50 HH11 ARG 50 -2.280 3.939 18.067 409 HH12 ARG 50 HH12 ARG 50 -3.805 4.757 18.292 410 HH21 ARG 50 HH21 ARG 50 -4.378 3.494 21.505 411 HH22 ARG 50 HH22 ARG 50 -4.985 4.501 20.209 412 H ILE 51 H ILE 51 3.442 1.857 17.423 413 HA ILE 51 HA ILE 51 5.429 0.052 18.682 414 HB ILE 51 HB ILE 51 4.635 0.603 15.804 415 HG12 ILE 51 HG12 ILE 51 4.166 -1.815 17.601 416 HG13 ILE 51 HG13 ILE 51 2.953 -0.554 17.293 417 HG21 ILE 51 HG21 ILE 51 6.038 -1.306 15.218 418 HG22 ILE 51 HG22 ILE 51 7.027 -0.087 16.035 419 HG23 ILE 51 HG23 ILE 51 6.489 -1.527 16.932 420 HD11 ILE 51 HD11 ILE 51 2.522 -2.437 15.848 421 HD12 ILE 51 HD12 ILE 51 3.037 -1.042 14.878 422 HD13 ILE 51 HD13 ILE 51 4.177 -2.380 15.196 423 H GLN 52 H GLN 52 5.227 2.977 16.560 424 HA GLN 52 HA GLN 52 8.088 3.309 16.539 425 HB2 GLN 52 HB2 GLN 52 5.831 5.246 15.873 426 HB3 GLN 52 HB3 GLN 52 7.553 5.529 15.536 427 HG2 GLN 52 HG2 GLN 52 5.755 3.409 14.344 428 HG3 GLN 52 HG3 GLN 52 6.666 4.698 13.526 429 HE21 GLN 52 HE22 GLN 52 6.646 1.409 14.330 430 HE22 GLN 52 HE21 GLN 52 8.341 1.063 14.063 431 H ALA 53 H ALA 53 6.074 3.508 19.126 432 HA ALA 53 HA ALA 53 6.972 5.888 20.417 433 HB1 ALA 53 HB1 ALA 53 4.976 4.595 21.088 434 HB2 ALA 53 HB2 ALA 53 6.010 3.230 21.557 435 HB3 ALA 53 HB3 ALA 53 6.110 4.769 22.446 436 H GLY 54 H GLY 54 8.599 2.879 19.695 437 HA2 GLY 54 HA2 GLY 54 11.117 3.617 20.131 438 HA3 GLY 54 HA3 GLY 54 10.620 3.331 21.806 439 H LEU 55 H LEU 55 9.254 1.241 19.249 440 HA LEU 55 HA LEU 55 11.167 -0.896 19.844 441 HB2 LEU 55 HB2 LEU 55 9.402 -2.273 21.005 442 HB3 LEU 55 HB3 LEU 55 9.995 -0.877 21.902 443 HG LEU 55 HG LEU 55 7.967 0.432 21.096 444 HD11 LEU 55 HD11 LEU 55 7.034 -2.361 20.309 445 HD12 LEU 55 HD12 LEU 55 5.978 -0.938 20.502 446 HD13 LEU 55 HD13 LEU 55 7.199 -0.950 19.229 447 HD21 LEU 55 HD21 LEU 55 8.235 -0.454 23.337 448 HD22 LEU 55 HD22 LEU 55 6.540 -0.582 22.816 449 HD23 LEU 55 HD23 LEU 55 7.583 -2.029 22.828 450 H THR 56 H THR 56 10.112 -3.093 19.161 451 HA THR 56 HA THR 56 8.116 -2.871 17.008 452 HB THR 56 HB THR 56 9.559 -4.377 15.562 453 HG1 THR 56 HG1 THR 56 11.593 -3.325 17.229 454 HG21 THR 56 HG21 THR 56 10.637 -1.566 15.981 455 HG22 THR 56 HG22 THR 56 10.724 -2.543 14.500 456 HG23 THR 56 HG23 THR 56 9.153 -1.964 15.085 457 H ALA 57 H ALA 57 8.961 -4.185 19.837 458 HA ALA 57 HA ALA 57 7.440 -6.645 19.360 459 HB1 ALA 57 HB1 ALA 57 10.319 -6.686 20.351 460 HB2 ALA 57 HB2 ALA 57 9.209 -8.078 20.338 461 HB3 ALA 57 HB3 ALA 57 9.730 -7.341 18.809 462 HA PRO 58 HA PRO 58 6.482 -4.320 23.271 463 HB2 PRO 58 HB2 PRO 58 3.952 -5.808 22.614 464 HB3 PRO 58 HB3 PRO 58 4.160 -4.171 23.319 465 HG2 PRO 58 HG2 PRO 58 3.583 -4.453 20.681 466 HG3 PRO 58 HG3 PRO 58 4.849 -3.283 21.198 467 HD2 PRO 58 HD2 PRO 58 5.215 -6.086 20.107 468 HD3 PRO 58 HD3 PRO 58 6.097 -4.590 19.688 469 H ASP 59 H ASP 59 5.358 -5.181 25.300 470 HA ASP 59 HA ASP 59 6.899 -7.248 26.383 471 HB2 ASP 59 HB2 ASP 59 5.673 -5.367 27.534 472 HB3 ASP 59 HB3 ASP 59 4.173 -6.269 27.304 473 H5' U 36 H5' U 36 -5.114 10.952 -16.810 474 H5'' U 36 H5'' U 36 -6.098 10.484 -15.414 475 H4' U 36 H4' U 36 -3.530 12.130 -15.209 476 H3' U 36 H3' U 36 -3.314 9.604 -16.030 477 H2' U 36 H2' U 36 -5.011 8.668 -14.756 478 HO2' U 36 HO2' U 36 -3.060 7.516 -14.237 479 H1' U 36 H1' U 36 -4.237 9.893 -12.147 480 H3 U 36 H3 U 36 -8.543 11.453 -11.061 481 H5 U 36 H5 U 36 -8.921 8.058 -13.506 482 H6 U 36 H6 U 36 -6.566 8.183 -13.969 483 HO5' U 36 HO5' U 36 -6.781 12.454 -16.401 484 H5' C 37 H5' C 37 -0.393 9.966 -18.146 485 H5'' C 37 H5'' C 37 -1.869 9.243 -17.474 486 H4' C 37 H4' C 37 0.774 7.749 -17.579 487 H3' C 37 H3' C 37 -0.408 8.523 -19.919 488 H2' C 37 H2' C 37 -2.579 7.805 -19.420 489 HO2' C 37 HO2' C 37 -1.940 6.664 -21.323 490 H1' C 37 H1' C 37 -1.611 5.207 -18.259 491 H41 C 37 H41 C 37 -7.448 5.188 -15.779 492 H42 C 37 H42 C 37 -7.647 6.910 -16.071 493 H5 C 37 H5 C 37 -5.879 8.305 -16.994 494 H6 C 37 H6 C 37 -3.589 8.303 -17.829 495 H5' A 38 H5' A 38 2.313 9.086 -18.201 496 H5'' A 38 H5'' A 38 3.905 8.869 -18.965 497 H4' A 38 H4' A 38 4.323 9.145 -16.644 498 H3' A 38 H3' A 38 5.253 6.893 -17.904 499 H2' A 38 H2' A 38 3.321 5.550 -17.364 500 HO2' A 38 HO2' A 38 5.386 5.225 -15.472 501 H1' A 38 H1' A 38 3.511 6.638 -14.543 502 H8 A 38 H8 A 38 1.476 4.765 -17.130 503 H61 A 38 H61 A 38 -2.943 4.412 -12.787 504 H62 A 38 H62 A 38 -2.414 3.815 -14.345 505 H2 A 38 H2 A 38 0.155 7.300 -11.397 506 H5' G 39 H5' G 39 5.014 9.707 -14.615 507 H5'' G 39 H5'' G 39 6.262 10.900 -15.010 508 H4' G 39 H4' G 39 5.731 11.527 -12.852 509 H3' G 39 H3' G 39 8.230 10.472 -13.069 510 H2' G 39 H2' G 39 7.644 8.237 -12.548 511 HO2' G 39 HO2' G 39 8.180 7.819 -10.376 512 H1' G 39 H1' G 39 5.836 9.033 -10.299 513 H8 G 39 H8 G 39 3.590 7.715 -12.633 514 H1 G 39 H1 G 39 7.128 2.827 -10.449 515 H21 G 39 H21 G 39 8.951 3.564 -9.515 516 H22 G 39 H22 G 39 9.345 5.269 -9.416 517 H5' G 40 H5' G 40 7.192 11.285 -8.581 518 H5'' G 40 H5'' G 40 8.250 12.628 -8.146 519 H4' G 40 H4' G 40 7.765 11.161 -6.229 520 H3' G 40 H3' G 40 10.334 12.125 -6.921 521 H2' G 40 H2' G 40 10.992 9.917 -7.688 522 HO2' G 40 HO2' G 40 11.538 10.113 -4.892 523 H1' G 40 H1' G 40 9.390 8.944 -5.286 524 H8 G 40 H8 G 40 9.984 7.749 -8.944 525 H1 G 40 H1 G 40 11.714 3.589 -4.370 526 H21 G 40 H21 G 40 11.438 4.524 -2.356 527 H22 G 40 H22 G 40 10.755 6.117 -2.177 528 H5' A 41 H5' A 41 7.322 13.959 -3.672 529 H5'' A 41 H5'' A 41 7.130 12.601 -4.796 530 H4' A 41 H4' A 41 7.022 15.481 -5.766 531 H3' A 41 H3' A 41 4.895 13.822 -4.409 532 H2' A 41 H2' A 41 3.311 14.465 -6.019 533 HO2' A 41 HO2' A 41 3.690 16.714 -5.788 534 H1' A 41 H1' A 41 5.147 14.931 -8.155 535 H8 A 41 H8 A 41 4.352 11.721 -6.070 536 H61 A 41 H61 A 41 1.816 9.685 -11.369 537 H62 A 41 H62 A 41 2.127 9.279 -9.690 538 H2 A 41 H2 A 41 3.387 13.766 -12.065 539 H5' C 42 H5' C 42 1.945 14.589 -1.919 540 H5'' C 42 H5'' C 42 2.699 13.737 -3.290 541 H4' C 42 H4' C 42 0.986 14.282 -4.777 542 H3' C 42 H3' C 42 0.733 16.728 -3.538 543 H2' C 42 H2' C 42 -0.064 15.865 -1.497 544 HO2' C 42 HO2' C 42 -2.506 16.165 -2.915 545 H1' C 42 H1' C 42 -1.961 13.945 -2.905 546 H41 C 42 H41 C 42 -2.184 12.368 3.326 547 H42 C 42 H42 C 42 -0.472 12.003 3.316 548 H5 C 42 H5 C 42 0.949 12.381 1.349 549 H6 C 42 H6 C 42 0.967 13.187 -0.950 550 H5' A 43 H5' A 43 -0.964 13.750 -6.415 551 H5'' A 43 H5'' A 43 -0.447 14.095 -8.069 552 H4' A 43 H4' A 43 -2.345 13.053 -8.711 553 H3' A 43 H3' A 43 -3.399 15.700 -7.750 554 H2' A 43 H2' A 43 -5.642 14.900 -7.599 555 HO2' A 43 HO2' A 43 -5.630 13.794 -9.595 556 H1' A 43 H1' A 43 -5.225 12.534 -6.601 557 H8 A 43 H8 A 43 -2.804 15.167 -5.036 558 H61 A 43 H61 A 43 -6.910 14.923 -0.398 559 H62 A 43 H62 A 43 -5.319 15.489 -0.871 560 H2 A 43 H2 A 43 -8.537 12.575 -3.787 561 H5' U 44 H5' U 44 -5.840 18.312 -8.721 562 H5'' U 44 H5'' U 44 -4.549 17.417 -7.917 563 H4' U 44 H4' U 44 -7.341 16.399 -7.432 564 H3' U 44 H3' U 44 -6.042 18.923 -6.451 565 HO3' U 44 HO3' U 44 -8.181 19.799 -6.796 566 H2' U 44 H2' U 44 -7.329 18.728 -4.419 567 HO2' U 44 HO2' U 44 -9.284 17.801 -5.393 568 H1' U 44 H1' U 44 -6.570 16.176 -4.116 569 H3 U 44 H3 U 44 -4.395 19.394 -1.523 570 H5 U 44 H5 U 44 -2.032 18.806 -4.947 571 H6 U 44 H6 U 44 -3.802 17.423 -5.861 572 H1 MET 1 H1 MET 1 1.029 -12.889 3.923 573 H2 MET 1 H2 MET 1 0.030 -13.153 5.203 574 H3 MET 1 H3 MET 1 0.938 -11.784 5.146 575 HA MET 1 HA MET 1 -0.227 -11.013 3.216 576 HB2 MET 1 HB2 MET 1 -0.846 -13.286 2.376 577 HB3 MET 1 HB3 MET 1 -1.954 -13.474 3.741 578 HG2 MET 1 HG2 MET 1 -3.241 -12.831 1.810 579 HG3 MET 1 HG3 MET 1 -3.251 -11.495 2.943 580 HE1 MET 1 HE1 MET 1 -3.483 -9.587 -0.347 581 HE2 MET 1 HE2 MET 1 -4.309 -11.047 0.262 582 HE3 MET 1 HE3 MET 1 -4.005 -9.691 1.360 583 H LEU 2 H LEU 2 -1.747 -9.388 3.666 584 HA LEU 2 HA LEU 2 -3.480 -9.766 6.036 585 HB2 LEU 2 HB2 LEU 2 -1.217 -7.902 5.731 586 HB3 LEU 2 HB3 LEU 2 -2.737 -7.084 6.139 587 HG LEU 2 HG LEU 2 -1.435 -9.325 7.701 588 HD11 LEU 2 HD11 LEU 2 -1.831 -6.363 8.305 589 HD12 LEU 2 HD12 LEU 2 -1.079 -7.567 9.385 590 HD13 LEU 2 HD13 LEU 2 -0.301 -7.138 7.840 591 HD21 LEU 2 HD21 LEU 2 -3.176 -8.752 9.420 592 HD22 LEU 2 HD22 LEU 2 -3.965 -7.682 8.234 593 HD23 LEU 2 HD23 LEU 2 -3.894 -9.436 7.953 594 H ILE 3 H ILE 3 -5.368 -8.403 5.989 595 HA ILE 3 HA ILE 3 -5.842 -6.917 3.459 596 HB ILE 3 HB ILE 3 -7.696 -9.012 4.683 597 HG12 ILE 3 HG12 ILE 3 -7.640 -9.662 2.127 598 HG13 ILE 3 HG13 ILE 3 -6.104 -8.786 2.110 599 HG21 ILE 3 HG21 ILE 3 -8.967 -7.002 3.963 600 HG22 ILE 3 HG22 ILE 3 -8.148 -7.073 2.376 601 HG23 ILE 3 HG23 ILE 3 -9.245 -8.373 2.874 602 HD11 ILE 3 HD11 ILE 3 -6.847 -11.189 3.836 603 HD12 ILE 3 HD12 ILE 3 -5.747 -11.173 2.444 604 HD13 ILE 3 HD13 ILE 3 -5.286 -10.335 3.934 605 H LEU 4 H LEU 4 -6.968 -5.077 3.720 606 HA LEU 4 HA LEU 4 -7.819 -4.240 6.462 607 HB2 LEU 4 HB2 LEU 4 -5.881 -3.005 4.474 608 HB3 LEU 4 HB3 LEU 4 -6.824 -1.972 5.530 609 HG LEU 4 HG LEU 4 -4.578 -2.311 6.382 610 HD11 LEU 4 HD11 LEU 4 -5.180 -2.726 8.667 611 HD12 LEU 4 HD12 LEU 4 -6.509 -1.847 7.863 612 HD13 LEU 4 HD13 LEU 4 -6.646 -3.599 8.176 613 HD21 LEU 4 HD21 LEU 4 -4.260 -4.684 5.604 614 HD22 LEU 4 HD22 LEU 4 -3.771 -4.362 7.280 615 HD23 LEU 4 HD23 LEU 4 -5.297 -5.191 6.977 616 H THR 5 H THR 5 -9.261 -2.318 6.369 617 HA THR 5 HA THR 5 -10.289 -1.668 3.677 618 HB THR 5 HB THR 5 -12.243 -2.080 5.968 619 HG1 THR 5 HG1 THR 5 -11.323 -4.084 5.350 620 HG21 THR 5 HG21 THR 5 -12.443 -1.663 2.974 621 HG22 THR 5 HG22 THR 5 -13.816 -2.068 4.037 622 HG23 THR 5 HG23 THR 5 -12.946 -0.536 4.262 623 H ARG 6 H ARG 6 -9.445 0.263 3.557 624 HA ARG 6 HA ARG 6 -9.679 2.173 5.821 625 HB2 ARG 6 HB2 ARG 6 -7.466 1.426 4.665 626 HB3 ARG 6 HB3 ARG 6 -8.030 2.324 3.264 627 HG2 ARG 6 HG2 ARG 6 -6.503 3.713 4.411 628 HG3 ARG 6 HG3 ARG 6 -8.112 4.392 4.734 629 HD2 ARG 6 HD2 ARG 6 -6.715 2.432 6.615 630 HD3 ARG 6 HD3 ARG 6 -6.424 4.171 6.695 631 HE ARG 6 HE ARG 6 -8.890 4.455 7.072 632 HH11 ARG 6 HH11 ARG 6 -7.351 1.389 7.943 633 HH12 ARG 6 HH12 ARG 6 -8.565 1.026 9.153 634 HH21 ARG 6 HH21 ARG 6 -10.381 3.974 8.613 635 HH22 ARG 6 HH22 ARG 6 -10.282 2.493 9.547 636 H LYS 7 H LYS 7 -10.297 4.505 5.151 637 HA LYS 7 HA LYS 7 -11.704 4.523 2.516 638 HB2 LYS 7 HB2 LYS 7 -13.327 6.116 3.384 639 HB3 LYS 7 HB3 LYS 7 -13.478 4.539 4.154 640 HG2 LYS 7 HG2 LYS 7 -12.376 5.377 6.166 641 HG3 LYS 7 HG3 LYS 7 -12.015 6.934 5.361 642 HD2 LYS 7 HD2 LYS 7 -14.486 7.249 4.998 643 HD3 LYS 7 HD3 LYS 7 -14.780 5.807 5.989 644 HE2 LYS 7 HE2 LYS 7 -13.391 8.365 6.872 645 HE3 LYS 7 HE3 LYS 7 -15.039 7.863 7.290 646 HZ1 LYS 7 HZ1 LYS 7 -14.052 5.919 8.374 647 HZ2 LYS 7 HZ2 LYS 7 -12.542 6.514 8.077 648 HZ3 LYS 7 HZ3 LYS 7 -13.562 7.330 9.061 649 H VAL 8 H VAL 8 -12.144 6.866 1.808 650 HA VAL 8 HA VAL 8 -9.553 7.713 1.135 651 HB VAL 8 HB VAL 8 -10.554 9.449 -0.129 652 HG11 VAL 8 HG11 VAL 8 -12.413 7.018 -0.074 653 HG12 VAL 8 HG12 VAL 8 -12.158 8.119 -1.439 654 HG13 VAL 8 HG13 VAL 8 -10.831 7.077 -0.879 655 HG21 VAL 8 HG21 VAL 8 -12.943 9.953 -0.096 656 HG22 VAL 8 HG22 VAL 8 -13.165 8.919 1.340 657 HG23 VAL 8 HG23 VAL 8 -12.182 10.409 1.437 658 H GLY 9 H GLY 9 -8.111 8.975 1.963 659 HA2 GLY 9 HA2 GLY 9 -7.414 11.028 2.952 660 HA3 GLY 9 HA3 GLY 9 -8.931 11.115 3.863 661 H GLU 10 H GLU 10 -7.808 7.918 4.039 662 HA GLU 10 HA GLU 10 -6.417 8.485 6.632 663 HB2 GLU 10 HB2 GLU 10 -8.154 6.130 5.838 664 HB3 GLU 10 HB3 GLU 10 -7.316 6.337 7.392 665 HG2 GLU 10 HG2 GLU 10 -8.612 8.386 7.818 666 HG3 GLU 10 HG3 GLU 10 -9.434 8.216 6.262 667 H SER 11 H SER 11 -5.124 6.252 7.252 668 HA SER 11 HA SER 11 -3.433 5.622 4.892 669 HB2 SER 11 HB2 SER 11 -2.462 6.916 7.463 670 HB3 SER 11 HB3 SER 11 -1.418 6.328 6.149 671 HG SER 11 HG SER 11 -1.880 8.580 6.016 672 H ILE 12 H ILE 12 -1.622 4.189 5.448 673 HA ILE 12 HA ILE 12 -2.044 2.265 7.657 674 HB ILE 12 HB ILE 12 -1.815 1.499 4.713 675 HG12 ILE 12 HG12 ILE 12 -4.188 1.324 6.617 676 HG13 ILE 12 HG13 ILE 12 -4.034 2.407 5.223 677 HG21 ILE 12 HG21 ILE 12 -2.217 -0.244 7.185 678 HG22 ILE 12 HG22 ILE 12 -2.189 -0.814 5.504 679 HG23 ILE 12 HG23 ILE 12 -0.726 -0.152 6.209 680 HD11 ILE 12 HD11 ILE 12 -3.878 0.418 3.726 681 HD12 ILE 12 HD12 ILE 12 -4.219 -0.626 5.135 682 HD13 ILE 12 HD13 ILE 12 -5.425 0.546 4.591 683 H ASN 13 H ASN 13 0.051 0.802 7.749 684 HA ASN 13 HA ASN 13 2.390 2.254 6.618 685 HB2 ASN 13 HB2 ASN 13 1.806 1.695 9.543 686 HB3 ASN 13 HB3 ASN 13 3.447 1.978 8.940 687 HD21 ASN 13 HD22 ASN 13 4.058 4.020 8.137 688 HD22 ASN 13 HD21 ASN 13 3.110 5.450 8.473 689 H ILE 14 H ILE 14 4.355 1.111 6.636 690 HA ILE 14 HA ILE 14 4.266 -1.782 7.245 691 HB ILE 14 HB ILE 14 5.191 -0.629 4.586 692 HG12 ILE 14 HG12 ILE 14 2.754 -2.331 5.272 693 HG13 ILE 14 HG13 ILE 14 2.729 -0.632 4.776 694 HG21 ILE 14 HG21 ILE 14 5.499 -3.002 3.937 695 HG22 ILE 14 HG22 ILE 14 6.511 -2.598 5.316 696 HG23 ILE 14 HG23 ILE 14 5.006 -3.509 5.570 697 HD11 ILE 14 HD11 ILE 14 3.765 -1.281 2.592 698 HD12 ILE 14 HD12 ILE 14 3.591 -2.993 3.066 699 HD13 ILE 14 HD13 ILE 14 2.153 -1.980 2.869 700 H GLY 15 H GLY 15 6.373 -2.654 7.629 701 HA2 GLY 15 HA2 GLY 15 8.478 -2.576 8.560 702 HA3 GLY 15 HA3 GLY 15 8.839 -1.369 7.315 703 H ASP 16 H ASP 16 10.033 0.051 8.504 704 HA ASP 16 HA ASP 16 8.602 1.557 10.635 705 HB2 ASP 16 HB2 ASP 16 11.534 0.753 10.587 706 HB3 ASP 16 HB3 ASP 16 10.791 1.845 11.766 707 H ASP 17 H ASP 17 9.377 1.691 7.571 708 HA ASP 17 HA ASP 17 10.114 4.556 7.612 709 HB2 ASP 17 HB2 ASP 17 11.603 2.451 5.990 710 HB3 ASP 17 HB3 ASP 17 11.846 4.200 5.899 711 H ILE 18 H ILE 18 7.784 2.462 6.712 712 HA ILE 18 HA ILE 18 7.407 3.868 4.109 713 HB ILE 18 HB ILE 18 6.665 0.975 4.671 714 HG12 ILE 18 HG12 ILE 18 8.369 0.757 2.632 715 HG13 ILE 18 HG13 ILE 18 9.073 2.210 3.352 716 HG21 ILE 18 HG21 ILE 18 5.138 2.047 3.106 717 HG22 ILE 18 HG22 ILE 18 6.509 2.705 2.171 718 HG23 ILE 18 HG23 ILE 18 6.214 0.957 2.217 719 HD11 ILE 18 HD11 ILE 18 8.531 -0.433 4.786 720 HD12 ILE 18 HD12 ILE 18 10.118 0.112 4.200 721 HD13 ILE 18 HD13 ILE 18 9.320 0.987 5.521 722 H THR 19 H THR 19 5.349 4.458 3.573 723 HA THR 19 HA THR 19 3.136 3.938 5.484 724 HB THR 19 HB THR 19 3.918 6.706 4.478 725 HG1 THR 19 HG1 THR 19 4.523 7.071 6.605 726 HG21 THR 19 HG21 THR 19 1.521 6.535 4.863 727 HG22 THR 19 HG22 THR 19 1.794 5.741 6.434 728 HG23 THR 19 HG23 THR 19 2.247 7.444 6.198 729 H ILE 20 H ILE 20 1.068 4.278 4.532 730 HA ILE 20 HA ILE 20 0.976 4.534 1.566 731 HB ILE 20 HB ILE 20 -0.416 2.446 3.304 732 HG12 ILE 20 HG12 ILE 20 1.984 1.939 2.903 733 HG13 ILE 20 HG13 ILE 20 0.878 0.759 2.200 734 HG21 ILE 20 HG21 ILE 20 -0.577 2.982 0.310 735 HG22 ILE 20 HG22 ILE 20 -1.216 1.528 1.112 736 HG23 ILE 20 HG23 ILE 20 -1.892 3.119 1.500 737 HD11 ILE 20 HD11 ILE 20 2.183 3.013 0.624 738 HD12 ILE 20 HD12 ILE 20 2.773 1.336 0.701 739 HD13 ILE 20 HD13 ILE 20 1.195 1.693 -0.032 740 H THR 21 H THR 21 -0.925 5.533 0.817 741 HA THR 21 HA THR 21 -2.937 6.321 2.848 742 HB THR 21 HB THR 21 -1.530 8.303 1.019 743 HG1 THR 21 HG1 THR 21 -1.343 7.928 3.820 744 HG21 THR 21 HG21 THR 21 -2.718 9.996 2.381 745 HG22 THR 21 HG22 THR 21 -3.865 8.933 1.546 746 HG23 THR 21 HG23 THR 21 -3.535 8.704 3.281 747 H ILE 22 H ILE 22 -4.967 6.711 2.008 748 HA ILE 22 HA ILE 22 -5.351 6.077 -0.880 749 HB ILE 22 HB ILE 22 -6.425 4.451 0.418 750 HG12 ILE 22 HG12 ILE 22 -8.779 4.707 0.034 751 HG13 ILE 22 HG13 ILE 22 -8.650 6.475 -0.011 752 HG21 ILE 22 HG21 ILE 22 -7.512 6.655 2.193 753 HG22 ILE 22 HG22 ILE 22 -7.970 4.940 2.288 754 HG23 ILE 22 HG23 ILE 22 -6.302 5.416 2.630 755 HD11 ILE 22 HD11 ILE 22 -7.369 4.582 -2.010 756 HD12 ILE 22 HD12 ILE 22 -8.865 5.532 -2.251 757 HD13 ILE 22 HD13 ILE 22 -7.314 6.369 -2.049 758 H LEU 23 H LEU 23 -5.205 8.091 -1.895 759 HA LEU 23 HA LEU 23 -6.008 10.479 -0.524 760 HB2 LEU 23 HB2 LEU 23 -5.776 10.249 -3.528 761 HB3 LEU 23 HB3 LEU 23 -5.508 11.650 -2.506 762 HG LEU 23 HG LEU 23 -3.691 9.243 -2.855 763 HD11 LEU 23 HD11 LEU 23 -3.351 12.253 -3.267 764 HD12 LEU 23 HD12 LEU 23 -2.108 11.021 -3.564 765 HD13 LEU 23 HD13 LEU 23 -3.595 11.071 -4.553 766 HD21 LEU 23 HD21 LEU 23 -3.497 11.496 -0.822 767 HD22 LEU 23 HD22 LEU 23 -3.642 9.760 -0.476 768 HD23 LEU 23 HD23 LEU 23 -2.165 10.378 -1.231 769 H GLY 24 H GLY 24 -7.687 8.258 -2.766 770 HA2 GLY 24 HA2 GLY 24 -10.265 8.923 -2.022 771 HA3 GLY 24 HA3 GLY 24 -9.894 10.126 -3.238 772 H VAL 25 H VAL 25 -11.899 8.855 -4.056 773 HA VAL 25 HA VAL 25 -10.908 6.783 -5.954 774 HB VAL 25 HB VAL 25 -12.793 5.385 -5.618 775 HG11 VAL 25 HG11 VAL 25 -11.011 5.147 -3.895 776 HG12 VAL 25 HG12 VAL 25 -11.918 6.253 -2.833 777 HG13 VAL 25 HG13 VAL 25 -12.616 4.689 -3.287 778 HG21 VAL 25 HG21 VAL 25 -14.558 7.031 -5.370 779 HG22 VAL 25 HG22 VAL 25 -14.609 5.902 -4.013 780 HG23 VAL 25 HG23 VAL 25 -13.921 7.527 -3.779 781 H SER 26 H SER 26 -12.253 6.484 -7.831 782 HA SER 26 HA SER 26 -14.332 8.461 -8.420 783 HB2 SER 26 HB2 SER 26 -13.181 9.100 -10.570 784 HB3 SER 26 HB3 SER 26 -12.443 9.757 -9.095 785 HG SER 26 HG SER 26 -10.940 8.838 -10.603 786 H GLY 27 H GLY 27 -15.711 6.658 -8.482 787 HA2 GLY 27 HA2 GLY 27 -16.894 5.064 -9.704 788 HA3 GLY 27 HA3 GLY 27 -15.693 5.210 -11.007 789 H GLN 28 H GLN 28 -14.051 3.712 -11.166 790 HA GLN 28 HA GLN 28 -13.782 1.723 -8.936 791 HB2 GLN 28 HB2 GLN 28 -13.079 1.469 -11.893 792 HB3 GLN 28 HB3 GLN 28 -12.785 0.239 -10.662 793 HG2 GLN 28 HG2 GLN 28 -15.513 1.251 -11.520 794 HG3 GLN 28 HG3 GLN 28 -14.711 -0.249 -12.044 795 HE21 GLN 28 HE22 GLN 28 -15.879 1.444 -9.058 796 HE22 GLN 28 HE21 GLN 28 -16.252 -0.024 -8.186 797 H GLN 29 H GLN 29 -12.244 4.280 -10.767 798 HA GLN 29 HA GLN 29 -9.552 3.391 -10.244 799 HB2 GLN 29 HB2 GLN 29 -10.751 6.079 -11.015 800 HB3 GLN 29 HB3 GLN 29 -9.048 5.881 -10.596 801 HG2 GLN 29 HG2 GLN 29 -9.099 5.700 -12.934 802 HG3 GLN 29 HG3 GLN 29 -8.910 4.044 -12.350 803 HE21 GLN 29 HE22 GLN 29 -10.567 2.536 -12.682 804 HE22 GLN 29 HE21 GLN 29 -11.995 2.917 -13.631 805 H VAL 30 H VAL 30 -8.132 4.105 -8.665 806 HA VAL 30 HA VAL 30 -9.272 5.452 -6.276 807 HB VAL 30 HB VAL 30 -7.665 2.848 -6.285 808 HG11 VAL 30 HG11 VAL 30 -7.318 4.422 -4.344 809 HG12 VAL 30 HG12 VAL 30 -9.062 4.318 -4.017 810 HG13 VAL 30 HG13 VAL 30 -8.049 2.858 -3.891 811 HG21 VAL 30 HG21 VAL 30 -9.733 1.840 -5.329 812 HG22 VAL 30 HG22 VAL 30 -10.596 3.361 -5.659 813 HG23 VAL 30 HG23 VAL 30 -9.953 2.384 -7.002 814 H ARG 31 H ARG 31 -8.029 7.214 -6.053 815 HA ARG 31 HA ARG 31 -5.260 7.304 -6.991 816 HB2 ARG 31 HB2 ARG 31 -7.270 9.172 -5.804 817 HB3 ARG 31 HB3 ARG 31 -5.580 9.487 -5.372 818 HG2 ARG 31 HG2 ARG 31 -6.400 9.116 -8.264 819 HG3 ARG 31 HG3 ARG 31 -6.490 10.681 -7.444 820 HD2 ARG 31 HD2 ARG 31 -4.083 10.461 -6.798 821 HD3 ARG 31 HD3 ARG 31 -3.987 8.982 -7.782 822 HE ARG 31 HE ARG 31 -4.967 11.470 -9.063 823 HH11 ARG 31 HH11 ARG 31 -2.337 9.141 -8.717 824 HH12 ARG 31 HH12 ARG 31 -1.461 9.766 -10.105 825 HH21 ARG 31 HH21 ARG 31 -3.836 12.235 -10.833 826 HH22 ARG 31 HH22 ARG 31 -2.318 11.505 -11.314 827 H ILE 32 H ILE 32 -3.645 6.461 -5.894 828 HA ILE 32 HA ILE 32 -3.886 6.165 -2.930 829 HB ILE 32 HB ILE 32 -2.434 4.226 -4.756 830 HG12 ILE 32 HG12 ILE 32 -5.332 4.157 -3.844 831 HG13 ILE 32 HG13 ILE 32 -4.697 4.123 -5.501 832 HG21 ILE 32 HG21 ILE 32 -3.509 3.984 -1.917 833 HG22 ILE 32 HG22 ILE 32 -2.576 2.742 -2.798 834 HG23 ILE 32 HG23 ILE 32 -1.803 4.257 -2.354 835 HD11 ILE 32 HD11 ILE 32 -5.402 1.894 -4.907 836 HD12 ILE 32 HD12 ILE 32 -3.634 1.910 -5.022 837 HD13 ILE 32 HD13 ILE 32 -4.437 1.923 -3.422 838 H GLY 33 H GLY 33 -1.882 6.303 -1.779 839 HA2 GLY 33 HA2 GLY 33 0.385 7.452 -3.338 840 HA3 GLY 33 HA3 GLY 33 -0.193 8.234 -1.863 841 H ILE 34 H ILE 34 2.407 7.231 -2.343 842 HA ILE 34 HA ILE 34 2.682 5.216 -0.179 843 HB ILE 34 HB ILE 34 4.096 5.003 -2.881 844 HG12 ILE 34 HG12 ILE 34 2.858 2.655 -2.730 845 HG13 ILE 34 HG13 ILE 34 1.676 3.564 -1.780 846 HG21 ILE 34 HG21 ILE 34 4.884 2.827 -1.918 847 HG22 ILE 34 HG22 ILE 34 5.483 4.239 -1.041 848 HG23 ILE 34 HG23 ILE 34 4.143 3.280 -0.367 849 HD11 ILE 34 HD11 ILE 34 2.617 4.228 -4.611 850 HD12 ILE 34 HD12 ILE 34 1.068 3.469 -4.178 851 HD13 ILE 34 HD13 ILE 34 1.399 5.150 -3.706 852 H ASN 35 H ASN 35 4.586 5.405 0.972 853 HA ASN 35 HA ASN 35 6.405 7.611 0.183 854 HB2 ASN 35 HB2 ASN 35 4.479 8.438 1.604 855 HB3 ASN 35 HB3 ASN 35 5.083 7.418 2.911 856 HD21 ASN 35 HD22 ASN 35 4.790 10.382 2.656 857 HD22 ASN 35 HD21 ASN 35 6.381 11.055 2.936 858 H ALA 36 H ALA 36 8.258 6.551 0.008 859 HA ALA 36 HA ALA 36 9.321 5.151 2.380 860 HB1 ALA 36 HB1 ALA 36 10.078 3.257 0.949 861 HB2 ALA 36 HB2 ALA 36 8.304 3.343 1.030 862 HB3 ALA 36 HB3 ALA 36 9.165 3.926 -0.416 863 HA PRO 37 HA PRO 37 13.027 7.171 1.071 864 HB2 PRO 37 HB2 PRO 37 14.933 5.251 1.715 865 HB3 PRO 37 HB3 PRO 37 14.134 6.320 2.925 866 HG2 PRO 37 HG2 PRO 37 13.458 3.464 2.153 867 HG3 PRO 37 HG3 PRO 37 13.570 4.176 3.796 868 HD2 PRO 37 HD2 PRO 37 11.183 3.855 2.568 869 HD3 PRO 37 HD3 PRO 37 11.543 5.320 3.537 870 H LYS 38 H LYS 38 14.705 7.104 -0.577 871 HA LYS 38 HA LYS 38 14.114 5.388 -2.829 872 HB2 LYS 38 HB2 LYS 38 16.436 7.275 -2.232 873 HB3 LYS 38 HB3 LYS 38 16.158 6.508 -3.807 874 HG2 LYS 38 HG2 LYS 38 14.121 8.303 -2.406 875 HG3 LYS 38 HG3 LYS 38 15.248 8.873 -3.631 876 HD2 LYS 38 HD2 LYS 38 13.370 6.534 -4.168 877 HD3 LYS 38 HD3 LYS 38 12.834 8.203 -4.314 878 HE2 LYS 38 HE2 LYS 38 15.266 7.057 -5.761 879 HE3 LYS 38 HE3 LYS 38 13.638 7.129 -6.456 880 HZ1 LYS 38 HZ1 LYS 38 14.958 9.003 -7.119 881 HZ2 LYS 38 HZ2 LYS 38 13.694 9.511 -6.189 882 HZ3 LYS 38 HZ3 LYS 38 15.209 9.451 -5.559 883 H ASP 39 H ASP 39 15.478 4.758 0.019 884 HA ASP 39 HA ASP 39 17.600 2.942 -0.599 885 HB2 ASP 39 HB2 ASP 39 16.851 4.011 1.643 886 HB3 ASP 39 HB3 ASP 39 15.634 2.740 1.706 887 H VAL 40 H VAL 40 14.243 2.842 -1.235 888 HA VAL 40 HA VAL 40 14.347 -0.050 -1.854 889 HB VAL 40 HB VAL 40 12.160 -0.429 -0.886 890 HG11 VAL 40 HG11 VAL 40 13.876 1.073 1.138 891 HG12 VAL 40 HG12 VAL 40 12.641 -0.157 1.496 892 HG13 VAL 40 HG13 VAL 40 14.133 -0.616 0.639 893 HG21 VAL 40 HG21 VAL 40 11.190 1.816 -1.286 894 HG22 VAL 40 HG22 VAL 40 10.929 1.226 0.365 895 HG23 VAL 40 HG23 VAL 40 12.178 2.448 0.063 896 H ALA 41 H ALA 41 12.382 -0.628 -3.266 897 HA ALA 41 HA ALA 41 12.033 1.584 -5.236 898 HB1 ALA 41 HB1 ALA 41 11.755 -0.211 -6.883 899 HB2 ALA 41 HB2 ALA 41 13.291 -0.402 -6.018 900 HB3 ALA 41 HB3 ALA 41 11.901 -1.439 -5.609 901 H VAL 42 H VAL 42 9.978 1.768 -6.323 902 HA VAL 42 HA VAL 42 7.724 0.165 -5.383 903 HB VAL 42 HB VAL 42 7.525 1.610 -3.597 904 HG11 VAL 42 HG11 VAL 42 7.772 4.112 -3.784 905 HG12 VAL 42 HG12 VAL 42 9.265 3.182 -4.014 906 HG13 VAL 42 HG13 VAL 42 8.412 3.855 -5.428 907 HG21 VAL 42 HG21 VAL 42 5.635 3.095 -4.026 908 HG22 VAL 42 HG22 VAL 42 5.951 3.059 -5.765 909 HG23 VAL 42 HG23 VAL 42 5.420 1.574 -4.927 910 H HIS 43 H HIS 43 6.403 -0.167 -7.021 911 HA HIS 43 HA HIS 43 5.811 1.896 -9.008 912 HB2 HIS 43 HB2 HIS 43 6.748 -0.764 -10.094 913 HB3 HIS 43 HB3 HIS 43 6.595 0.794 -10.906 914 HD2 HIS 43 HD2 HIS 43 8.988 -1.189 -8.610 915 HE1 HIS 43 HE1 HIS 43 11.179 2.125 -10.121 916 HE2 HIS 43 HE2 HIS 43 11.329 -0.036 -8.783 917 H ARG 44 H ARG 44 4.090 0.852 -10.640 918 HA ARG 44 HA ARG 44 2.273 -0.737 -8.985 919 HB2 ARG 44 HB2 ARG 44 0.615 -0.188 -10.456 920 HB3 ARG 44 HB3 ARG 44 1.706 1.183 -10.659 921 HG2 ARG 44 HG2 ARG 44 2.720 -0.214 -12.631 922 HG3 ARG 44 HG3 ARG 44 1.231 -1.189 -12.482 923 HD2 ARG 44 HD2 ARG 44 0.803 0.493 -14.145 924 HD3 ARG 44 HD3 ARG 44 -0.078 0.984 -12.692 925 HE ARG 44 HE ARG 44 1.645 2.637 -12.239 926 HH11 ARG 44 HH11 ARG 44 1.736 1.211 -15.503 927 HH12 ARG 44 HH12 ARG 44 2.836 2.418 -16.097 928 HH21 ARG 44 HH21 ARG 44 3.126 4.145 -13.063 929 HH22 ARG 44 HH22 ARG 44 3.600 4.066 -14.738 930 H GLU 45 H GLU 45 1.225 -2.763 -10.081 931 HA GLU 45 HA GLU 45 3.304 -4.644 -10.224 932 HB2 GLU 45 HB2 GLU 45 0.854 -4.865 -9.547 933 HB3 GLU 45 HB3 GLU 45 0.465 -5.040 -11.260 934 HG2 GLU 45 HG2 GLU 45 2.458 -6.805 -9.769 935 HG3 GLU 45 HG3 GLU 45 0.730 -7.178 -9.883 936 H GLU 46 H GLU 46 1.902 -2.706 -12.768 937 HA GLU 46 HA GLU 46 2.575 -4.382 -14.992 938 HB2 GLU 46 HB2 GLU 46 0.942 -2.471 -14.992 939 HB3 GLU 46 HB3 GLU 46 2.300 -1.354 -14.791 940 HG2 GLU 46 HG2 GLU 46 3.240 -2.103 -16.957 941 HG3 GLU 46 HG3 GLU 46 1.917 -3.261 -17.137 942 H ILE 47 H ILE 47 4.366 -1.851 -13.173 943 HA ILE 47 HA ILE 47 6.497 -1.877 -15.214 944 HB ILE 47 HB ILE 47 6.311 -0.331 -12.611 945 HG12 ILE 47 HG12 ILE 47 4.381 0.369 -13.803 946 HG13 ILE 47 HG13 ILE 47 5.608 1.606 -14.060 947 HG21 ILE 47 HG21 ILE 47 7.880 1.216 -13.771 948 HG22 ILE 47 HG22 ILE 47 8.567 -0.400 -13.542 949 HG23 ILE 47 HG23 ILE 47 7.962 0.084 -15.143 950 HD11 ILE 47 HD11 ILE 47 4.733 -0.561 -16.007 951 HD12 ILE 47 HD12 ILE 47 4.503 1.192 -16.170 952 HD13 ILE 47 HD13 ILE 47 6.137 0.509 -16.287 953 H TYR 48 H TYR 48 5.711 -3.200 -12.066 954 HA TYR 48 HA TYR 48 8.273 -3.693 -11.017 955 HB2 TYR 48 HB2 TYR 48 6.141 -3.930 -9.827 956 HB3 TYR 48 HB3 TYR 48 5.759 -5.333 -10.828 957 HD1 TYR 48 HD1 TYR 48 8.219 -4.040 -8.323 958 HD2 TYR 48 HD2 TYR 48 6.595 -7.502 -10.307 959 HE1 TYR 48 HE1 TYR 48 9.378 -5.504 -6.707 960 HE2 TYR 48 HE2 TYR 48 7.685 -8.966 -8.665 961 HH TYR 48 HH TYR 48 9.721 -7.665 -5.997 962 H GLN 49 H GLN 49 6.467 -5.321 -13.592 963 HA GLN 49 HA GLN 49 7.986 -7.763 -13.618 964 HB2 GLN 49 HB2 GLN 49 6.241 -6.339 -15.663 965 HB3 GLN 49 HB3 GLN 49 6.909 -7.975 -15.893 966 HG2 GLN 49 HG2 GLN 49 5.705 -8.828 -13.982 967 HG3 GLN 49 HG3 GLN 49 5.236 -7.213 -13.467 968 HE21 GLN 49 HE22 GLN 49 3.004 -7.893 -13.503 969 HE22 GLN 49 HE21 GLN 49 2.117 -8.011 -14.996 970 H ARG 50 H ARG 50 8.602 -4.526 -14.821 971 HA ARG 50 HA ARG 50 10.718 -5.433 -16.667 972 HB2 ARG 50 HB2 ARG 50 9.572 -2.737 -15.872 973 HB3 ARG 50 HB3 ARG 50 11.102 -2.877 -16.742 974 HG2 ARG 50 HG2 ARG 50 9.366 -2.521 -18.360 975 HG3 ARG 50 HG3 ARG 50 9.989 -4.169 -18.532 976 HD2 ARG 50 HD2 ARG 50 8.002 -5.033 -17.306 977 HD3 ARG 50 HD3 ARG 50 7.404 -3.369 -17.136 978 HE ARG 50 HE ARG 50 7.983 -4.108 -19.886 979 HH11 ARG 50 HH11 ARG 50 5.488 -4.275 -17.362 980 HH12 ARG 50 HH12 ARG 50 4.201 -4.497 -18.519 981 HH21 ARG 50 HH21 ARG 50 6.269 -4.375 -21.337 982 HH22 ARG 50 HH22 ARG 50 4.634 -4.553 -20.751 983 H ILE 51 H ILE 51 10.317 -4.697 -13.328 984 HA ILE 51 HA ILE 51 13.116 -4.019 -12.837 985 HB ILE 51 HB ILE 51 11.165 -5.142 -10.799 986 HG12 ILE 51 HG12 ILE 51 9.901 -3.453 -12.033 987 HG13 ILE 51 HG13 ILE 51 10.208 -3.009 -10.341 988 HG21 ILE 51 HG21 ILE 51 13.389 -3.076 -10.659 989 HG22 ILE 51 HG22 ILE 51 12.370 -3.611 -9.294 990 HG23 ILE 51 HG23 ILE 51 13.459 -4.764 -10.089 991 HD11 ILE 51 HD11 ILE 51 11.696 -1.940 -12.762 992 HD12 ILE 51 HD12 ILE 51 10.371 -1.133 -11.889 993 HD13 ILE 51 HD13 ILE 51 11.925 -1.434 -11.058 994 H GLN 52 H GLN 52 10.935 -6.769 -12.126 995 HA GLN 52 HA GLN 52 13.011 -8.482 -11.163 996 HB2 GLN 52 HB2 GLN 52 10.132 -9.034 -12.006 997 HB3 GLN 52 HB3 GLN 52 11.147 -10.152 -11.080 998 HG2 GLN 52 HG2 GLN 52 10.157 -7.419 -10.222 999 HG3 GLN 52 HG3 GLN 52 9.826 -8.998 -9.486 1000 HE21 GLN 52 HE22 GLN 52 11.502 -6.191 -9.045 1001 HE22 GLN 52 HE21 GLN 52 12.849 -6.780 -8.094 1002 H ALA 53 H ALA 53 12.578 -7.500 -14.270 1003 HA ALA 53 HA ALA 53 12.811 -9.926 -15.740 1004 HB1 ALA 53 HB1 ALA 53 13.782 -7.106 -16.356 1005 HB2 ALA 53 HB2 ALA 53 13.586 -8.427 -17.540 1006 HB3 ALA 53 HB3 ALA 53 12.165 -7.754 -16.718 1007 H GLY 54 H GLY 54 15.050 -8.336 -13.618 1008 HA2 GLY 54 HA2 GLY 54 16.899 -10.273 -13.422 1009 HA3 GLY 54 HA3 GLY 54 17.422 -9.495 -14.926 1010 H LEU 55 H LEU 55 15.976 -7.373 -12.509 1011 HA LEU 55 HA LEU 55 18.572 -6.534 -11.447 1012 HB2 LEU 55 HB2 LEU 55 18.434 -4.300 -12.611 1013 HB3 LEU 55 HB3 LEU 55 18.788 -5.674 -13.648 1014 HG LEU 55 HG LEU 55 16.294 -5.768 -14.236 1015 HD11 LEU 55 HD11 LEU 55 16.377 -2.973 -13.013 1016 HD12 LEU 55 HD12 LEU 55 15.076 -3.627 -14.039 1017 HD13 LEU 55 HD13 LEU 55 15.369 -4.331 -12.450 1018 HD21 LEU 55 HD21 LEU 55 18.035 -4.971 -15.716 1019 HD22 LEU 55 HD22 LEU 55 16.564 -3.988 -15.900 1020 HD23 LEU 55 HD23 LEU 55 17.959 -3.345 -14.992 1021 H THR 56 H THR 56 18.230 -4.149 -10.514 1022 HA THR 56 HA THR 56 15.473 -3.689 -9.589 1023 HB THR 56 HB THR 56 17.717 -3.680 -7.551 1024 HG1 THR 56 HG1 THR 56 17.484 -5.799 -8.320 1025 HG21 THR 56 HG21 THR 56 14.669 -3.783 -7.399 1026 HG22 THR 56 HG22 THR 56 15.749 -3.966 -5.998 1027 HG23 THR 56 HG23 THR 56 15.709 -2.438 -6.902 1028 H ALA 57 H ALA 57 18.193 -2.592 -11.044 1029 HA ALA 57 HA ALA 57 17.567 0.225 -10.510 1030 HB1 ALA 57 HB1 ALA 57 20.310 -0.988 -9.945 1031 HB2 ALA 57 HB2 ALA 57 19.924 0.753 -9.966 1032 HB3 ALA 57 HB3 ALA 57 19.189 -0.307 -8.747 1033 HA PRO 58 HA PRO 58 18.262 -0.994 -14.933 1034 HB2 PRO 58 HB2 PRO 58 16.624 1.526 -15.079 1035 HB3 PRO 58 HB3 PRO 58 16.553 0.067 -16.115 1036 HG2 PRO 58 HG2 PRO 58 14.731 0.417 -14.128 1037 HG3 PRO 58 HG3 PRO 58 15.503 -1.192 -14.341 1038 HD2 PRO 58 HD2 PRO 58 16.213 0.979 -12.360 1039 HD3 PRO 58 HD3 PRO 58 16.052 -0.784 -12.091 1040 H ASP 59 H ASP 59 18.972 0.313 -16.835 1041 HA ASP 59 HA ASP 59 21.428 1.584 -16.262 1042 HB2 ASP 59 HB2 ASP 59 20.637 0.317 -18.348 1043 HB3 ASP 59 HB3 ASP 59 19.773 1.771 -18.807 1044 H5' U 36 H5' U 36 -12.833 2.693 7.473 1045 H5'' U 36 H5'' U 36 -13.830 1.657 6.428 1046 H4' U 36 H4' U 36 -14.424 2.129 9.379 1047 H3' U 36 H3' U 36 -12.196 0.793 8.463 1048 H2' U 36 H2' U 36 -13.386 -0.642 7.004 1049 HO2' U 36 HO2' U 36 -12.166 -1.942 8.520 1050 H1' U 36 H1' U 36 -15.372 -1.016 9.255 1051 H3 U 36 H3 U 36 -18.471 -3.464 7.129 1052 H5 U 36 H5 U 36 -16.160 -1.946 3.972 1053 H6 U 36 H6 U 36 -14.860 -0.693 5.599 1054 HO5' U 36 HO5' U 36 -15.627 3.032 7.094 1055 H5' C 37 H5' C 37 -13.845 1.069 13.524 1056 H5'' C 37 H5'' C 37 -12.283 1.623 14.126 1057 H4' C 37 H4' C 37 -12.371 0.092 15.755 1058 H3' C 37 H3' C 37 -11.445 -1.620 13.904 1059 H2' C 37 H2' C 37 -13.410 -1.967 12.653 1060 HO2' C 37 HO2' C 37 -13.441 -3.901 14.723 1061 H1' C 37 H1' C 37 -15.210 -2.338 14.990 1062 H41 C 37 H41 C 37 -19.532 0.439 11.236 1063 H42 C 37 H42 C 37 -18.307 0.898 10.067 1064 H5 C 37 H5 C 37 -15.900 0.452 10.421 1065 H6 C 37 H6 C 37 -14.304 -0.494 11.941 1066 H5' A 38 H5' A 38 -11.020 -5.042 15.652 1067 H5'' A 38 H5'' A 38 -9.858 -5.043 16.993 1068 H4' A 38 H4' A 38 -9.142 -6.614 15.282 1069 H3' A 38 H3' A 38 -7.374 -4.861 16.379 1070 H2' A 38 H2' A 38 -7.870 -3.066 14.837 1071 HO2' A 38 HO2' A 38 -5.677 -4.506 13.746 1072 H1' A 38 H1' A 38 -7.590 -5.044 12.572 1073 H8 A 38 H8 A 38 -9.254 -1.814 13.882 1074 H61 A 38 H61 A 38 -10.331 -0.618 7.899 1075 H62 A 38 H62 A 38 -10.442 -0.010 9.545 1076 H2 A 38 H2 A 38 -8.729 -4.761 8.216 1077 H5' G 39 H5' G 39 -7.951 -8.291 13.545 1078 H5'' G 39 H5'' G 39 -7.813 -9.763 14.521 1079 H4' G 39 H4' G 39 -7.620 -10.595 12.365 1080 H3' G 39 H3' G 39 -5.375 -10.911 13.814 1081 H2' G 39 H2' G 39 -4.293 -8.888 13.218 1082 HO2' G 39 HO2' G 39 -3.536 -10.791 11.259 1083 H1' G 39 H1' G 39 -4.998 -9.021 10.327 1084 H8 G 39 H8 G 39 -7.041 -6.459 10.964 1085 H1 G 39 H1 G 39 -1.251 -4.254 12.633 1086 H21 G 39 H21 G 39 0.144 -5.914 12.923 1087 H22 G 39 H22 G 39 -0.324 -7.586 12.685 1088 H5' G 40 H5' G 40 -4.367 -11.996 9.323 1089 H5'' G 40 H5'' G 40 -3.983 -13.720 9.385 1090 H4' G 40 H4' G 40 -2.617 -12.555 7.722 1091 H3' G 40 H3' G 40 -1.572 -14.393 9.588 1092 H2' G 40 H2' G 40 -0.823 -12.491 10.923 1093 HO2' G 40 HO2' G 40 1.430 -12.601 10.757 1094 H1' G 40 H1' G 40 0.066 -11.493 8.179 1095 H8 G 40 H8 G 40 -0.967 -9.931 11.613 1096 H1 G 40 H1 G 40 4.605 -7.936 9.143 1097 H21 G 40 H21 G 40 5.002 -8.978 7.218 1098 H22 G 40 H22 G 40 3.868 -10.114 6.534 1099 H5' A 41 H5' A 41 -2.716 -15.151 5.015 1100 H5'' A 41 H5'' A 41 -2.943 -13.709 6.020 1101 H4' A 41 H4' A 41 -4.707 -16.173 6.307 1102 H3' A 41 H3' A 41 -4.806 -13.923 4.314 1103 H2' A 41 H2' A 41 -7.074 -13.505 4.729 1104 HO2' A 41 HO2' A 41 -7.731 -15.687 4.385 1105 H1' A 41 H1' A 41 -7.191 -14.446 7.397 1106 H8 A 41 H8 A 41 -5.167 -11.640 5.583 1107 H61 A 41 H61 A 41 -8.551 -7.833 9.154 1108 H62 A 41 H62 A 41 -7.368 -7.886 7.866 1109 H2 A 41 H2 A 41 -9.652 -12.005 10.153 1110 H5' C 42 H5' C 42 -6.094 -13.737 0.327 1111 H5'' C 42 H5'' C 42 -5.503 -13.026 1.835 1112 H4' C 42 H4' C 42 -7.724 -12.254 2.425 1113 H3' C 42 H3' C 42 -8.845 -14.360 1.219 1114 H2' C 42 H2' C 42 -7.946 -13.834 -0.972 1115 HO2' C 42 HO2' C 42 -10.591 -12.774 -0.759 1116 H1' C 42 H1' C 42 -9.027 -11.049 -0.503 1117 H41 C 42 H41 C 42 -6.247 -10.654 -6.268 1118 H42 C 42 H42 C 42 -4.677 -10.964 -5.552 1119 H5 C 42 H5 C 42 -4.385 -11.481 -3.175 1120 H6 C 42 H6 C 42 -5.558 -11.816 -1.075 1121 H5' A 43 H5' A 43 -10.571 -15.850 2.256 1122 H5'' A 43 H5'' A 43 -10.614 -14.909 0.752 1123 H4' A 43 H4' A 43 -13.203 -15.351 0.886 1124 H3' A 43 H3' A 43 -12.852 -17.088 2.852 1125 H2' A 43 H2' A 43 -10.741 -17.943 2.042 1126 HO2' A 43 HO2' A 43 -12.124 -19.742 2.498 1127 H1' A 43 H1' A 43 -11.774 -18.554 -0.685 1128 H8 A 43 H8 A 43 -9.765 -15.597 -0.996 1129 H61 A 43 H61 A 43 -4.640 -19.103 -1.114 1130 H62 A 43 H62 A 43 -5.289 -17.504 -1.447 1131 H2 A 43 H2 A 43 -7.966 -21.594 0.409 1132 H5' U 44 H5' U 44 -14.772 -14.193 0.751 1133 H5'' U 44 H5'' U 44 -16.302 -14.352 -0.122 1134 H4' U 44 H4' U 44 -14.803 -12.853 -1.335 1135 H3' U 44 H3' U 44 -15.048 -15.547 -2.704 1136 HO3' U 44 HO3' U 44 -16.648 -14.383 -3.888 1137 H2' U 44 H2' U 44 -13.930 -14.472 -4.535 1138 HO2' U 44 HO2' U 44 -15.119 -12.454 -4.377 1139 H1' U 44 H1' U 44 -12.167 -13.084 -2.897 1140 H3 U 44 H3 U 44 -9.418 -15.951 -5.042 1141 H5 U 44 H5 U 44 -12.016 -18.510 -2.944 1142 H6 U 44 H6 U 44 -13.215 -16.567 -2.171 Start of MODEL 14 1 H1 MET 1 H1 MET 1 8.431 10.472 -1.175 2 H2 MET 1 H2 MET 1 8.501 10.892 -2.763 3 H3 MET 1 H3 MET 1 8.554 9.304 -2.333 4 HA MET 1 HA MET 1 6.328 9.371 -1.501 5 HB2 MET 1 HB2 MET 1 6.372 11.787 -0.845 6 HB3 MET 1 HB3 MET 1 6.426 12.231 -2.561 7 HG2 MET 1 HG2 MET 1 4.160 12.489 -1.818 8 HG3 MET 1 HG3 MET 1 4.211 11.103 -2.890 9 HE1 MET 1 HE1 MET 1 1.857 11.816 -1.264 10 HE2 MET 1 HE2 MET 1 1.878 10.270 -2.133 11 HE3 MET 1 HE3 MET 1 1.342 10.315 -0.435 12 H LEU 2 H LEU 2 4.812 8.475 -2.923 13 HA LEU 2 HA LEU 2 4.949 9.323 -5.760 14 HB2 LEU 2 HB2 LEU 2 5.461 6.649 -4.578 15 HB3 LEU 2 HB3 LEU 2 4.268 6.640 -5.886 16 HG LEU 2 HG LEU 2 7.037 7.833 -6.090 17 HD11 LEU 2 HD11 LEU 2 5.904 5.231 -7.197 18 HD12 LEU 2 HD12 LEU 2 7.541 5.880 -7.497 19 HD13 LEU 2 HD13 LEU 2 7.066 5.384 -5.855 20 HD21 LEU 2 HD21 LEU 2 5.422 8.891 -7.661 21 HD22 LEU 2 HD22 LEU 2 6.526 7.817 -8.537 22 HD23 LEU 2 HD23 LEU 2 4.860 7.288 -8.174 23 H ILE 3 H ILE 3 2.961 9.019 -6.880 24 HA ILE 3 HA ILE 3 0.588 8.262 -5.275 25 HB ILE 3 HB ILE 3 0.933 10.852 -6.839 26 HG12 ILE 3 HG12 ILE 3 -0.318 11.570 -4.580 27 HG13 ILE 3 HG13 ILE 3 0.489 10.128 -3.951 28 HG21 ILE 3 HG21 ILE 3 -1.601 9.548 -5.751 29 HG22 ILE 3 HG22 ILE 3 -1.490 11.195 -6.403 30 HG23 ILE 3 HG23 ILE 3 -1.209 9.801 -7.465 31 HD11 ILE 3 HD11 ILE 3 1.753 12.576 -5.262 32 HD12 ILE 3 HD12 ILE 3 1.834 12.105 -3.555 33 HD13 ILE 3 HD13 ILE 3 2.681 11.127 -4.778 34 H LEU 4 H LEU 4 -1.069 7.393 -6.545 35 HA LEU 4 HA LEU 4 -0.534 6.905 -9.429 36 HB2 LEU 4 HB2 LEU 4 -1.059 4.785 -7.304 37 HB3 LEU 4 HB3 LEU 4 -1.021 4.490 -9.046 38 HG LEU 4 HG LEU 4 1.349 5.451 -7.394 39 HD11 LEU 4 HD11 LEU 4 0.616 2.726 -8.540 40 HD12 LEU 4 HD12 LEU 4 2.146 3.129 -7.714 41 HD13 LEU 4 HD13 LEU 4 0.604 3.166 -6.822 42 HD21 LEU 4 HD21 LEU 4 1.145 4.442 -10.273 43 HD22 LEU 4 HD22 LEU 4 1.515 6.108 -9.792 44 HD23 LEU 4 HD23 LEU 4 2.656 4.813 -9.403 45 H THR 5 H THR 5 -2.485 5.877 -10.459 46 HA THR 5 HA THR 5 -4.946 6.104 -8.818 47 HB THR 5 HB THR 5 -5.123 6.968 -11.691 48 HG1 THR 5 HG1 THR 5 -3.591 8.342 -10.835 49 HG21 THR 5 HG21 THR 5 -7.124 6.433 -10.439 50 HG22 THR 5 HG22 THR 5 -6.604 7.456 -9.085 51 HG23 THR 5 HG23 THR 5 -7.039 8.200 -10.651 52 H ARG 6 H ARG 6 -5.132 3.962 -8.594 53 HA ARG 6 HA ARG 6 -5.100 2.217 -11.010 54 HB2 ARG 6 HB2 ARG 6 -3.775 2.041 -8.588 55 HB3 ARG 6 HB3 ARG 6 -5.198 1.037 -8.298 56 HG2 ARG 6 HG2 ARG 6 -4.698 -0.294 -10.316 57 HG3 ARG 6 HG3 ARG 6 -3.340 0.792 -10.716 58 HD2 ARG 6 HD2 ARG 6 -2.525 -1.237 -9.526 59 HD3 ARG 6 HD3 ARG 6 -2.235 0.252 -8.618 60 HE ARG 6 HE ARG 6 -4.544 -1.567 -8.063 61 HH11 ARG 6 HH21 ARG 6 -2.199 0.833 -6.952 62 HH12 ARG 6 HH22 ARG 6 -2.351 0.401 -5.267 63 HH21 ARG 6 HH11 ARG 6 -4.583 -2.221 -5.789 64 HH22 ARG 6 HH12 ARG 6 -3.735 -1.241 -4.617 65 H LYS 7 H LYS 7 -6.692 0.190 -10.526 66 HA LYS 7 HA LYS 7 -9.099 1.191 -9.117 67 HB2 LYS 7 HB2 LYS 7 -10.578 0.354 -10.880 68 HB3 LYS 7 HB3 LYS 7 -9.571 1.673 -11.481 69 HG2 LYS 7 HG2 LYS 7 -8.288 0.239 -12.817 70 HG3 LYS 7 HG3 LYS 7 -8.575 -1.162 -11.758 71 HD2 LYS 7 HD2 LYS 7 -10.993 -1.150 -12.467 72 HD3 LYS 7 HD3 LYS 7 -10.624 0.171 -13.587 73 HE2 LYS 7 HE2 LYS 7 -10.673 -1.935 -14.771 74 HE3 LYS 7 HE3 LYS 7 -9.005 -1.317 -14.759 75 HZ1 LYS 7 HZ1 LYS 7 -9.105 -3.665 -14.248 76 HZ2 LYS 7 HZ2 LYS 7 -8.533 -2.833 -12.961 77 HZ3 LYS 7 HZ3 LYS 7 -10.081 -3.387 -12.955 78 H VAL 8 H VAL 8 -10.811 -0.628 -9.025 79 HA VAL 8 HA VAL 8 -9.631 -2.473 -7.275 80 HB VAL 8 HB VAL 8 -11.762 -3.501 -7.057 81 HG11 VAL 8 HG11 VAL 8 -12.090 -0.504 -7.589 82 HG12 VAL 8 HG12 VAL 8 -13.103 -1.490 -6.532 83 HG13 VAL 8 HG13 VAL 8 -11.398 -1.207 -6.110 84 HG21 VAL 8 HG21 VAL 8 -12.680 -1.968 -9.509 85 HG22 VAL 8 HG22 VAL 8 -12.488 -3.741 -9.375 86 HG23 VAL 8 HG23 VAL 8 -13.705 -2.906 -8.388 87 H GLY 9 H GLY 9 -8.917 -4.481 -7.350 88 HA2 GLY 9 HA2 GLY 9 -8.705 -6.668 -8.203 89 HA3 GLY 9 HA3 GLY 9 -9.256 -6.114 -9.790 90 H GLU 10 H GLU 10 -7.056 -3.790 -8.979 91 HA GLU 10 HA GLU 10 -4.922 -5.146 -10.524 92 HB2 GLU 10 HB2 GLU 10 -5.309 -2.254 -9.676 93 HB3 GLU 10 HB3 GLU 10 -4.024 -2.849 -10.739 94 HG2 GLU 10 HG2 GLU 10 -7.019 -2.952 -11.304 95 HG3 GLU 10 HG3 GLU 10 -5.851 -1.843 -12.036 96 H SER 11 H SER 11 -2.602 -4.162 -9.840 97 HA SER 11 HA SER 11 -2.264 -4.267 -6.904 98 HB2 SER 11 HB2 SER 11 -0.974 -6.226 -8.850 99 HB3 SER 11 HB3 SER 11 -0.532 -6.040 -7.138 100 HG SER 11 HG SER 11 -2.053 -7.739 -7.516 101 H ILE 12 H ILE 12 -0.000 -3.935 -6.283 102 HA ILE 12 HA ILE 12 1.762 -2.473 -8.165 103 HB ILE 12 HB ILE 12 0.634 -1.352 -5.565 104 HG12 ILE 12 HG12 ILE 12 -0.855 -1.072 -7.501 105 HG13 ILE 12 HG13 ILE 12 -0.226 0.463 -6.880 106 HG21 ILE 12 HG21 ILE 12 2.825 -0.239 -7.350 107 HG22 ILE 12 HG22 ILE 12 1.969 0.697 -6.113 108 HG23 ILE 12 HG23 ILE 12 2.955 -0.678 -5.621 109 HD11 ILE 12 HD11 ILE 12 -0.266 0.479 -9.319 110 HD12 ILE 12 HD12 ILE 12 1.400 0.593 -8.716 111 HD13 ILE 12 HD13 ILE 12 0.790 -0.949 -9.370 112 H ASN 13 H ASN 13 3.939 -2.033 -6.923 113 HA ASN 13 HA ASN 13 4.433 -4.218 -4.955 114 HB2 ASN 13 HB2 ASN 13 5.814 -3.748 -7.615 115 HB3 ASN 13 HB3 ASN 13 6.578 -4.649 -6.301 116 HD21 ASN 13 HD22 ASN 13 5.528 -6.591 -5.475 117 HD22 ASN 13 HD21 ASN 13 4.485 -7.516 -6.526 118 H ILE 14 H ILE 14 6.247 -4.000 -3.676 119 HA ILE 14 HA ILE 14 7.758 -1.454 -3.768 120 HB ILE 14 HB ILE 14 6.421 -2.557 -1.258 121 HG12 ILE 14 HG12 ILE 14 5.773 -0.076 -2.912 122 HG13 ILE 14 HG13 ILE 14 4.774 -1.536 -2.799 123 HG21 ILE 14 HG21 ILE 14 7.265 -0.486 -0.198 124 HG22 ILE 14 HG22 ILE 14 8.596 -1.450 -0.829 125 HG23 ILE 14 HG23 ILE 14 8.041 -0.021 -1.733 126 HD11 ILE 14 HD11 ILE 14 5.393 0.398 -0.532 127 HD12 ILE 14 HD12 ILE 14 3.840 0.152 -1.349 128 HD13 ILE 14 HD13 ILE 14 4.521 -1.144 -0.343 129 H GLY 15 H GLY 15 9.834 -1.618 -2.761 130 HA2 GLY 15 HA2 GLY 15 11.826 -2.712 -2.392 131 HA3 GLY 15 HA3 GLY 15 10.880 -3.778 -1.344 132 H ASP 16 H ASP 16 11.809 -5.725 -1.873 133 HA ASP 16 HA ASP 16 11.248 -6.706 -4.613 134 HB2 ASP 16 HB2 ASP 16 13.308 -7.948 -4.641 135 HB3 ASP 16 HB3 ASP 16 13.657 -6.237 -4.413 136 H ASP 17 H ASP 17 10.148 -6.816 -1.652 137 HA ASP 17 HA ASP 17 9.415 -9.677 -1.799 138 HB2 ASP 17 HB2 ASP 17 10.549 -8.284 0.663 139 HB3 ASP 17 HB3 ASP 17 9.741 -9.851 0.685 140 H ILE 18 H ILE 18 8.174 -6.690 -2.015 141 HA ILE 18 HA ILE 18 5.852 -7.430 -0.296 142 HB ILE 18 HB ILE 18 6.872 -4.600 -0.729 143 HG12 ILE 18 HG12 ILE 18 7.084 -4.911 1.910 144 HG13 ILE 18 HG13 ILE 18 7.370 -6.598 1.476 145 HG21 ILE 18 HG21 ILE 18 4.457 -4.702 -0.413 146 HG22 ILE 18 HG22 ILE 18 4.655 -5.771 0.995 147 HG23 ILE 18 HG23 ILE 18 5.218 -4.085 1.061 148 HD11 ILE 18 HD11 ILE 18 9.246 -5.856 -0.010 149 HD12 ILE 18 HD12 ILE 18 8.871 -4.165 0.388 150 HD13 ILE 18 HD13 ILE 18 9.473 -5.269 1.644 151 H THR 19 H THR 19 3.831 -6.983 -1.058 152 HA THR 19 HA THR 19 3.507 -5.771 -3.742 153 HB THR 19 HB THR 19 2.337 -8.457 -2.903 154 HG1 THR 19 HG1 THR 19 4.529 -8.615 -3.373 155 HG21 THR 19 HG21 THR 19 0.860 -7.296 -4.463 156 HG22 THR 19 HG22 THR 19 2.229 -6.897 -5.523 157 HG23 THR 19 HG23 THR 19 1.713 -8.590 -5.327 158 H ILE 20 H ILE 20 1.331 -5.033 -4.090 159 HA ILE 20 HA ILE 20 -0.421 -4.854 -1.678 160 HB ILE 20 HB ILE 20 0.400 -2.598 -3.555 161 HG12 ILE 20 HG12 ILE 20 2.155 -3.164 -1.888 162 HG13 ILE 20 HG13 ILE 20 1.484 -1.542 -1.683 163 HG21 ILE 20 HG21 ILE 20 -1.542 -2.652 -1.214 164 HG22 ILE 20 HG22 ILE 20 -0.944 -1.171 -1.988 165 HG23 ILE 20 HG23 ILE 20 -1.909 -2.326 -2.926 166 HD11 ILE 20 HD11 ILE 20 0.655 -3.965 -0.037 167 HD12 ILE 20 HD12 ILE 20 1.815 -2.725 0.478 168 HD13 ILE 20 HD13 ILE 20 0.116 -2.287 0.201 169 H THR 21 H THR 21 -2.640 -4.801 -2.188 170 HA THR 21 HA THR 21 -3.375 -4.904 -5.066 171 HB THR 21 HB THR 21 -4.253 -6.960 -3.002 172 HG1 THR 21 HG1 THR 21 -2.439 -7.173 -5.163 173 HG21 THR 21 HG21 THR 21 -5.141 -8.168 -4.960 174 HG22 THR 21 HG22 THR 21 -5.900 -6.570 -4.831 175 HG23 THR 21 HG23 THR 21 -4.616 -6.846 -6.030 176 H ILE 22 H ILE 22 -5.496 -4.284 -5.497 177 HA ILE 22 HA ILE 22 -6.944 -2.958 -3.247 178 HB ILE 22 HB ILE 22 -6.252 -1.328 -4.793 179 HG12 ILE 22 HG12 ILE 22 -8.287 -0.423 -5.753 180 HG13 ILE 22 HG13 ILE 22 -9.121 -1.981 -5.538 181 HG21 ILE 22 HG21 ILE 22 -7.461 -2.956 -7.071 182 HG22 ILE 22 HG22 ILE 22 -6.626 -1.395 -7.184 183 HG23 ILE 22 HG23 ILE 22 -5.725 -2.853 -6.719 184 HD11 ILE 22 HD11 ILE 22 -9.725 -0.456 -3.769 185 HD12 ILE 22 HD12 ILE 22 -8.817 -1.843 -3.129 186 HD13 ILE 22 HD13 ILE 22 -8.007 -0.254 -3.318 187 H LEU 23 H LEU 23 -8.222 -4.610 -2.474 188 HA LEU 23 HA LEU 23 -9.283 -6.638 -4.183 189 HB2 LEU 23 HB2 LEU 23 -10.298 -5.848 -1.439 190 HB3 LEU 23 HB3 LEU 23 -10.460 -7.413 -2.240 191 HG LEU 23 HG LEU 23 -7.956 -6.156 -1.058 192 HD11 LEU 23 HD11 LEU 23 -9.462 -7.390 0.463 193 HD12 LEU 23 HD12 LEU 23 -9.424 -8.792 -0.626 194 HD13 LEU 23 HD13 LEU 23 -7.937 -8.279 0.221 195 HD21 LEU 23 HD21 LEU 23 -7.254 -7.154 -3.177 196 HD22 LEU 23 HD22 LEU 23 -6.742 -8.182 -1.822 197 HD23 LEU 23 HD23 LEU 23 -8.158 -8.639 -2.798 198 H GLY 24 H GLY 24 -10.572 -3.481 -3.184 199 HA2 GLY 24 HA2 GLY 24 -12.288 -3.076 -5.224 200 HA3 GLY 24 HA3 GLY 24 -13.267 -4.118 -4.212 201 H VAL 25 H VAL 25 -14.622 -2.042 -4.310 202 HA VAL 25 HA VAL 25 -13.915 -0.415 -1.919 203 HB VAL 25 HB VAL 25 -14.705 1.592 -2.920 204 HG11 VAL 25 HG11 VAL 25 -12.368 0.974 -3.447 205 HG12 VAL 25 HG12 VAL 25 -12.920 0.227 -4.970 206 HG13 VAL 25 HG13 VAL 25 -13.116 1.969 -4.719 207 HG21 VAL 25 HG21 VAL 25 -15.476 1.701 -5.279 208 HG22 VAL 25 HG22 VAL 25 -15.448 -0.078 -5.350 209 HG23 VAL 25 HG23 VAL 25 -16.564 0.763 -4.242 210 H SER 26 H SER 26 -15.749 0.617 -0.903 211 HA SER 26 HA SER 26 -18.444 -0.341 -1.541 212 HB2 SER 26 HB2 SER 26 -17.527 -2.133 -0.076 213 HB3 SER 26 HB3 SER 26 -17.137 -0.919 1.155 214 HG SER 26 HG SER 26 -19.178 -1.928 1.504 215 H GLY 27 H GLY 27 -18.937 1.851 -1.947 216 HA2 GLY 27 HA2 GLY 27 -19.474 4.048 -1.360 217 HA3 GLY 27 HA3 GLY 27 -19.333 3.555 0.341 218 H GLN 28 H GLN 28 -17.966 5.155 1.209 219 HA GLN 28 HA GLN 28 -15.599 6.015 -0.270 220 HB2 GLN 28 HB2 GLN 28 -16.333 6.360 2.677 221 HB3 GLN 28 HB3 GLN 28 -14.969 7.127 1.846 222 HG2 GLN 28 HG2 GLN 28 -17.920 7.621 1.452 223 HG3 GLN 28 HG3 GLN 28 -16.634 8.752 1.933 224 HE21 GLN 28 HE22 GLN 28 -14.718 8.753 0.141 225 HE22 GLN 28 HE21 GLN 28 -15.284 8.901 -1.511 226 H GLN 29 H GLN 29 -16.399 3.286 1.746 227 HA GLN 29 HA GLN 29 -13.736 2.873 2.744 228 HB2 GLN 29 HB2 GLN 29 -16.273 1.665 3.128 229 HB3 GLN 29 HB3 GLN 29 -15.282 0.433 2.357 230 HG2 GLN 29 HG2 GLN 29 -14.986 0.214 4.730 231 HG3 GLN 29 HG3 GLN 29 -13.490 0.953 4.120 232 HE21 GLN 29 HE22 GLN 29 -16.771 2.181 5.077 233 HE22 GLN 29 HE21 GLN 29 -16.153 3.400 6.175 234 H VAL 30 H VAL 30 -12.191 1.374 2.012 235 HA VAL 30 HA VAL 30 -12.387 0.412 -0.781 236 HB VAL 30 HB VAL 30 -10.116 2.061 0.435 237 HG11 VAL 30 HG11 VAL 30 -9.350 0.268 -1.121 238 HG12 VAL 30 HG12 VAL 30 -10.446 0.930 -2.364 239 HG13 VAL 30 HG13 VAL 30 -9.075 1.899 -1.765 240 HG21 VAL 30 HG21 VAL 30 -10.672 3.676 -1.377 241 HG22 VAL 30 HG22 VAL 30 -12.081 2.686 -1.806 242 HG23 VAL 30 HG23 VAL 30 -12.002 3.491 -0.216 243 H ARG 31 H ARG 31 -11.993 -1.697 -0.671 244 HA ARG 31 HA ARG 31 -10.744 -2.840 1.732 245 HB2 ARG 31 HB2 ARG 31 -12.851 -3.703 0.583 246 HB3 ARG 31 HB3 ARG 31 -11.819 -4.231 -0.755 247 HG2 ARG 31 HG2 ARG 31 -10.481 -5.598 0.883 248 HG3 ARG 31 HG3 ARG 31 -11.610 -5.101 2.167 249 HD2 ARG 31 HD2 ARG 31 -13.488 -6.023 0.793 250 HD3 ARG 31 HD3 ARG 31 -12.299 -6.633 -0.372 251 HE ARG 31 HE ARG 31 -11.882 -7.490 2.405 252 HH11 ARG 31 HH11 ARG 31 -13.425 -8.229 -0.690 253 HH12 ARG 31 HH12 ARG 31 -13.515 -9.946 -0.369 254 HH21 ARG 31 HH21 ARG 31 -12.018 -9.756 2.789 255 HH22 ARG 31 HH22 ARG 31 -12.765 -10.793 1.604 256 H ILE 32 H ILE 32 -8.662 -3.569 1.780 257 HA ILE 32 HA ILE 32 -7.103 -3.495 -0.765 258 HB ILE 32 HB ILE 32 -6.115 -2.184 1.780 259 HG12 ILE 32 HG12 ILE 32 -7.745 -0.916 -0.452 260 HG13 ILE 32 HG13 ILE 32 -8.125 -0.983 1.277 261 HG21 ILE 32 HG21 ILE 32 -4.569 -1.062 0.247 262 HG22 ILE 32 HG22 ILE 32 -4.454 -2.803 0.032 263 HG23 ILE 32 HG23 ILE 32 -5.354 -1.824 -1.152 264 HD11 ILE 32 HD11 ILE 32 -7.339 1.230 0.762 265 HD12 ILE 32 HD12 ILE 32 -6.109 0.414 1.747 266 HD13 ILE 32 HD13 ILE 32 -5.872 0.592 -0.009 267 H GLY 33 H GLY 33 -5.081 -4.649 -0.655 268 HA2 GLY 33 HA2 GLY 33 -4.811 -6.470 1.688 269 HA3 GLY 33 HA3 GLY 33 -4.781 -7.102 0.031 270 H ILE 34 H ILE 34 -2.697 -7.315 1.978 271 HA ILE 34 HA ILE 34 -0.468 -5.887 0.622 272 HB ILE 34 HB ILE 34 -0.860 -6.103 3.637 273 HG12 ILE 34 HG12 ILE 34 -1.010 -3.588 1.922 274 HG13 ILE 34 HG13 ILE 34 -2.427 -4.445 2.573 275 HG21 ILE 34 HG21 ILE 34 1.491 -6.178 2.961 276 HG22 ILE 34 HG22 ILE 34 1.278 -4.714 1.967 277 HG23 ILE 34 HG23 ILE 34 1.149 -4.632 3.734 278 HD11 ILE 34 HD11 ILE 34 -1.922 -2.617 4.047 279 HD12 ILE 34 HD12 ILE 34 -1.560 -4.156 4.867 280 HD13 ILE 34 HD13 ILE 34 -0.238 -3.147 4.219 281 H ASN 35 H ASN 35 1.440 -7.082 0.606 282 HA ASN 35 HA ASN 35 1.345 -9.744 1.911 283 HB2 ASN 35 HB2 ASN 35 0.337 -9.801 -0.399 284 HB3 ASN 35 HB3 ASN 35 1.908 -9.326 -1.046 285 HD21 ASN 35 HD22 ASN 35 0.197 -11.827 -1.297 286 HD22 ASN 35 HD21 ASN 35 1.261 -13.148 -0.859 287 H ALA 36 H ALA 36 3.059 -9.610 3.189 288 HA ALA 36 HA ALA 36 5.725 -9.215 1.985 289 HB1 ALA 36 HB1 ALA 36 6.362 -7.677 3.844 290 HB2 ALA 36 HB2 ALA 36 5.100 -6.963 2.809 291 HB3 ALA 36 HB3 ALA 36 4.683 -7.652 4.396 292 HA PRO 37 HA PRO 37 6.729 -12.480 4.816 293 HB2 PRO 37 HB2 PRO 37 9.302 -11.759 5.538 294 HB3 PRO 37 HB3 PRO 37 8.874 -12.505 3.949 295 HG2 PRO 37 HG2 PRO 37 9.283 -9.584 4.648 296 HG3 PRO 37 HG3 PRO 37 9.936 -10.498 3.244 297 HD2 PRO 37 HD2 PRO 37 7.730 -8.956 3.005 298 HD3 PRO 37 HD3 PRO 37 7.822 -10.559 2.199 299 H LYS 38 H LYS 38 7.086 -12.910 7.093 300 HA LYS 38 HA LYS 38 6.265 -10.777 8.875 301 HB2 LYS 38 HB2 LYS 38 7.349 -13.591 9.396 302 HB3 LYS 38 HB3 LYS 38 6.676 -12.528 10.649 303 HG2 LYS 38 HG2 LYS 38 5.135 -13.403 8.164 304 HG3 LYS 38 HG3 LYS 38 5.031 -14.225 9.726 305 HD2 LYS 38 HD2 LYS 38 4.502 -11.240 9.469 306 HD3 LYS 38 HD3 LYS 38 3.265 -12.425 9.083 307 HE2 LYS 38 HE2 LYS 38 4.760 -12.310 11.748 308 HE3 LYS 38 HE3 LYS 38 3.196 -11.536 11.443 309 HZ1 LYS 38 HZ1 LYS 38 2.920 -13.688 12.450 310 HZ2 LYS 38 HZ2 LYS 38 2.292 -13.693 10.931 311 HZ3 LYS 38 HZ3 LYS 38 3.731 -14.426 11.224 312 H ASP 39 H ASP 39 9.036 -11.322 7.307 313 HA ASP 39 HA ASP 39 11.067 -10.605 9.181 314 HB2 ASP 39 HB2 ASP 39 11.205 -11.555 6.776 315 HB3 ASP 39 HB3 ASP 39 10.954 -9.900 6.231 316 H VAL 40 H VAL 40 8.380 -8.868 7.953 317 HA VAL 40 HA VAL 40 9.506 -6.290 8.870 318 HB VAL 40 HB VAL 40 8.610 -5.122 6.956 319 HG11 VAL 40 HG11 VAL 40 10.081 -5.944 5.187 320 HG12 VAL 40 HG12 VAL 40 10.908 -6.099 6.749 321 HG13 VAL 40 HG13 VAL 40 10.199 -7.533 5.969 322 HG21 VAL 40 HG21 VAL 40 6.671 -6.590 6.505 323 HG22 VAL 40 HG22 VAL 40 7.616 -6.217 5.046 324 HG23 VAL 40 HG23 VAL 40 7.786 -7.808 5.822 325 H ALA 41 H ALA 41 7.626 -4.637 9.080 326 HA ALA 41 HA ALA 41 5.337 -6.120 10.296 327 HB1 ALA 41 HB1 ALA 41 6.521 -3.408 10.995 328 HB2 ALA 41 HB2 ALA 41 5.158 -4.198 11.812 329 HB3 ALA 41 HB3 ALA 41 6.782 -4.922 11.899 330 H VAL 42 H VAL 42 3.234 -5.169 10.161 331 HA VAL 42 HA VAL 42 2.824 -2.837 8.455 332 HB VAL 42 HB VAL 42 2.886 -4.263 6.627 333 HG11 VAL 42 HG11 VAL 42 3.234 -6.384 7.661 334 HG12 VAL 42 HG12 VAL 42 1.587 -6.400 8.339 335 HG13 VAL 42 HG13 VAL 42 1.840 -6.537 6.578 336 HG21 VAL 42 HG21 VAL 42 0.701 -3.089 6.714 337 HG22 VAL 42 HG22 VAL 42 0.601 -4.659 5.872 338 HG23 VAL 42 HG23 VAL 42 -0.015 -4.508 7.518 339 H HIS 43 H HIS 43 1.142 -1.714 9.195 340 HA HIS 43 HA HIS 43 -1.209 -3.026 10.338 341 HB2 HIS 43 HB2 HIS 43 0.118 -0.932 12.062 342 HB3 HIS 43 HB3 HIS 43 -1.099 -2.132 12.489 343 HD2 HIS 43 HD2 HIS 43 2.719 -1.830 11.876 344 HE1 HIS 43 HE1 HIS 43 2.061 -5.401 14.090 345 HE2 HIS 43 HE2 HIS 43 3.832 -3.836 13.151 346 H ARG 44 H ARG 44 -2.825 -1.181 11.053 347 HA ARG 44 HA ARG 44 -2.925 0.833 8.956 348 HB2 ARG 44 HB2 ARG 44 -4.509 0.596 11.552 349 HB3 ARG 44 HB3 ARG 44 -4.893 1.655 10.183 350 HG2 ARG 44 HG2 ARG 44 -5.053 -0.415 8.725 351 HG3 ARG 44 HG3 ARG 44 -4.920 -1.383 10.205 352 HD2 ARG 44 HD2 ARG 44 -7.087 0.626 9.466 353 HD3 ARG 44 HD3 ARG 44 -7.279 -1.118 9.693 354 HE ARG 44 HE ARG 44 -7.365 0.921 11.721 355 HH11 ARG 44 HH11 ARG 44 -6.272 -2.425 11.215 356 HH12 ARG 44 HH12 ARG 44 -6.445 -2.825 12.905 357 HH21 ARG 44 HH21 ARG 44 -7.554 0.332 13.902 358 HH22 ARG 44 HH22 ARG 44 -7.158 -1.299 14.398 359 H GLU 45 H GLU 45 -3.044 3.219 9.523 360 HA GLU 45 HA GLU 45 -0.674 3.979 10.875 361 HB2 GLU 45 HB2 GLU 45 -1.945 5.210 9.072 362 HB3 GLU 45 HB3 GLU 45 -3.123 5.705 10.298 363 HG2 GLU 45 HG2 GLU 45 -0.131 6.320 10.385 364 HG3 GLU 45 HG3 GLU 45 -1.355 7.410 9.703 365 H GLU 46 H GLU 46 -3.935 3.398 12.005 366 HA GLU 46 HA GLU 46 -3.828 4.839 14.470 367 HB2 GLU 46 HB2 GLU 46 -5.888 3.937 13.355 368 HB3 GLU 46 HB3 GLU 46 -5.323 2.295 13.700 369 HG2 GLU 46 HG2 GLU 46 -5.443 2.757 16.121 370 HG3 GLU 46 HG3 GLU 46 -5.930 4.435 15.782 371 H ILE 47 H ILE 47 -2.770 1.567 13.504 372 HA ILE 47 HA ILE 47 -2.280 0.835 16.321 373 HB ILE 47 HB ILE 47 -1.831 -0.753 13.774 374 HG12 ILE 47 HG12 ILE 47 -4.144 -0.223 13.718 375 HG13 ILE 47 HG13 ILE 47 -4.019 -1.872 14.340 376 HG21 ILE 47 HG21 ILE 47 -2.148 -1.592 16.690 377 HG22 ILE 47 HG22 ILE 47 -2.038 -2.708 15.305 378 HG23 ILE 47 HG23 ILE 47 -0.663 -1.672 15.714 379 HD11 ILE 47 HD11 ILE 47 -5.672 -0.662 15.639 380 HD12 ILE 47 HD12 ILE 47 -4.252 -0.954 16.671 381 HD13 ILE 47 HD13 ILE 47 -4.528 0.659 15.945 382 H TYR 48 H TYR 48 -0.543 1.774 13.400 383 HA TYR 48 HA TYR 48 2.019 0.783 13.886 384 HB2 TYR 48 HB2 TYR 48 1.235 1.895 11.834 385 HB3 TYR 48 HB3 TYR 48 1.107 3.429 12.692 386 HD1 TYR 48 HD2 TYR 48 3.512 0.877 11.437 387 HD2 TYR 48 HD1 TYR 48 3.026 4.832 13.080 388 HE1 TYR 48 HE2 TYR 48 5.831 1.428 10.786 389 HE2 TYR 48 HE1 TYR 48 5.307 5.413 12.381 390 HH TYR 48 HH TYR 48 7.242 4.687 11.369 391 H GLN 49 H GLN 49 0.322 3.465 15.414 392 HA GLN 49 HA GLN 49 2.536 4.903 16.431 393 HB2 GLN 49 HB2 GLN 49 -0.343 4.620 17.338 394 HB3 GLN 49 HB3 GLN 49 0.792 5.805 18.025 395 HG2 GLN 49 HG2 GLN 49 1.083 6.908 15.910 396 HG3 GLN 49 HG3 GLN 49 0.305 5.605 15.026 397 HE21 GLN 49 HE22 GLN 49 -1.120 7.189 14.086 398 HE22 GLN 49 HE21 GLN 49 -2.493 7.806 14.966 399 H ARG 50 H ARG 50 1.358 1.763 17.393 400 HA ARG 50 HA ARG 50 2.399 1.980 20.146 401 HB2 ARG 50 HB2 ARG 50 1.229 -0.235 18.420 402 HB3 ARG 50 HB3 ARG 50 2.066 -0.592 19.925 403 HG2 ARG 50 HG2 ARG 50 -0.311 -0.478 20.356 404 HG3 ARG 50 HG3 ARG 50 0.532 0.825 21.200 405 HD2 ARG 50 HD2 ARG 50 -0.181 2.430 19.468 406 HD3 ARG 50 HD3 ARG 50 -1.001 1.117 18.588 407 HE ARG 50 HE ARG 50 -1.957 1.133 21.255 408 HH11 ARG 50 HH11 ARG 50 -2.096 3.161 18.354 409 HH12 ARG 50 HH12 ARG 50 -3.616 3.892 18.800 410 HH21 ARG 50 HH21 ARG 50 -3.953 2.096 21.794 411 HH22 ARG 50 HH22 ARG 50 -4.669 3.282 20.731 412 H ILE 51 H ILE 51 3.291 0.611 16.989 413 HA ILE 51 HA ILE 51 5.652 -0.751 17.831 414 HB ILE 51 HB ILE 51 4.789 0.321 15.117 415 HG12 ILE 51 HG12 ILE 51 4.121 -1.906 14.589 416 HG13 ILE 51 HG13 ILE 51 4.662 -2.542 16.152 417 HG21 ILE 51 HG21 ILE 51 6.902 -1.743 15.855 418 HG22 ILE 51 HG22 ILE 51 6.339 -1.386 14.201 419 HG23 ILE 51 HG23 ILE 51 7.209 -0.152 15.121 420 HD11 ILE 51 HD11 ILE 51 2.171 -2.294 15.860 421 HD12 ILE 51 HD12 ILE 51 2.825 -1.480 17.283 422 HD13 ILE 51 HD13 ILE 51 2.409 -0.533 15.814 423 H GLN 52 H GLN 52 4.884 2.541 17.445 424 HA GLN 52 HA GLN 52 7.766 3.281 17.315 425 HB2 GLN 52 HB2 GLN 52 5.329 5.026 16.757 426 HB3 GLN 52 HB3 GLN 52 7.006 5.478 16.491 427 HG2 GLN 52 HG2 GLN 52 5.403 3.386 14.997 428 HG3 GLN 52 HG3 GLN 52 6.097 4.889 14.375 429 HE21 GLN 52 HE22 GLN 52 6.410 1.764 13.978 430 HE22 GLN 52 HE21 GLN 52 8.140 1.561 13.848 431 H ALA 53 H ALA 53 5.565 2.736 19.731 432 HA ALA 53 HA ALA 53 6.757 4.914 21.354 433 HB1 ALA 53 HB1 ALA 53 3.792 4.265 21.262 434 HB2 ALA 53 HB2 ALA 53 4.573 5.486 22.292 435 HB3 ALA 53 HB3 ALA 53 4.568 5.690 20.527 436 H GLY 54 H GLY 54 6.155 1.580 21.162 437 HA2 GLY 54 HA2 GLY 54 7.238 1.113 23.739 438 HA3 GLY 54 HA3 GLY 54 5.486 0.968 23.873 439 H LEU 55 H LEU 55 5.688 0.064 20.863 440 HA LEU 55 HA LEU 55 6.026 -1.745 19.580 441 HB2 LEU 55 HB2 LEU 55 7.963 -2.602 21.746 442 HB3 LEU 55 HB3 LEU 55 7.832 -3.328 20.163 443 HG LEU 55 HG LEU 55 9.117 -1.774 19.183 444 HD11 LEU 55 HD11 LEU 55 8.125 0.550 20.854 445 HD12 LEU 55 HD12 LEU 55 9.028 0.577 19.331 446 HD13 LEU 55 HD13 LEU 55 7.342 0.026 19.338 447 HD21 LEU 55 HD21 LEU 55 10.340 -2.294 21.288 448 HD22 LEU 55 HD22 LEU 55 10.684 -0.640 20.719 449 HD23 LEU 55 HD23 LEU 55 9.551 -0.903 22.068 450 H THR 56 H THR 56 5.953 -4.263 19.614 451 HA THR 56 HA THR 56 4.134 -5.243 21.718 452 HB THR 56 HB THR 56 2.721 -4.166 20.002 453 HG1 THR 56 HG1 THR 56 2.599 -6.988 20.095 454 HG21 THR 56 HG21 THR 56 2.519 -5.176 17.761 455 HG22 THR 56 HG22 THR 56 4.146 -4.522 18.016 456 HG23 THR 56 HG23 THR 56 3.869 -6.275 18.125 457 H ALA 57 H ALA 57 6.917 -5.723 20.206 458 HA ALA 57 HA ALA 57 6.785 -8.632 20.514 459 HB1 ALA 57 HB1 ALA 57 7.559 -7.332 17.869 460 HB2 ALA 57 HB2 ALA 57 7.714 -9.057 18.267 461 HB3 ALA 57 HB3 ALA 57 6.107 -8.316 18.163 462 HA PRO 58 HA PRO 58 10.591 -6.435 22.133 463 HB2 PRO 58 HB2 PRO 58 10.102 -8.673 24.091 464 HB3 PRO 58 HB3 PRO 58 10.719 -7.017 24.397 465 HG2 PRO 58 HG2 PRO 58 8.124 -7.630 24.931 466 HG3 PRO 58 HG3 PRO 58 8.524 -6.088 24.102 467 HD2 PRO 58 HD2 PRO 58 7.549 -8.675 22.870 468 HD3 PRO 58 HD3 PRO 58 7.035 -6.987 22.536 469 H ASP 59 H ASP 59 12.676 -7.521 22.885 470 HA ASP 59 HA ASP 59 13.718 -9.153 20.829 471 HB2 ASP 59 HB2 ASP 59 14.897 -7.511 22.409 472 HB3 ASP 59 HB3 ASP 59 14.816 -8.753 23.641 473 H5' U 36 H5' U 36 -4.969 10.407 -17.149 474 H5'' U 36 H5'' U 36 -5.953 10.052 -15.717 475 H4' U 36 H4' U 36 -3.469 11.839 -15.711 476 H3' U 36 H3' U 36 -3.195 9.200 -16.112 477 H2' U 36 H2' U 36 -4.712 8.350 -14.635 478 HO2' U 36 HO2' U 36 -2.665 7.623 -13.830 479 H1' U 36 H1' U 36 -4.284 10.139 -12.313 480 H3 U 36 H3 U 36 -8.811 11.596 -12.086 481 H5 U 36 H5 U 36 -8.671 7.717 -13.682 482 H6 U 36 H6 U 36 -6.294 7.938 -13.898 483 HO5' U 36 HO5' U 36 -6.280 12.329 -15.520 484 H5' C 37 H5' C 37 -0.344 9.162 -18.400 485 H5'' C 37 H5'' C 37 -1.844 8.629 -17.610 486 H4' C 37 H4' C 37 0.727 7.032 -17.424 487 H3' C 37 H3' C 37 -0.398 7.422 -19.894 488 H2' C 37 H2' C 37 -2.597 6.938 -19.304 489 HO2' C 37 HO2' C 37 -1.414 4.474 -20.067 490 H1' C 37 H1' C 37 -1.798 4.527 -17.691 491 H41 C 37 H41 C 37 -7.658 5.283 -15.378 492 H42 C 37 H42 C 37 -7.764 6.923 -15.987 493 H5 C 37 H5 C 37 -5.893 8.037 -17.102 494 H6 C 37 H6 C 37 -3.598 7.757 -17.862 495 H5' A 38 H5' A 38 2.632 7.907 -18.073 496 H5'' A 38 H5'' A 38 4.130 7.319 -18.806 497 H4' A 38 H4' A 38 4.566 7.800 -16.486 498 H3' A 38 H3' A 38 5.281 5.378 -17.510 499 H2' A 38 H2' A 38 3.194 4.289 -17.007 500 HO2' A 38 HO2' A 38 4.946 3.876 -14.805 501 H1' A 38 H1' A 38 3.363 5.515 -14.242 502 H8 A 38 H8 A 38 1.223 3.777 -16.847 503 H61 A 38 H61 A 38 -3.400 4.328 -12.739 504 H62 A 38 H62 A 38 -2.907 3.598 -14.255 505 H2 A 38 H2 A 38 0.032 6.803 -11.333 506 H5' G 39 H5' G 39 5.052 8.559 -14.684 507 H5'' G 39 H5'' G 39 6.436 9.539 -15.209 508 H4' G 39 H4' G 39 5.638 10.610 -13.283 509 H3' G 39 H3' G 39 8.191 9.824 -13.182 510 H2' G 39 H2' G 39 7.893 7.646 -12.344 511 HO2' G 39 HO2' G 39 8.286 7.569 -10.146 512 H1' G 39 H1' G 39 5.798 8.292 -10.328 513 H8 G 39 H8 G 39 3.720 6.785 -12.520 514 H1 G 39 H1 G 39 8.103 2.326 -11.045 515 H21 G 39 H21 G 39 9.831 3.256 -10.080 516 H22 G 39 H22 G 39 9.939 4.984 -9.809 517 H5' G 40 H5' G 40 7.011 10.977 -8.759 518 H5'' G 40 H5'' G 40 7.996 12.400 -8.407 519 H4' G 40 H4' G 40 7.669 10.998 -6.431 520 H3' G 40 H3' G 40 10.190 12.015 -7.261 521 H2' G 40 H2' G 40 10.924 9.800 -7.865 522 HO2' G 40 HO2' G 40 11.480 10.205 -5.103 523 H1' G 40 H1' G 40 9.367 8.908 -5.401 524 H8 G 40 H8 G 40 9.972 7.519 -8.995 525 H1 G 40 H1 G 40 11.913 3.702 -4.215 526 H21 G 40 H21 G 40 11.603 4.721 -2.255 527 H22 G 40 H22 G 40 10.889 6.309 -2.149 528 H5' A 41 H5' A 41 7.285 13.892 -3.986 529 H5'' A 41 H5'' A 41 7.061 12.606 -5.185 530 H4' A 41 H4' A 41 6.909 15.549 -5.934 531 H3' A 41 H3' A 41 4.827 13.783 -4.663 532 H2' A 41 H2' A 41 3.216 14.358 -6.244 533 HO2' A 41 HO2' A 41 3.615 16.663 -5.921 534 H1' A 41 H1' A 41 4.907 14.914 -8.424 535 H8 A 41 H8 A 41 4.225 11.807 -6.150 536 H61 A 41 H61 A 41 2.272 9.200 -11.440 537 H62 A 41 H62 A 41 2.422 8.977 -9.705 538 H2 A 41 H2 A 41 3.794 13.254 -12.382 539 H5' C 42 H5' C 42 2.322 14.114 -1.799 540 H5'' C 42 H5'' C 42 2.864 13.812 -3.469 541 H4' C 42 H4' C 42 1.070 14.966 -4.423 542 H3' C 42 H3' C 42 0.799 16.230 -1.700 543 H2' C 42 H2' C 42 -1.527 16.341 -1.897 544 HO2' C 42 HO2' C 42 -1.571 17.232 -4.027 545 H1' C 42 H1' C 42 -1.890 14.059 -3.470 546 H41 C 42 H41 C 42 -3.490 13.285 2.771 547 H42 C 42 H42 C 42 -1.946 12.486 3.015 548 H5 C 42 H5 C 42 -0.246 12.324 1.247 549 H6 C 42 H6 C 42 0.267 12.959 -1.054 550 H5' A 43 H5' A 43 -0.589 17.091 -5.702 551 H5'' A 43 H5'' A 43 0.456 18.430 -6.052 552 H4' A 43 H4' A 43 -1.583 19.773 -6.745 553 H3' A 43 H3' A 43 -2.890 17.423 -5.550 554 H2' A 43 H2' A 43 -4.115 16.657 -7.412 555 HO2' A 43 HO2' A 43 -4.912 18.874 -7.814 556 H1' A 43 H1' A 43 -2.456 17.283 -9.443 557 H8 A 43 H8 A 43 -2.168 15.247 -6.076 558 H61 A 43 H61 A 43 0.696 11.149 -9.744 559 H62 A 43 H62 A 43 0.041 11.435 -8.138 560 H2 A 43 H2 A 43 0.068 14.838 -12.093 561 H5' U 44 H5' U 44 -7.130 17.019 -3.969 562 H5'' U 44 H5'' U 44 -5.514 16.634 -3.346 563 H4' U 44 H4' U 44 -6.538 14.550 -3.965 564 H3' U 44 H3' U 44 -4.442 15.522 -5.920 565 HO3' U 44 HO3' U 44 -3.833 14.950 -3.749 566 H2' U 44 H2' U 44 -4.699 13.481 -7.111 567 HO2' U 44 HO2' U 44 -4.731 12.258 -5.066 568 H1' U 44 H1' U 44 -7.437 13.250 -6.695 569 H3 U 44 H3 U 44 -7.089 13.684 -11.203 570 H5 U 44 H5 U 44 -6.142 17.507 -9.747 571 H6 U 44 H6 U 44 -6.254 16.623 -7.498 572 H1 MET 1 H1 MET 1 0.765 -11.687 4.991 573 H2 MET 1 H2 MET 1 0.831 -12.811 3.795 574 H3 MET 1 H3 MET 1 -0.171 -13.045 5.072 575 HA MET 1 HA MET 1 -0.417 -10.901 3.077 576 HB2 MET 1 HB2 MET 1 -1.007 -13.129 2.168 577 HB3 MET 1 HB3 MET 1 -2.073 -13.411 3.555 578 HG2 MET 1 HG2 MET 1 -3.425 -12.740 1.666 579 HG3 MET 1 HG3 MET 1 -3.464 -11.458 2.862 580 HE1 MET 1 HE1 MET 1 -3.831 -9.505 -0.442 581 HE2 MET 1 HE2 MET 1 -4.492 -11.118 -0.020 582 HE3 MET 1 HE3 MET 1 -4.460 -9.822 1.195 583 H LEU 2 H LEU 2 -1.796 -9.219 3.629 584 HA LEU 2 HA LEU 2 -3.583 -9.637 5.965 585 HB2 LEU 2 HB2 LEU 2 -1.320 -7.756 5.634 586 HB3 LEU 2 HB3 LEU 2 -2.845 -6.967 6.099 587 HG LEU 2 HG LEU 2 -1.540 -9.277 7.562 588 HD11 LEU 2 HD11 LEU 2 -0.287 -7.161 7.712 589 HD12 LEU 2 HD12 LEU 2 -1.751 -6.313 8.251 590 HD13 LEU 2 HD13 LEU 2 -1.026 -7.588 9.270 591 HD21 LEU 2 HD21 LEU 2 -3.966 -7.530 8.223 592 HD22 LEU 2 HD22 LEU 2 -3.985 -9.286 7.901 593 HD23 LEU 2 HD23 LEU 2 -3.192 -8.665 9.353 594 H ILE 3 H ILE 3 -5.460 -8.371 5.937 595 HA ILE 3 HA ILE 3 -5.988 -6.816 3.457 596 HB ILE 3 HB ILE 3 -7.797 -8.940 4.695 597 HG12 ILE 3 HG12 ILE 3 -7.741 -9.617 2.156 598 HG13 ILE 3 HG13 ILE 3 -6.222 -8.708 2.110 599 HG21 ILE 3 HG21 ILE 3 -8.301 -6.999 2.406 600 HG22 ILE 3 HG22 ILE 3 -9.352 -8.355 2.861 601 HG23 ILE 3 HG23 ILE 3 -9.132 -7.002 3.990 602 HD11 ILE 3 HD11 ILE 3 -6.882 -11.044 3.941 603 HD12 ILE 3 HD12 ILE 3 -5.867 -11.120 2.476 604 HD13 ILE 3 HD13 ILE 3 -5.301 -10.220 3.881 605 H LEU 4 H LEU 4 -7.464 -5.119 3.734 606 HA LEU 4 HA LEU 4 -8.293 -4.408 6.485 607 HB2 LEU 4 HB2 LEU 4 -6.496 -2.744 4.674 608 HB3 LEU 4 HB3 LEU 4 -7.262 -2.136 6.141 609 HG LEU 4 HG LEU 4 -5.238 -4.417 6.084 610 HD11 LEU 4 HD11 LEU 4 -4.223 -2.313 5.412 611 HD12 LEU 4 HD12 LEU 4 -5.020 -1.457 6.752 612 HD13 LEU 4 HD13 LEU 4 -3.751 -2.672 7.087 613 HD21 LEU 4 HD21 LEU 4 -6.478 -2.820 8.374 614 HD22 LEU 4 HD22 LEU 4 -6.756 -4.543 8.035 615 HD23 LEU 4 HD23 LEU 4 -5.153 -3.990 8.539 616 H THR 5 H THR 5 -9.717 -2.446 6.458 617 HA THR 5 HA THR 5 -10.712 -1.711 3.772 618 HB THR 5 HB THR 5 -12.781 -2.026 5.919 619 HG1 THR 5 HG1 THR 5 -11.723 -4.140 4.359 620 HG21 THR 5 HG21 THR 5 -13.200 -1.035 3.611 621 HG22 THR 5 HG22 THR 5 -12.787 -2.632 2.937 622 HG23 THR 5 HG23 THR 5 -14.204 -2.440 3.997 623 H ARG 6 H ARG 6 -9.724 0.219 3.854 624 HA ARG 6 HA ARG 6 -10.295 2.097 6.109 625 HB2 ARG 6 HB2 ARG 6 -8.216 2.040 3.876 626 HB3 ARG 6 HB3 ARG 6 -8.424 3.398 4.989 627 HG2 ARG 6 HG2 ARG 6 -8.222 0.902 6.487 628 HG3 ARG 6 HG3 ARG 6 -6.850 1.074 5.384 629 HD2 ARG 6 HD2 ARG 6 -6.314 2.122 7.503 630 HD3 ARG 6 HD3 ARG 6 -6.445 3.371 6.256 631 HE ARG 6 HE ARG 6 -8.910 3.546 7.165 632 HH11 ARG 6 HH11 ARG 6 -5.930 3.176 9.022 633 HH12 ARG 6 HH12 ARG 6 -6.618 3.857 10.480 634 HH21 ARG 6 HH21 ARG 6 -9.775 4.427 9.060 635 HH22 ARG 6 HH22 ARG 6 -8.790 4.580 10.501 636 H LYS 7 H LYS 7 -10.477 4.487 5.247 637 HA LYS 7 HA LYS 7 -11.825 4.505 2.599 638 HB2 LYS 7 HB2 LYS 7 -13.456 6.174 3.410 639 HB3 LYS 7 HB3 LYS 7 -13.703 4.578 4.102 640 HG2 LYS 7 HG2 LYS 7 -12.651 5.286 6.200 641 HG3 LYS 7 HG3 LYS 7 -12.230 6.870 5.482 642 HD2 LYS 7 HD2 LYS 7 -14.700 7.219 5.047 643 HD3 LYS 7 HD3 LYS 7 -15.020 5.743 5.971 644 HE2 LYS 7 HE2 LYS 7 -13.669 8.286 6.969 645 HE3 LYS 7 HE3 LYS 7 -15.308 7.738 7.359 646 HZ1 LYS 7 HZ1 LYS 7 -12.799 6.384 8.100 647 HZ2 LYS 7 HZ2 LYS 7 -13.794 7.194 9.112 648 HZ3 LYS 7 HZ3 LYS 7 -14.307 5.793 8.408 649 H VAL 8 H VAL 8 -12.238 6.890 1.905 650 HA VAL 8 HA VAL 8 -9.619 7.728 1.294 651 HB VAL 8 HB VAL 8 -10.564 9.524 0.084 652 HG11 VAL 8 HG11 VAL 8 -12.466 7.128 0.032 653 HG12 VAL 8 HG12 VAL 8 -12.206 8.276 -1.288 654 HG13 VAL 8 HG13 VAL 8 -10.880 7.203 -0.772 655 HG21 VAL 8 HG21 VAL 8 -12.178 10.464 1.655 656 HG22 VAL 8 HG22 VAL 8 -12.923 10.085 0.093 657 HG23 VAL 8 HG23 VAL 8 -13.207 9.016 1.501 658 H GLY 9 H GLY 9 -8.201 9.061 2.092 659 HA2 GLY 9 HA2 GLY 9 -7.487 11.021 3.229 660 HA3 GLY 9 HA3 GLY 9 -9.001 11.047 4.149 661 H GLU 10 H GLU 10 -7.941 7.847 4.158 662 HA GLU 10 HA GLU 10 -6.665 8.218 6.823 663 HB2 GLU 10 HB2 GLU 10 -8.046 5.810 5.596 664 HB3 GLU 10 HB3 GLU 10 -7.383 5.911 7.241 665 HG2 GLU 10 HG2 GLU 10 -8.900 7.783 7.761 666 HG3 GLU 10 HG3 GLU 10 -9.595 7.702 6.134 667 H SER 11 H SER 11 -5.219 6.050 7.271 668 HA SER 11 HA SER 11 -3.378 5.718 4.967 669 HB2 SER 11 HB2 SER 11 -2.533 6.836 7.663 670 HB3 SER 11 HB3 SER 11 -1.457 6.436 6.305 671 HG SER 11 HG SER 11 -1.989 8.648 6.345 672 H ILE 12 H ILE 12 -1.542 4.306 5.492 673 HA ILE 12 HA ILE 12 -1.981 2.229 7.549 674 HB ILE 12 HB ILE 12 -1.623 1.611 4.584 675 HG12 ILE 12 HG12 ILE 12 -4.143 1.308 6.264 676 HG13 ILE 12 HG13 ILE 12 -3.872 2.587 5.062 677 HG21 ILE 12 HG21 ILE 12 -2.123 -0.722 5.274 678 HG22 ILE 12 HG22 ILE 12 -0.678 -0.119 6.065 679 HG23 ILE 12 HG23 ILE 12 -2.206 -0.204 6.970 680 HD11 ILE 12 HD11 ILE 12 -4.023 -0.384 4.477 681 HD12 ILE 12 HD12 ILE 12 -5.197 0.876 4.038 682 HD13 ILE 12 HD13 ILE 12 -3.583 0.875 3.296 683 H ASN 13 H ASN 13 0.112 0.791 7.574 684 HA ASN 13 HA ASN 13 2.466 2.320 6.596 685 HB2 ASN 13 HB2 ASN 13 1.814 1.666 9.485 686 HB3 ASN 13 HB3 ASN 13 3.457 2.012 8.920 687 HD21 ASN 13 HD22 ASN 13 4.017 4.101 8.167 688 HD22 ASN 13 HD21 ASN 13 3.017 5.489 8.525 689 H ILE 14 H ILE 14 4.425 1.193 6.612 690 HA ILE 14 HA ILE 14 4.354 -1.721 7.113 691 HB ILE 14 HB ILE 14 5.302 -0.456 4.512 692 HG12 ILE 14 HG12 ILE 14 2.865 -2.207 5.087 693 HG13 ILE 14 HG13 ILE 14 2.835 -0.489 4.655 694 HG21 ILE 14 HG21 ILE 14 6.630 -2.421 5.210 695 HG22 ILE 14 HG22 ILE 14 5.128 -3.368 5.393 696 HG23 ILE 14 HG23 ILE 14 5.656 -2.800 3.794 697 HD11 ILE 14 HD11 ILE 14 3.754 -2.782 2.884 698 HD12 ILE 14 HD12 ILE 14 2.318 -1.769 2.683 699 HD13 ILE 14 HD13 ILE 14 3.932 -1.053 2.471 700 H GLY 15 H GLY 15 6.440 -2.573 7.573 701 HA2 GLY 15 HA2 GLY 15 8.520 -2.491 8.566 702 HA3 GLY 15 HA3 GLY 15 8.901 -1.258 7.345 703 H ASP 16 H ASP 16 10.037 0.169 8.581 704 HA ASP 16 HA ASP 16 8.488 1.645 10.653 705 HB2 ASP 16 HB2 ASP 16 11.421 0.850 10.727 706 HB3 ASP 16 HB3 ASP 16 10.662 2.006 11.832 707 H ASP 17 H ASP 17 9.386 1.799 7.613 708 HA ASP 17 HA ASP 17 10.102 4.663 7.707 709 HB2 ASP 17 HB2 ASP 17 11.635 2.556 6.126 710 HB3 ASP 17 HB3 ASP 17 11.862 4.301 6.003 711 H ILE 18 H ILE 18 7.822 2.563 6.718 712 HA ILE 18 HA ILE 18 7.466 4.024 4.142 713 HB ILE 18 HB ILE 18 6.749 1.114 4.649 714 HG12 ILE 18 HG12 ILE 18 8.435 0.959 2.587 715 HG13 ILE 18 HG13 ILE 18 9.122 2.416 3.312 716 HG21 ILE 18 HG21 ILE 18 6.523 2.894 2.193 717 HG22 ILE 18 HG22 ILE 18 6.268 1.135 2.201 718 HG23 ILE 18 HG23 ILE 18 5.181 2.188 3.121 719 HD11 ILE 18 HD11 ILE 18 8.635 -0.240 4.736 720 HD12 ILE 18 HD12 ILE 18 10.212 0.318 4.121 721 HD13 ILE 18 HD13 ILE 18 9.429 1.175 5.459 722 H THR 19 H THR 19 5.411 4.647 3.619 723 HA THR 19 HA THR 19 3.195 4.038 5.494 724 HB THR 19 HB THR 19 3.961 6.835 4.554 725 HG1 THR 19 HG1 THR 19 5.348 6.051 6.167 726 HG21 THR 19 HG21 THR 19 1.551 6.655 4.889 727 HG22 THR 19 HG22 THR 19 1.790 5.824 6.442 728 HG23 THR 19 HG23 THR 19 2.259 7.532 6.260 729 H ILE 20 H ILE 20 1.124 4.381 4.525 730 HA ILE 20 HA ILE 20 1.064 4.741 1.568 731 HB ILE 20 HB ILE 20 -0.331 2.583 3.207 732 HG12 ILE 20 HG12 ILE 20 2.074 2.109 2.831 733 HG13 ILE 20 HG13 ILE 20 0.989 0.939 2.085 734 HG21 ILE 20 HG21 ILE 20 -0.462 3.218 0.232 735 HG22 ILE 20 HG22 ILE 20 -1.100 1.735 0.977 736 HG23 ILE 20 HG23 ILE 20 -1.783 3.310 1.413 737 HD11 ILE 20 HD11 ILE 20 2.889 1.558 0.606 738 HD12 ILE 20 HD12 ILE 20 1.323 1.953 -0.121 739 HD13 ILE 20 HD13 ILE 20 2.313 3.244 0.602 740 H THR 21 H THR 21 -0.854 5.750 0.848 741 HA THR 21 HA THR 21 -2.834 6.498 2.937 742 HB THR 21 HB THR 21 -1.585 8.508 1.025 743 HG1 THR 21 HG1 THR 21 -0.489 9.254 2.856 744 HG21 THR 21 HG21 THR 21 -3.869 9.060 1.861 745 HG22 THR 21 HG22 THR 21 -3.299 8.833 3.529 746 HG23 THR 21 HG23 THR 21 -2.642 10.152 2.530 747 H ILE 22 H ILE 22 -4.898 6.865 2.167 748 HA ILE 22 HA ILE 22 -5.365 6.198 -0.694 749 HB ILE 22 HB ILE 22 -6.386 4.567 0.661 750 HG12 ILE 22 HG12 ILE 22 -8.779 4.818 0.308 751 HG13 ILE 22 HG13 ILE 22 -8.616 6.578 0.167 752 HG21 ILE 22 HG21 ILE 22 -6.238 5.579 2.843 753 HG22 ILE 22 HG22 ILE 22 -7.484 6.785 2.419 754 HG23 ILE 22 HG23 ILE 22 -7.902 5.061 2.544 755 HD11 ILE 22 HD11 ILE 22 -7.379 4.568 -1.728 756 HD12 ILE 22 HD12 ILE 22 -8.862 5.522 -2.016 757 HD13 ILE 22 HD13 ILE 22 -7.301 6.354 -1.855 758 H LEU 23 H LEU 23 -5.221 8.135 -1.727 759 HA LEU 23 HA LEU 23 -5.954 10.587 -0.422 760 HB2 LEU 23 HB2 LEU 23 -5.524 10.221 -3.390 761 HB3 LEU 23 HB3 LEU 23 -5.221 11.658 -2.416 762 HG LEU 23 HG LEU 23 -3.629 9.064 -2.421 763 HD11 LEU 23 HD11 LEU 23 -2.906 11.936 -3.163 764 HD12 LEU 23 HD12 LEU 23 -1.803 10.550 -3.196 765 HD13 LEU 23 HD13 LEU 23 -3.192 10.611 -4.310 766 HD21 LEU 23 HD21 LEU 23 -2.097 10.175 -0.848 767 HD22 LEU 23 HD22 LEU 23 -3.219 11.555 -0.726 768 HD23 LEU 23 HD23 LEU 23 -3.703 9.949 -0.123 769 H GLY 24 H GLY 24 -7.711 8.331 -2.513 770 HA2 GLY 24 HA2 GLY 24 -10.219 9.077 -1.804 771 HA3 GLY 24 HA3 GLY 24 -9.880 10.271 -3.039 772 H VAL 25 H VAL 25 -11.896 9.041 -3.891 773 HA VAL 25 HA VAL 25 -10.918 6.950 -5.763 774 HB VAL 25 HB VAL 25 -12.815 5.547 -5.430 775 HG11 VAL 25 HG11 VAL 25 -12.605 4.819 -3.133 776 HG12 VAL 25 HG12 VAL 25 -11.003 5.291 -3.746 777 HG13 VAL 25 HG13 VAL 25 -11.891 6.379 -2.655 778 HG21 VAL 25 HG21 VAL 25 -14.569 7.175 -5.156 779 HG22 VAL 25 HG22 VAL 25 -14.609 6.051 -3.800 780 HG23 VAL 25 HG23 VAL 25 -13.917 7.676 -3.568 781 H SER 26 H SER 26 -12.280 6.615 -7.615 782 HA SER 26 HA SER 26 -14.314 8.634 -8.281 783 HB2 SER 26 HB2 SER 26 -11.754 8.257 -9.888 784 HB3 SER 26 HB3 SER 26 -13.176 9.176 -10.424 785 HG SER 26 HG SER 26 -11.562 10.498 -9.482 786 H GLY 27 H GLY 27 -15.752 6.800 -8.281 787 HA2 GLY 27 HA2 GLY 27 -16.930 5.176 -9.458 788 HA3 GLY 27 HA3 GLY 27 -15.752 5.331 -10.782 789 H GLN 28 H GLN 28 -14.191 3.737 -11.016 790 HA GLN 28 HA GLN 28 -13.898 1.785 -8.765 791 HB2 GLN 28 HB2 GLN 28 -13.079 1.547 -11.692 792 HB3 GLN 28 HB3 GLN 28 -12.839 0.318 -10.453 793 HG2 GLN 28 HG2 GLN 28 -15.528 1.312 -11.443 794 HG3 GLN 28 HG3 GLN 28 -14.700 -0.202 -11.892 795 HE21 GLN 28 HE22 GLN 28 -16.057 1.559 -9.032 796 HE22 GLN 28 HE21 GLN 28 -16.449 0.110 -8.136 797 H GLN 29 H GLN 29 -12.349 4.335 -10.597 798 HA GLN 29 HA GLN 29 -9.660 3.515 -10.032 799 HB2 GLN 29 HB2 GLN 29 -10.893 6.201 -10.773 800 HB3 GLN 29 HB3 GLN 29 -9.187 6.007 -10.368 801 HG2 GLN 29 HG2 GLN 29 -9.442 5.896 -12.777 802 HG3 GLN 29 HG3 GLN 29 -8.841 4.382 -12.109 803 HE21 GLN 29 HE22 GLN 29 -9.590 2.817 -13.431 804 HE22 GLN 29 HE21 GLN 29 -11.294 2.619 -13.821 805 H VAL 30 H VAL 30 -8.256 4.268 -8.450 806 HA VAL 30 HA VAL 30 -9.410 5.551 -6.044 807 HB VAL 30 HB VAL 30 -7.775 2.964 -6.125 808 HG11 VAL 30 HG11 VAL 30 -7.364 4.494 -4.162 809 HG12 VAL 30 HG12 VAL 30 -9.096 4.368 -3.781 810 HG13 VAL 30 HG13 VAL 30 -8.070 2.911 -3.731 811 HG21 VAL 30 HG21 VAL 30 -10.688 3.453 -5.375 812 HG22 VAL 30 HG22 VAL 30 -10.098 2.524 -6.777 813 HG23 VAL 30 HG23 VAL 30 -9.802 1.930 -5.136 814 H ARG 31 H ARG 31 -8.174 7.332 -5.804 815 HA ARG 31 HA ARG 31 -5.435 7.497 -6.822 816 HB2 ARG 31 HB2 ARG 31 -7.371 9.285 -5.338 817 HB3 ARG 31 HB3 ARG 31 -5.638 9.658 -5.276 818 HG2 ARG 31 HG2 ARG 31 -7.042 9.236 -7.923 819 HG3 ARG 31 HG3 ARG 31 -6.975 10.810 -7.097 820 HD2 ARG 31 HD2 ARG 31 -4.476 10.589 -6.944 821 HD3 ARG 31 HD3 ARG 31 -4.585 9.136 -7.954 822 HE ARG 31 HE ARG 31 -5.946 11.298 -9.233 823 HH11 ARG 31 HH11 ARG 31 -2.694 10.204 -8.421 824 HH12 ARG 31 HH12 ARG 31 -1.936 11.052 -9.756 825 HH21 ARG 31 HH21 ARG 31 -4.944 12.367 -10.989 826 HH22 ARG 31 HH22 ARG 31 -3.206 12.297 -11.185 827 H ILE 32 H ILE 32 -3.732 6.741 -5.781 828 HA ILE 32 HA ILE 32 -3.897 6.377 -2.813 829 HB ILE 32 HB ILE 32 -2.513 4.441 -4.688 830 HG12 ILE 32 HG12 ILE 32 -5.374 4.395 -3.669 831 HG13 ILE 32 HG13 ILE 32 -4.801 4.363 -5.343 832 HG21 ILE 32 HG21 ILE 32 -3.474 4.186 -1.803 833 HG22 ILE 32 HG22 ILE 32 -2.598 2.943 -2.729 834 HG23 ILE 32 HG23 ILE 32 -1.787 4.446 -2.312 835 HD11 ILE 32 HD11 ILE 32 -5.509 2.138 -4.751 836 HD12 ILE 32 HD12 ILE 32 -3.736 2.137 -4.897 837 HD13 ILE 32 HD13 ILE 32 -4.510 2.141 -3.291 838 H GLY 33 H GLY 33 -1.840 6.449 -1.713 839 HA2 GLY 33 HA2 GLY 33 0.395 7.582 -3.325 840 HA3 GLY 33 HA3 GLY 33 -0.141 8.373 -1.830 841 H ILE 34 H ILE 34 2.458 7.391 -2.309 842 HA ILE 34 HA ILE 34 2.736 5.302 -0.218 843 HB ILE 34 HB ILE 34 4.151 5.323 -2.922 844 HG12 ILE 34 HG12 ILE 34 2.055 3.339 -1.944 845 HG13 ILE 34 HG13 ILE 34 1.743 4.645 -3.097 846 HG21 ILE 34 HG21 ILE 34 5.531 4.441 -1.079 847 HG22 ILE 34 HG22 ILE 34 4.235 3.321 -0.622 848 HG23 ILE 34 HG23 ILE 34 5.077 3.140 -2.179 849 HD11 ILE 34 HD11 ILE 34 3.664 2.320 -3.505 850 HD12 ILE 34 HD12 ILE 34 2.124 2.616 -4.336 851 HD13 ILE 34 HD13 ILE 34 3.501 3.721 -4.596 852 H ASN 35 H ASN 35 4.600 5.569 1.012 853 HA ASN 35 HA ASN 35 6.382 7.814 0.246 854 HB2 ASN 35 HB2 ASN 35 4.439 8.609 1.644 855 HB3 ASN 35 HB3 ASN 35 5.003 7.570 2.944 856 HD21 ASN 35 HD22 ASN 35 4.717 10.544 2.763 857 HD22 ASN 35 HD21 ASN 35 6.304 11.203 3.101 858 H ALA 36 H ALA 36 8.247 6.767 0.076 859 HA ALA 36 HA ALA 36 9.321 5.368 2.443 860 HB1 ALA 36 HB1 ALA 36 9.192 4.159 -0.357 861 HB2 ALA 36 HB2 ALA 36 10.077 3.480 1.017 862 HB3 ALA 36 HB3 ALA 36 8.301 3.571 1.074 863 HA PRO 37 HA PRO 37 13.028 7.402 1.162 864 HB2 PRO 37 HB2 PRO 37 14.919 5.498 1.871 865 HB3 PRO 37 HB3 PRO 37 14.095 6.601 3.037 866 HG2 PRO 37 HG2 PRO 37 13.469 3.728 2.339 867 HG3 PRO 37 HG3 PRO 37 13.520 4.492 3.962 868 HD2 PRO 37 HD2 PRO 37 11.183 4.072 2.631 869 HD3 PRO 37 HD3 PRO 37 11.442 5.550 3.612 870 H LYS 38 H LYS 38 14.720 7.321 -0.444 871 HA LYS 38 HA LYS 38 14.111 5.663 -2.738 872 HB2 LYS 38 HB2 LYS 38 16.405 7.578 -2.095 873 HB3 LYS 38 HB3 LYS 38 16.168 6.826 -3.684 874 HG2 LYS 38 HG2 LYS 38 14.005 8.469 -2.294 875 HG3 LYS 38 HG3 LYS 38 15.181 9.180 -3.408 876 HD2 LYS 38 HD2 LYS 38 13.580 6.763 -4.296 877 HD3 LYS 38 HD3 LYS 38 12.837 8.368 -4.247 878 HE2 LYS 38 HE2 LYS 38 14.682 9.262 -5.641 879 HE3 LYS 38 HE3 LYS 38 15.420 7.645 -5.705 880 HZ1 LYS 38 HZ1 LYS 38 12.769 8.382 -6.740 881 HZ2 LYS 38 HZ2 LYS 38 14.110 8.118 -7.648 882 HZ3 LYS 38 HZ3 LYS 38 13.429 6.872 -6.813 883 H ASP 39 H ASP 39 15.565 4.981 0.093 884 HA ASP 39 HA ASP 39 17.695 3.189 -0.704 885 HB2 ASP 39 HB2 ASP 39 15.987 3.482 1.796 886 HB3 ASP 39 HB3 ASP 39 17.301 2.313 1.648 887 H VAL 40 H VAL 40 14.330 3.031 -1.129 888 HA VAL 40 HA VAL 40 14.473 0.104 -1.590 889 HB VAL 40 HB VAL 40 12.243 -0.196 -0.637 890 HG11 VAL 40 HG11 VAL 40 14.025 1.284 1.346 891 HG12 VAL 40 HG12 VAL 40 12.763 0.102 1.741 892 HG13 VAL 40 HG13 VAL 40 14.230 -0.424 0.879 893 HG21 VAL 40 HG21 VAL 40 11.415 2.123 -1.074 894 HG22 VAL 40 HG22 VAL 40 11.074 1.532 0.566 895 HG23 VAL 40 HG23 VAL 40 12.411 2.674 0.307 896 H ALA 41 H ALA 41 12.462 -0.563 -2.949 897 HA ALA 41 HA ALA 41 12.208 1.535 -5.044 898 HB1 ALA 41 HB1 ALA 41 12.038 -0.364 -6.621 899 HB2 ALA 41 HB2 ALA 41 13.537 -0.466 -5.664 900 HB3 ALA 41 HB3 ALA 41 12.141 -1.504 -5.268 901 H VAL 42 H VAL 42 10.244 1.647 -6.255 902 HA VAL 42 HA VAL 42 7.931 0.083 -5.420 903 HB VAL 42 HB VAL 42 7.646 1.661 -3.719 904 HG11 VAL 42 HG11 VAL 42 8.548 3.816 -5.655 905 HG12 VAL 42 HG12 VAL 42 7.881 4.122 -4.031 906 HG13 VAL 42 HG13 VAL 42 9.398 3.229 -4.202 907 HG21 VAL 42 HG21 VAL 42 5.601 1.500 -5.092 908 HG22 VAL 42 HG22 VAL 42 5.783 3.113 -4.360 909 HG23 VAL 42 HG23 VAL 42 6.147 2.882 -6.077 910 H HIS 43 H HIS 43 6.828 -0.388 -7.210 911 HA HIS 43 HA HIS 43 6.557 1.600 -9.360 912 HB2 HIS 43 HB2 HIS 43 7.553 -1.170 -10.084 913 HB3 HIS 43 HB3 HIS 43 7.459 0.266 -11.082 914 HD2 HIS 43 HD2 HIS 43 9.643 -1.374 -8.364 915 HE1 HIS 43 HE1 HIS 43 11.917 1.814 -10.024 916 HE2 HIS 43 HE2 HIS 43 11.983 -0.180 -8.454 917 H ARG 44 H ARG 44 5.111 0.612 -11.166 918 HA ARG 44 HA ARG 44 2.777 -0.537 -9.921 919 HB2 ARG 44 HB2 ARG 44 3.605 0.010 -12.802 920 HB3 ARG 44 HB3 ARG 44 1.996 -0.586 -12.342 921 HG2 ARG 44 HG2 ARG 44 1.533 1.405 -11.066 922 HG3 ARG 44 HG3 ARG 44 3.207 1.971 -11.222 923 HD2 ARG 44 HD2 ARG 44 1.652 3.146 -12.760 924 HD3 ARG 44 HD3 ARG 44 2.958 2.300 -13.595 925 HE ARG 44 HE ARG 44 0.149 1.270 -13.374 926 HH11 ARG 44 HH11 ARG 44 3.141 1.720 -15.238 927 HH12 ARG 44 HH12 ARG 44 2.574 0.721 -16.559 928 HH21 ARG 44 HH21 ARG 44 -0.559 0.060 -15.179 929 HH22 ARG 44 HH22 ARG 44 0.501 -0.145 -16.555 930 H GLU 45 H GLU 45 1.782 -2.598 -10.698 931 HA GLU 45 HA GLU 45 3.640 -4.718 -10.385 932 HB2 GLU 45 HB2 GLU 45 1.258 -4.765 -9.754 933 HB3 GLU 45 HB3 GLU 45 0.775 -4.738 -11.449 934 HG2 GLU 45 HG2 GLU 45 2.571 -6.918 -10.315 935 HG3 GLU 45 HG3 GLU 45 0.822 -6.991 -10.129 936 H GLU 46 H GLU 46 2.724 -2.883 -13.162 937 HA GLU 46 HA GLU 46 3.462 -4.836 -15.175 938 HB2 GLU 46 HB2 GLU 46 1.900 -2.953 -15.547 939 HB3 GLU 46 HB3 GLU 46 3.199 -1.794 -15.226 940 HG2 GLU 46 HG2 GLU 46 4.442 -2.592 -17.191 941 HG3 GLU 46 HG3 GLU 46 3.255 -3.884 -17.445 942 H ILE 47 H ILE 47 5.048 -1.925 -13.741 943 HA ILE 47 HA ILE 47 7.446 -2.209 -15.318 944 HB ILE 47 HB ILE 47 6.600 -0.562 -12.924 945 HG12 ILE 47 HG12 ILE 47 7.002 1.322 -14.424 946 HG13 ILE 47 HG13 ILE 47 7.630 0.235 -15.666 947 HG21 ILE 47 HG21 ILE 47 9.367 -0.617 -14.203 948 HG22 ILE 47 HG22 ILE 47 8.791 0.623 -13.065 949 HG23 ILE 47 HG23 ILE 47 8.981 -1.045 -12.521 950 HD11 ILE 47 HD11 ILE 47 4.764 0.193 -14.629 951 HD12 ILE 47 HD12 ILE 47 5.300 1.023 -16.102 952 HD13 ILE 47 HD13 ILE 47 5.418 -0.743 -16.001 953 H TYR 48 H TYR 48 6.347 -3.456 -12.208 954 HA TYR 48 HA TYR 48 8.851 -4.030 -11.036 955 HB2 TYR 48 HB2 TYR 48 6.648 -4.023 -9.918 956 HB3 TYR 48 HB3 TYR 48 6.183 -5.469 -10.809 957 HD1 TYR 48 HD1 TYR 48 8.652 -4.147 -8.347 958 HD2 TYR 48 HD2 TYR 48 6.766 -7.632 -10.020 959 HE1 TYR 48 HE1 TYR 48 9.602 -5.529 -6.517 960 HE2 TYR 48 HE2 TYR 48 7.671 -9.014 -8.195 961 HH TYR 48 HH TYR 48 9.688 -7.621 -5.562 962 H GLN 49 H GLN 49 7.028 -5.761 -13.555 963 HA GLN 49 HA GLN 49 8.470 -8.242 -13.237 964 HB2 GLN 49 HB2 GLN 49 6.747 -7.129 -15.487 965 HB3 GLN 49 HB3 GLN 49 7.377 -8.788 -15.429 966 HG2 GLN 49 HG2 GLN 49 6.179 -9.235 -13.355 967 HG3 GLN 49 HG3 GLN 49 5.659 -7.554 -13.235 968 HE21 GLN 49 HE22 GLN 49 3.581 -7.250 -13.793 969 HE22 GLN 49 HE21 GLN 49 2.704 -8.144 -15.008 970 H ARG 50 H ARG 50 9.144 -5.215 -14.879 971 HA ARG 50 HA ARG 50 11.096 -6.322 -16.762 972 HB2 ARG 50 HB2 ARG 50 10.294 -3.544 -15.815 973 HB3 ARG 50 HB3 ARG 50 11.759 -3.797 -16.760 974 HG2 ARG 50 HG2 ARG 50 10.017 -3.184 -18.273 975 HG3 ARG 50 HG3 ARG 50 10.412 -4.893 -18.546 976 HD2 ARG 50 HD2 ARG 50 8.430 -5.562 -17.240 977 HD3 ARG 50 HD3 ARG 50 8.059 -3.853 -16.913 978 HE ARG 50 HE ARG 50 8.272 -4.135 -19.709 979 HH11 ARG 50 HH11 ARG 50 6.146 -5.290 -17.131 980 HH12 ARG 50 HH12 ARG 50 4.797 -5.557 -18.213 981 HH21 ARG 50 HH21 ARG 50 6.485 -4.448 -21.071 982 HH22 ARG 50 HH22 ARG 50 4.972 -5.038 -20.418 983 H ILE 51 H ILE 51 10.984 -5.591 -13.419 984 HA ILE 51 HA ILE 51 13.900 -5.062 -13.267 985 HB ILE 51 HB ILE 51 11.602 -4.745 -11.303 986 HG12 ILE 51 HG12 ILE 51 13.297 -2.671 -12.774 987 HG13 ILE 51 HG13 ILE 51 11.707 -3.195 -13.331 988 HG21 ILE 51 HG21 ILE 51 14.510 -3.884 -11.052 989 HG22 ILE 51 HG22 ILE 51 13.214 -3.573 -9.868 990 HG23 ILE 51 HG23 ILE 51 13.761 -5.229 -10.159 991 HD11 ILE 51 HD11 ILE 51 12.285 -1.811 -10.699 992 HD12 ILE 51 HD12 ILE 51 11.471 -1.131 -12.133 993 HD13 ILE 51 HD13 ILE 51 10.690 -2.436 -11.215 994 H GLN 52 H GLN 52 11.340 -7.247 -11.942 995 HA GLN 52 HA GLN 52 13.274 -8.790 -10.455 996 HB2 GLN 52 HB2 GLN 52 10.382 -9.346 -11.238 997 HB3 GLN 52 HB3 GLN 52 11.331 -10.352 -10.129 998 HG2 GLN 52 HG2 GLN 52 10.480 -7.469 -9.749 999 HG3 GLN 52 HG3 GLN 52 10.086 -8.890 -8.753 1000 HE21 GLN 52 HE22 GLN 52 12.030 -6.162 -8.955 1001 HE22 GLN 52 HE21 GLN 52 13.321 -6.644 -7.879 1002 H ALA 53 H ALA 53 13.017 -8.520 -13.717 1003 HA ALA 53 HA ALA 53 13.085 -11.229 -14.599 1004 HB1 ALA 53 HB1 ALA 53 14.073 -10.266 -16.638 1005 HB2 ALA 53 HB2 ALA 53 12.696 -9.292 -16.076 1006 HB3 ALA 53 HB3 ALA 53 14.357 -8.727 -15.782 1007 H GLY 54 H GLY 54 15.404 -9.388 -12.779 1008 HA2 GLY 54 HA2 GLY 54 17.063 -11.323 -12.002 1009 HA3 GLY 54 HA3 GLY 54 17.659 -11.092 -13.654 1010 H LEU 55 H LEU 55 16.430 -8.273 -11.880 1011 HA LEU 55 HA LEU 55 19.125 -7.372 -11.175 1012 HB2 LEU 55 HB2 LEU 55 19.023 -5.478 -12.845 1013 HB3 LEU 55 HB3 LEU 55 19.258 -7.085 -13.509 1014 HG LEU 55 HG LEU 55 16.710 -7.153 -13.944 1015 HD11 LEU 55 HD11 LEU 55 17.090 -4.157 -13.518 1016 HD12 LEU 55 HD12 LEU 55 15.696 -4.922 -14.320 1017 HD13 LEU 55 HD13 LEU 55 15.993 -5.218 -12.600 1018 HD21 LEU 55 HD21 LEU 55 18.499 -5.168 -15.390 1019 HD22 LEU 55 HD22 LEU 55 18.436 -6.926 -15.656 1020 HD23 LEU 55 HD23 LEU 55 17.020 -5.925 -16.045 1021 H THR 56 H THR 56 18.773 -4.695 -11.056 1022 HA THR 56 HA THR 56 16.190 -4.147 -9.687 1023 HB THR 56 HB THR 56 18.913 -3.421 -8.537 1024 HG1 THR 56 HG1 THR 56 18.460 -5.630 -8.328 1025 HG21 THR 56 HG21 THR 56 17.541 -2.852 -6.525 1026 HG22 THR 56 HG22 THR 56 17.192 -1.797 -7.906 1027 HG23 THR 56 HG23 THR 56 16.068 -3.109 -7.487 1028 H ALA 57 H ALA 57 18.952 -3.164 -11.588 1029 HA ALA 57 HA ALA 57 17.511 -0.861 -12.625 1030 HB1 ALA 57 HB1 ALA 57 20.115 -0.480 -11.087 1031 HB2 ALA 57 HB2 ALA 57 19.313 0.754 -12.081 1032 HB3 ALA 57 HB3 ALA 57 18.517 0.145 -10.614 1033 HA PRO 58 HA PRO 58 19.742 -3.177 -15.844 1034 HB2 PRO 58 HB2 PRO 58 18.551 -0.845 -17.359 1035 HB3 PRO 58 HB3 PRO 58 18.678 -2.557 -17.863 1036 HG2 PRO 58 HG2 PRO 58 16.338 -1.603 -16.887 1037 HG3 PRO 58 HG3 PRO 58 16.949 -3.190 -16.294 1038 HD2 PRO 58 HD2 PRO 58 17.132 -0.483 -14.960 1039 HD3 PRO 58 HD3 PRO 58 16.741 -2.071 -14.235 1040 H ASP 59 H ASP 59 19.768 0.409 -15.735 1041 HA ASP 59 HA ASP 59 22.623 0.639 -15.573 1042 HB2 ASP 59 HB2 ASP 59 22.447 -0.160 -17.948 1043 HB3 ASP 59 HB3 ASP 59 21.329 1.148 -18.290 1044 H5' U 36 H5' U 36 -16.789 -5.661 9.797 1045 H5'' U 36 H5'' U 36 -16.708 -5.359 8.047 1046 H4' U 36 H4' U 36 -15.538 -7.836 9.398 1047 H3' U 36 H3' U 36 -14.492 -5.412 9.962 1048 H2' U 36 H2' U 36 -14.616 -4.528 7.775 1049 HO2' U 36 HO2' U 36 -12.457 -4.507 6.950 1050 H1' U 36 H1' U 36 -13.342 -7.010 6.642 1051 H3 U 36 H3 U 36 -14.563 -6.588 2.350 1052 H5 U 36 H5 U 36 -16.666 -3.481 4.251 1053 H6 U 36 H6 U 36 -15.895 -4.319 6.365 1054 HO5' U 36 HO5' U 36 -18.648 -6.431 8.684 1055 H5' C 37 H5' C 37 -13.926 -6.203 13.488 1056 H5'' C 37 H5'' C 37 -14.324 -5.248 12.046 1057 H4' C 37 H4' C 37 -11.832 -4.717 13.693 1058 H3' C 37 H3' C 37 -14.319 -4.461 14.845 1059 H2' C 37 H2' C 37 -15.299 -3.187 13.158 1060 HO2' C 37 HO2' C 37 -15.403 -1.926 15.092 1061 H1' C 37 H1' C 37 -12.850 -1.462 12.870 1062 H41 C 37 H41 C 37 -15.779 0.081 7.446 1063 H42 C 37 H42 C 37 -16.727 -1.395 7.448 1064 H5 C 37 H5 C 37 -16.487 -3.109 9.177 1065 H6 C 37 H6 C 37 -15.306 -3.702 11.219 1066 H5' A 38 H5' A 38 -11.447 -6.285 15.054 1067 H5'' A 38 H5'' A 38 -10.545 -6.415 16.571 1068 H4' A 38 H4' A 38 -9.141 -7.223 14.799 1069 H3' A 38 H3' A 38 -8.190 -5.328 16.513 1070 H2' A 38 H2' A 38 -8.925 -3.464 15.177 1071 HO2' A 38 HO2' A 38 -6.604 -3.352 15.601 1072 H1' A 38 H1' A 38 -7.729 -4.872 12.782 1073 H8 A 38 H8 A 38 -9.942 -2.088 14.095 1074 H61 A 38 H61 A 38 -11.010 -0.720 8.133 1075 H62 A 38 H62 A 38 -11.195 -0.178 9.791 1076 H2 A 38 H2 A 38 -8.980 -4.696 8.332 1077 H5' G 39 H5' G 39 -8.038 -8.213 13.381 1078 H5'' G 39 H5'' G 39 -7.903 -9.659 14.394 1079 H4' G 39 H4' G 39 -7.693 -10.550 12.264 1080 H3' G 39 H3' G 39 -5.448 -10.825 13.733 1081 H2' G 39 H2' G 39 -4.371 -8.810 13.115 1082 HO2' G 39 HO2' G 39 -3.623 -10.704 11.142 1083 H1' G 39 H1' G 39 -5.067 -8.889 10.225 1084 H8 G 39 H8 G 39 -7.244 -6.409 11.232 1085 H1 G 39 H1 G 39 -1.329 -4.146 12.263 1086 H21 G 39 H21 G 39 0.109 -5.783 12.346 1087 H22 G 39 H22 G 39 -0.360 -7.460 12.132 1088 H5' G 40 H5' G 40 -4.436 -11.884 9.267 1089 H5'' G 40 H5'' G 40 -4.062 -13.614 9.300 1090 H4' G 40 H4' G 40 -2.714 -12.375 7.647 1091 H3' G 40 H3' G 40 -1.721 -14.307 9.460 1092 H2' G 40 H2' G 40 -0.604 -12.576 10.737 1093 HO2' G 40 HO2' G 40 1.143 -13.429 8.654 1094 H1' G 40 H1' G 40 -0.044 -11.342 8.013 1095 H8 G 40 H8 G 40 -0.935 -10.023 11.568 1096 H1 G 40 H1 G 40 4.600 -7.882 9.118 1097 H21 G 40 H21 G 40 4.978 -8.861 7.157 1098 H22 G 40 H22 G 40 3.843 -9.990 6.458 1099 H5' A 41 H5' A 41 -2.870 -15.061 4.958 1100 H5'' A 41 H5'' A 41 -3.164 -13.729 6.090 1101 H4' A 41 H4' A 41 -4.820 -16.278 6.166 1102 H3' A 41 H3' A 41 -4.948 -13.942 4.283 1103 H2' A 41 H2' A 41 -7.239 -13.617 4.617 1104 HO2' A 41 HO2' A 41 -7.765 -15.862 4.253 1105 H1' A 41 H1' A 41 -7.428 -14.481 7.266 1106 H8 A 41 H8 A 41 -5.252 -11.816 5.419 1107 H61 A 41 H61 A 41 -8.345 -7.826 9.067 1108 H62 A 41 H62 A 41 -7.172 -7.934 7.769 1109 H2 A 41 H2 A 41 -9.636 -11.917 10.093 1110 H5' C 42 H5' C 42 -6.802 -13.866 0.238 1111 H5'' C 42 H5'' C 42 -5.756 -13.083 1.430 1112 H4' C 42 H4' C 42 -7.681 -12.190 2.633 1113 H3' C 42 H3' C 42 -9.398 -13.989 1.837 1114 H2' C 42 H2' C 42 -8.764 -13.770 -0.538 1115 HO2' C 42 HO2' C 42 -11.147 -12.280 -0.024 1116 H1' C 42 H1' C 42 -9.388 -10.836 -0.190 1117 H41 C 42 H41 C 42 -7.169 -11.098 -6.187 1118 H42 C 42 H42 C 42 -5.592 -11.601 -5.609 1119 H5 C 42 H5 C 42 -5.138 -12.056 -3.228 1120 H6 C 42 H6 C 42 -6.148 -12.134 -1.017 1121 H5' A 43 H5' A 43 -11.697 -14.739 3.358 1122 H5'' A 43 H5'' A 43 -11.416 -13.950 1.802 1123 H4' A 43 H4' A 43 -13.927 -13.255 1.929 1124 H3' A 43 H3' A 43 -14.235 -14.690 4.156 1125 H2' A 43 H2' A 43 -12.928 -16.585 3.584 1126 HO2' A 43 HO2' A 43 -15.550 -17.136 2.638 1127 H1' A 43 H1' A 43 -13.892 -17.022 0.834 1128 H8 A 43 H8 A 43 -10.987 -15.201 0.132 1129 H61 A 43 H61 A 43 -7.343 -19.857 2.068 1130 H62 A 43 H62 A 43 -7.356 -18.315 1.235 1131 H2 A 43 H2 A 43 -11.452 -20.664 3.477 1132 H5' U 44 H5' U 44 -17.275 -13.122 -0.114 1133 H5'' U 44 H5'' U 44 -15.986 -14.318 0.096 1134 H4' U 44 H4' U 44 -15.523 -11.421 -0.754 1135 H3' U 44 H3' U 44 -15.813 -13.983 -2.334 1136 HO3' U 44 HO3' U 44 -16.921 -12.520 -3.724 1137 H2' U 44 H2' U 44 -14.238 -13.090 -3.919 1138 HO2' U 44 HO2' U 44 -14.989 -10.867 -3.820 1139 H1' U 44 H1' U 44 -12.462 -12.304 -2.046 1140 H3 U 44 H3 U 44 -10.774 -16.125 -3.827 1141 H5 U 44 H5 U 44 -13.860 -17.437 -1.285 1142 H6 U 44 H6 U 44 -14.484 -15.143 -0.941 Start of MODEL 15 1 H1 MET 1 H1 MET 1 8.754 10.800 -2.812 2 H2 MET 1 H2 MET 1 8.751 9.212 -2.372 3 H3 MET 1 H3 MET 1 8.671 10.390 -1.224 4 HA MET 1 HA MET 1 6.514 9.388 -1.534 5 HB2 MET 1 HB2 MET 1 6.696 11.815 -0.932 6 HB3 MET 1 HB3 MET 1 6.700 12.211 -2.658 7 HG2 MET 1 HG2 MET 1 4.467 12.539 -1.845 8 HG3 MET 1 HG3 MET 1 4.458 11.122 -2.881 9 HE1 MET 1 HE1 MET 1 1.643 10.427 -0.361 10 HE2 MET 1 HE2 MET 1 2.138 11.839 -1.352 11 HE3 MET 1 HE3 MET 1 2.163 10.217 -2.053 12 H LEU 2 H LEU 2 4.958 8.541 -2.920 13 HA LEU 2 HA LEU 2 5.073 9.339 -5.767 14 HB2 LEU 2 HB2 LEU 2 5.630 6.660 -4.609 15 HB3 LEU 2 HB3 LEU 2 4.394 6.654 -5.878 16 HG LEU 2 HG LEU 2 7.194 7.781 -6.153 17 HD11 LEU 2 HD11 LEU 2 7.559 5.842 -7.611 18 HD12 LEU 2 HD12 LEU 2 7.089 5.316 -5.975 19 HD13 LEU 2 HD13 LEU 2 5.902 5.271 -7.299 20 HD21 LEU 2 HD21 LEU 2 5.594 8.950 -7.655 21 HD22 LEU 2 HD22 LEU 2 6.607 7.838 -8.594 22 HD23 LEU 2 HD23 LEU 2 4.937 7.383 -8.187 23 H ILE 3 H ILE 3 3.067 9.017 -6.872 24 HA ILE 3 HA ILE 3 0.759 8.225 -5.193 25 HB ILE 3 HB ILE 3 0.929 10.779 -6.856 26 HG12 ILE 3 HG12 ILE 3 -0.110 11.598 -4.563 27 HG13 ILE 3 HG13 ILE 3 0.649 10.149 -3.897 28 HG21 ILE 3 HG21 ILE 3 -1.434 9.473 -5.449 29 HG22 ILE 3 HG22 ILE 3 -1.433 11.073 -6.223 30 HG23 ILE 3 HG23 ILE 3 -1.227 9.613 -7.215 31 HD11 ILE 3 HD11 ILE 3 1.998 12.470 -5.344 32 HD12 ILE 3 HD12 ILE 3 2.077 12.094 -3.612 33 HD13 ILE 3 HD13 ILE 3 2.866 11.017 -4.786 34 H LEU 4 H LEU 4 -0.589 6.920 -6.248 35 HA LEU 4 HA LEU 4 -0.178 6.370 -9.161 36 HB2 LEU 4 HB2 LEU 4 -0.191 4.590 -6.713 37 HB3 LEU 4 HB3 LEU 4 -0.907 3.971 -8.189 38 HG LEU 4 HG LEU 4 1.408 3.229 -7.871 39 HD11 LEU 4 HD11 LEU 4 2.106 3.611 -10.165 40 HD12 LEU 4 HD12 LEU 4 0.337 3.397 -10.102 41 HD13 LEU 4 HD13 LEU 4 1.041 5.025 -10.291 42 HD21 LEU 4 HD21 LEU 4 2.312 5.323 -6.846 43 HD22 LEU 4 HD22 LEU 4 3.289 4.682 -8.186 44 HD23 LEU 4 HD23 LEU 4 2.244 6.087 -8.459 45 H THR 5 H THR 5 -2.138 5.464 -10.201 46 HA THR 5 HA THR 5 -4.576 5.604 -8.532 47 HB THR 5 HB THR 5 -4.595 6.896 -11.273 48 HG1 THR 5 HG1 THR 5 -3.138 8.048 -9.950 49 HG21 THR 5 HG21 THR 5 -6.724 6.210 -10.321 50 HG22 THR 5 HG22 THR 5 -6.333 7.025 -8.783 51 HG23 THR 5 HG23 THR 5 -6.592 7.984 -10.259 52 H ARG 6 H ARG 6 -5.109 3.507 -8.623 53 HA ARG 6 HA ARG 6 -5.628 2.392 -11.332 54 HB2 ARG 6 HB2 ARG 6 -4.885 0.115 -10.244 55 HB3 ARG 6 HB3 ARG 6 -3.750 1.197 -11.048 56 HG2 ARG 6 HG2 ARG 6 -2.466 1.100 -9.267 57 HG3 ARG 6 HG3 ARG 6 -3.657 2.033 -8.360 58 HD2 ARG 6 HD2 ARG 6 -3.424 -0.993 -8.552 59 HD3 ARG 6 HD3 ARG 6 -3.167 0.001 -7.121 60 HE ARG 6 HE ARG 6 -5.687 -0.987 -8.044 61 HH11 ARG 6 HH11 ARG 6 -4.168 1.809 -6.517 62 HH12 ARG 6 HH12 ARG 6 -5.654 2.369 -5.779 63 HH21 ARG 6 HH21 ARG 6 -7.586 -0.297 -6.996 64 HH22 ARG 6 HH22 ARG 6 -7.563 1.123 -5.977 65 H LYS 7 H LYS 7 -6.955 0.256 -11.041 66 HA LYS 7 HA LYS 7 -9.195 1.116 -9.247 67 HB2 LYS 7 HB2 LYS 7 -10.773 0.326 -10.890 68 HB3 LYS 7 HB3 LYS 7 -9.738 1.558 -11.603 69 HG2 LYS 7 HG2 LYS 7 -8.547 -0.072 -12.888 70 HG3 LYS 7 HG3 LYS 7 -9.147 -1.416 -11.892 71 HD2 LYS 7 HD2 LYS 7 -10.391 -1.453 -13.957 72 HD3 LYS 7 HD3 LYS 7 -11.476 -0.927 -12.664 73 HE2 LYS 7 HE2 LYS 7 -11.854 0.440 -14.617 74 HE3 LYS 7 HE3 LYS 7 -11.128 1.427 -13.341 75 HZ1 LYS 7 HZ1 LYS 7 -9.696 0.262 -15.642 76 HZ2 LYS 7 HZ2 LYS 7 -10.106 1.843 -15.460 77 HZ3 LYS 7 HZ3 LYS 7 -9.007 1.175 -14.455 78 H VAL 8 H VAL 8 -10.916 -0.774 -9.110 79 HA VAL 8 HA VAL 8 -9.650 -2.555 -7.323 80 HB VAL 8 HB VAL 8 -11.772 -3.638 -7.074 81 HG11 VAL 8 HG11 VAL 8 -12.140 -0.644 -7.565 82 HG12 VAL 8 HG12 VAL 8 -13.108 -1.660 -6.484 83 HG13 VAL 8 HG13 VAL 8 -11.393 -1.355 -6.117 84 HG21 VAL 8 HG21 VAL 8 -12.536 -3.836 -9.399 85 HG22 VAL 8 HG22 VAL 8 -13.735 -3.013 -8.370 86 HG23 VAL 8 HG23 VAL 8 -12.731 -2.067 -9.493 87 H GLY 9 H GLY 9 -8.960 -4.610 -7.371 88 HA2 GLY 9 HA2 GLY 9 -8.683 -6.768 -8.256 89 HA3 GLY 9 HA3 GLY 9 -9.201 -6.198 -9.853 90 H GLU 10 H GLU 10 -7.168 -3.797 -9.142 91 HA GLU 10 HA GLU 10 -4.933 -5.051 -10.572 92 HB2 GLU 10 HB2 GLU 10 -5.422 -2.201 -9.612 93 HB3 GLU 10 HB3 GLU 10 -4.060 -2.714 -10.621 94 HG2 GLU 10 HG2 GLU 10 -6.999 -2.914 -11.379 95 HG3 GLU 10 HG3 GLU 10 -5.843 -1.718 -11.977 96 H SER 11 H SER 11 -2.677 -3.988 -9.774 97 HA SER 11 HA SER 11 -2.365 -4.307 -6.852 98 HB2 SER 11 HB2 SER 11 -0.930 -6.009 -8.927 99 HB3 SER 11 HB3 SER 11 -0.535 -5.951 -7.202 100 HG SER 11 HG SER 11 -1.923 -7.691 -7.751 101 H ILE 12 H ILE 12 -0.153 -3.827 -6.160 102 HA ILE 12 HA ILE 12 1.528 -2.183 -7.947 103 HB ILE 12 HB ILE 12 0.394 -1.189 -5.289 104 HG12 ILE 12 HG12 ILE 12 -0.135 -0.333 -8.168 105 HG13 ILE 12 HG13 ILE 12 -1.286 -1.050 -7.033 106 HG21 ILE 12 HG21 ILE 12 1.586 0.903 -5.764 107 HG22 ILE 12 HG22 ILE 12 2.737 -0.424 -5.694 108 HG23 ILE 12 HG23 ILE 12 2.214 0.223 -7.279 109 HD11 ILE 12 HD11 ILE 12 -0.000 1.708 -6.799 110 HD12 ILE 12 HD12 ILE 12 -1.673 1.349 -7.212 111 HD13 ILE 12 HD13 ILE 12 -1.085 0.967 -5.583 112 H ASN 13 H ASN 13 3.728 -1.782 -6.712 113 HA ASN 13 HA ASN 13 4.226 -4.032 -4.824 114 HB2 ASN 13 HB2 ASN 13 5.654 -3.485 -7.453 115 HB3 ASN 13 HB3 ASN 13 6.289 -4.543 -6.184 116 HD21 ASN 13 HD22 ASN 13 5.287 -6.574 -5.769 117 HD22 ASN 13 HD21 ASN 13 4.132 -7.259 -6.890 118 H ILE 14 H ILE 14 6.161 -3.910 -3.629 119 HA ILE 14 HA ILE 14 7.676 -1.371 -3.684 120 HB ILE 14 HB ILE 14 6.415 -2.534 -1.161 121 HG12 ILE 14 HG12 ILE 14 5.744 -0.005 -2.730 122 HG13 ILE 14 HG13 ILE 14 4.723 -1.446 -2.589 123 HG21 ILE 14 HG21 ILE 14 8.039 0.006 -1.613 124 HG22 ILE 14 HG22 ILE 14 7.332 -0.523 -0.069 125 HG23 ILE 14 HG23 ILE 14 8.624 -1.470 -0.801 126 HD11 ILE 14 HD11 ILE 14 4.613 -1.082 -0.113 127 HD12 ILE 14 HD12 ILE 14 5.494 0.445 -0.335 128 HD13 ILE 14 HD13 ILE 14 3.895 0.234 -1.076 129 H GLY 15 H GLY 15 9.808 -1.620 -2.857 130 HA2 GLY 15 HA2 GLY 15 11.782 -2.761 -2.590 131 HA3 GLY 15 HA3 GLY 15 10.872 -3.819 -1.496 132 H ASP 16 H ASP 16 11.746 -5.756 -2.074 133 HA ASP 16 HA ASP 16 11.052 -6.762 -4.785 134 HB2 ASP 16 HB2 ASP 16 13.599 -7.239 -3.195 135 HB3 ASP 16 HB3 ASP 16 13.125 -8.178 -4.617 136 H ASP 17 H ASP 17 10.061 -6.786 -1.779 137 HA ASP 17 HA ASP 17 9.360 -9.661 -1.769 138 HB2 ASP 17 HB2 ASP 17 10.536 -8.171 0.617 139 HB3 ASP 17 HB3 ASP 17 9.902 -9.821 0.637 140 H ILE 18 H ILE 18 8.117 -6.647 -1.973 141 HA ILE 18 HA ILE 18 5.830 -7.403 -0.226 142 HB ILE 18 HB ILE 18 6.874 -4.580 -0.655 143 HG12 ILE 18 HG12 ILE 18 7.038 -4.897 1.999 144 HG13 ILE 18 HG13 ILE 18 7.312 -6.584 1.548 145 HG21 ILE 18 HG21 ILE 18 4.611 -5.706 1.041 146 HG22 ILE 18 HG22 ILE 18 5.207 -4.033 1.101 147 HG23 ILE 18 HG23 ILE 18 4.456 -4.640 -0.381 148 HD11 ILE 18 HD11 ILE 18 9.432 -5.269 1.758 149 HD12 ILE 18 HD12 ILE 18 9.214 -5.855 0.100 150 HD13 ILE 18 HD13 ILE 18 8.846 -4.162 0.490 151 H THR 19 H THR 19 3.807 -7.023 -1.010 152 HA THR 19 HA THR 19 3.490 -5.740 -3.671 153 HB THR 19 HB THR 19 2.443 -8.502 -2.920 154 HG1 THR 19 HG1 THR 19 3.848 -9.188 -4.529 155 HG21 THR 19 HG21 THR 19 1.764 -8.571 -5.339 156 HG22 THR 19 HG22 THR 19 0.855 -7.386 -4.386 157 HG23 THR 19 HG23 THR 19 2.168 -6.847 -5.462 158 H ILE 20 H ILE 20 1.304 -5.050 -4.041 159 HA ILE 20 HA ILE 20 -0.468 -4.973 -1.644 160 HB ILE 20 HB ILE 20 0.241 -2.692 -3.532 161 HG12 ILE 20 HG12 ILE 20 2.045 -3.169 -1.899 162 HG13 ILE 20 HG13 ILE 20 1.300 -1.579 -1.685 163 HG21 ILE 20 HG21 ILE 20 -1.663 -2.818 -1.157 164 HG22 ILE 20 HG22 ILE 20 -1.148 -1.318 -1.959 165 HG23 ILE 20 HG23 ILE 20 -2.077 -2.524 -2.864 166 HD11 ILE 20 HD11 ILE 20 1.722 -2.749 0.474 167 HD12 ILE 20 HD12 ILE 20 0.002 -2.393 0.227 168 HD13 ILE 20 HD13 ILE 20 0.620 -4.046 -0.027 169 H THR 21 H THR 21 -2.674 -5.023 -2.170 170 HA THR 21 HA THR 21 -3.411 -5.141 -5.044 171 HB THR 21 HB THR 21 -4.141 -7.283 -3.002 172 HG1 THR 21 HG1 THR 21 -2.405 -7.371 -5.236 173 HG21 THR 21 HG21 THR 21 -5.887 -6.969 -4.713 174 HG22 THR 21 HG22 THR 21 -4.663 -7.073 -5.998 175 HG23 THR 21 HG23 THR 21 -5.012 -8.490 -4.986 176 H ILE 22 H ILE 22 -5.559 -4.573 -5.440 177 HA ILE 22 HA ILE 22 -7.005 -3.349 -3.135 178 HB ILE 22 HB ILE 22 -6.525 -1.694 -4.723 179 HG12 ILE 22 HG12 ILE 22 -8.692 -1.211 -5.901 180 HG13 ILE 22 HG13 ILE 22 -9.308 -2.769 -5.335 181 HG21 ILE 22 HG21 ILE 22 -7.216 -3.737 -6.857 182 HG22 ILE 22 HG22 ILE 22 -7.000 -2.002 -7.174 183 HG23 ILE 22 HG23 ILE 22 -5.652 -2.937 -6.528 184 HD11 ILE 22 HD11 ILE 22 -8.335 -0.480 -3.588 185 HD12 ILE 22 HD12 ILE 22 -10.027 -0.990 -3.839 186 HD13 ILE 22 HD13 ILE 22 -8.897 -2.064 -2.989 187 H LEU 23 H LEU 23 -8.459 -4.811 -2.307 188 HA LEU 23 HA LEU 23 -9.461 -6.949 -3.992 189 HB2 LEU 23 HB2 LEU 23 -10.416 -6.137 -1.225 190 HB3 LEU 23 HB3 LEU 23 -10.659 -7.685 -2.050 191 HG LEU 23 HG LEU 23 -8.121 -6.552 -0.836 192 HD11 LEU 23 HD11 LEU 23 -8.115 -8.776 0.259 193 HD12 LEU 23 HD12 LEU 23 -9.638 -7.902 0.573 194 HD13 LEU 23 HD13 LEU 23 -9.591 -9.216 -0.617 195 HD21 LEU 23 HD21 LEU 23 -8.314 -8.887 -2.772 196 HD22 LEU 23 HD22 LEU 23 -7.375 -7.391 -3.008 197 HD23 LEU 23 HD23 LEU 23 -6.914 -8.538 -1.729 198 H GLY 24 H GLY 24 -10.595 -3.737 -3.053 199 HA2 GLY 24 HA2 GLY 24 -12.175 -3.190 -5.122 200 HA3 GLY 24 HA3 GLY 24 -13.274 -4.239 -4.237 201 H VAL 25 H VAL 25 -14.560 -2.107 -4.305 202 HA VAL 25 HA VAL 25 -13.916 -0.574 -1.841 203 HB VAL 25 HB VAL 25 -14.368 1.527 -2.834 204 HG11 VAL 25 HG11 VAL 25 -12.651 1.762 -4.527 205 HG12 VAL 25 HG12 VAL 25 -12.099 0.618 -3.283 206 HG13 VAL 25 HG13 VAL 25 -12.675 0.019 -4.857 207 HG21 VAL 25 HG21 VAL 25 -16.244 0.979 -4.261 208 HG22 VAL 25 HG22 VAL 25 -15.003 1.805 -5.210 209 HG23 VAL 25 HG23 VAL 25 -15.187 0.035 -5.347 210 H SER 26 H SER 26 -15.747 0.643 -0.992 211 HA SER 26 HA SER 26 -18.436 -0.034 -1.944 212 HB2 SER 26 HB2 SER 26 -17.861 -1.902 -0.399 213 HB3 SER 26 HB3 SER 26 -17.504 -0.716 0.874 214 HG SER 26 HG SER 26 -19.646 -1.529 1.002 215 H GLY 27 H GLY 27 -19.027 2.082 -2.252 216 HA2 GLY 27 HA2 GLY 27 -19.632 4.245 -1.676 217 HA3 GLY 27 HA3 GLY 27 -19.398 3.790 0.028 218 H GLN 28 H GLN 28 -17.584 4.508 1.089 219 HA GLN 28 HA GLN 28 -15.446 5.798 -0.563 220 HB2 GLN 28 HB2 GLN 28 -16.127 6.218 2.380 221 HB3 GLN 28 HB3 GLN 28 -14.845 7.028 1.471 222 HG2 GLN 28 HG2 GLN 28 -17.829 7.347 1.158 223 HG3 GLN 28 HG3 GLN 28 -16.623 8.545 1.665 224 HE21 GLN 28 HE22 GLN 28 -14.668 8.545 -0.170 225 HE22 GLN 28 HE21 GLN 28 -15.265 8.777 -1.803 226 H GLN 29 H GLN 29 -16.255 3.130 1.489 227 HA GLN 29 HA GLN 29 -13.613 2.738 2.579 228 HB2 GLN 29 HB2 GLN 29 -15.954 0.809 2.223 229 HB3 GLN 29 HB3 GLN 29 -14.412 0.408 2.973 230 HG2 GLN 29 HG2 GLN 29 -15.871 0.914 4.755 231 HG3 GLN 29 HG3 GLN 29 -14.731 2.255 4.619 232 HE21 GLN 29 HE22 GLN 29 -15.500 4.302 4.329 233 HE22 GLN 29 HE21 GLN 29 -17.188 4.678 4.009 234 H VAL 30 H VAL 30 -12.051 1.293 1.917 235 HA VAL 30 HA VAL 30 -12.128 0.267 -0.868 236 HB VAL 30 HB VAL 30 -9.937 1.959 0.424 237 HG11 VAL 30 HG11 VAL 30 -8.769 1.775 -1.681 238 HG12 VAL 30 HG12 VAL 30 -9.072 0.140 -1.050 239 HG13 VAL 30 HG13 VAL 30 -10.078 0.784 -2.372 240 HG21 VAL 30 HG21 VAL 30 -11.818 3.337 -0.360 241 HG22 VAL 30 HG22 VAL 30 -10.409 3.543 -1.421 242 HG23 VAL 30 HG23 VAL 30 -11.770 2.522 -1.941 243 H ARG 31 H ARG 31 -11.965 -1.888 -0.492 244 HA ARG 31 HA ARG 31 -10.585 -2.881 1.902 245 HB2 ARG 31 HB2 ARG 31 -12.762 -3.801 0.913 246 HB3 ARG 31 HB3 ARG 31 -11.771 -4.509 -0.380 247 HG2 ARG 31 HG2 ARG 31 -10.409 -5.692 1.377 248 HG3 ARG 31 HG3 ARG 31 -11.429 -4.939 2.624 249 HD2 ARG 31 HD2 ARG 31 -13.414 -6.006 1.317 250 HD3 ARG 31 HD3 ARG 31 -12.179 -7.055 0.595 251 HE ARG 31 HE ARG 31 -12.727 -6.788 3.530 252 HH11 ARG 31 HH11 ARG 31 -11.782 -8.806 0.756 253 HH12 ARG 31 HH12 ARG 31 -11.619 -10.238 1.760 254 HH21 ARG 31 HH21 ARG 31 -12.497 -8.691 4.747 255 HH22 ARG 31 HH22 ARG 31 -12.003 -10.176 3.950 256 H ILE 32 H ILE 32 -8.523 -3.653 1.933 257 HA ILE 32 HA ILE 32 -7.080 -3.768 -0.671 258 HB ILE 32 HB ILE 32 -5.889 -2.549 1.829 259 HG12 ILE 32 HG12 ILE 32 -7.624 -1.183 -0.253 260 HG13 ILE 32 HG13 ILE 32 -7.811 -1.206 1.512 261 HG21 ILE 32 HG21 ILE 32 -5.290 -2.195 -1.138 262 HG22 ILE 32 HG22 ILE 32 -4.377 -1.490 0.213 263 HG23 ILE 32 HG23 ILE 32 -4.375 -3.237 -0.016 264 HD11 ILE 32 HD11 ILE 32 -5.635 0.218 -0.066 265 HD12 ILE 32 HD12 ILE 32 -6.968 0.958 0.832 266 HD13 ILE 32 HD13 ILE 32 -5.689 0.097 1.717 267 H GLY 33 H GLY 33 -5.166 -5.037 -0.650 268 HA2 GLY 33 HA2 GLY 33 -4.857 -6.866 1.682 269 HA3 GLY 33 HA3 GLY 33 -4.834 -7.470 0.011 270 H ILE 34 H ILE 34 -2.719 -7.663 1.954 271 HA ILE 34 HA ILE 34 -0.543 -6.172 0.580 272 HB ILE 34 HB ILE 34 -0.943 -6.330 3.601 273 HG12 ILE 34 HG12 ILE 34 -1.100 -3.871 1.808 274 HG13 ILE 34 HG13 ILE 34 -2.508 -4.726 2.469 275 HG21 ILE 34 HG21 ILE 34 1.051 -4.840 3.692 276 HG22 ILE 34 HG22 ILE 34 1.429 -6.391 2.945 277 HG23 ILE 34 HG23 ILE 34 1.198 -4.958 1.924 278 HD11 ILE 34 HD11 ILE 34 -2.042 -2.851 3.894 279 HD12 ILE 34 HD12 ILE 34 -1.665 -4.356 4.763 280 HD13 ILE 34 HD13 ILE 34 -0.352 -3.345 4.097 281 H ASN 35 H ASN 35 1.422 -7.272 0.598 282 HA ASN 35 HA ASN 35 1.403 -9.955 1.864 283 HB2 ASN 35 HB2 ASN 35 0.460 -10.038 -0.473 284 HB3 ASN 35 HB3 ASN 35 2.007 -9.452 -1.077 285 HD21 ASN 35 HD22 ASN 35 0.545 -12.011 -1.537 286 HD22 ASN 35 HD21 ASN 35 1.642 -13.287 -1.053 287 H ALA 36 H ALA 36 3.062 -9.731 3.200 288 HA ALA 36 HA ALA 36 5.731 -9.213 2.057 289 HB1 ALA 36 HB1 ALA 36 4.576 -7.707 4.443 290 HB2 ALA 36 HB2 ALA 36 6.268 -7.660 3.917 291 HB3 ALA 36 HB3 ALA 36 4.996 -7.000 2.856 292 HA PRO 37 HA PRO 37 6.808 -12.454 4.859 293 HB2 PRO 37 HB2 PRO 37 9.371 -11.661 5.580 294 HB3 PRO 37 HB3 PRO 37 8.944 -12.459 4.026 295 HG2 PRO 37 HG2 PRO 37 9.365 -9.524 4.621 296 HG3 PRO 37 HG3 PRO 37 9.929 -10.468 3.201 297 HD2 PRO 37 HD2 PRO 37 7.717 -8.888 3.115 298 HD3 PRO 37 HD3 PRO 37 7.787 -10.442 2.229 299 H LYS 38 H LYS 38 7.206 -12.909 7.137 300 HA LYS 38 HA LYS 38 6.195 -10.866 8.927 301 HB2 LYS 38 HB2 LYS 38 7.411 -13.628 9.383 302 HB3 LYS 38 HB3 LYS 38 6.670 -12.648 10.666 303 HG2 LYS 38 HG2 LYS 38 5.196 -13.423 8.114 304 HG3 LYS 38 HG3 LYS 38 5.129 -14.380 9.608 305 HD2 LYS 38 HD2 LYS 38 4.474 -11.416 9.643 306 HD3 LYS 38 HD3 LYS 38 3.301 -12.604 9.086 307 HE2 LYS 38 HE2 LYS 38 3.529 -13.832 11.237 308 HE3 LYS 38 HE3 LYS 38 4.741 -12.657 11.784 309 HZ1 LYS 38 HZ1 LYS 38 1.943 -12.052 11.122 310 HZ2 LYS 38 HZ2 LYS 38 2.557 -12.169 12.642 311 HZ3 LYS 38 HZ3 LYS 38 3.060 -10.957 11.640 312 H ASP 39 H ASP 39 9.090 -11.240 7.495 313 HA ASP 39 HA ASP 39 10.926 -10.418 9.576 314 HB2 ASP 39 HB2 ASP 39 10.979 -10.314 6.534 315 HB3 ASP 39 HB3 ASP 39 12.329 -9.785 7.540 316 H VAL 40 H VAL 40 8.338 -8.821 8.076 317 HA VAL 40 HA VAL 40 9.387 -6.193 8.958 318 HB VAL 40 HB VAL 40 8.499 -5.103 6.963 319 HG11 VAL 40 HG11 VAL 40 10.260 -7.456 6.139 320 HG12 VAL 40 HG12 VAL 40 10.079 -5.923 5.277 321 HG13 VAL 40 HG13 VAL 40 10.860 -5.946 6.876 322 HG21 VAL 40 HG21 VAL 40 6.682 -6.760 6.497 323 HG22 VAL 40 HG22 VAL 40 7.647 -6.329 5.065 324 HG23 VAL 40 HG23 VAL 40 7.937 -7.879 5.884 325 H ALA 41 H ALA 41 7.471 -4.576 9.030 326 HA ALA 41 HA ALA 41 5.189 -6.079 10.215 327 HB1 ALA 41 HB1 ALA 41 6.284 -3.324 10.926 328 HB2 ALA 41 HB2 ALA 41 4.951 -4.171 11.739 329 HB3 ALA 41 HB3 ALA 41 6.597 -4.829 11.827 330 H VAL 42 H VAL 42 3.076 -5.103 10.084 331 HA VAL 42 HA VAL 42 2.642 -2.854 8.273 332 HB VAL 42 HB VAL 42 2.719 -4.384 6.526 333 HG11 VAL 42 HG11 VAL 42 1.664 -6.656 6.609 334 HG12 VAL 42 HG12 VAL 42 3.061 -6.449 7.675 335 HG13 VAL 42 HG13 VAL 42 1.412 -6.423 8.356 336 HG21 VAL 42 HG21 VAL 42 -0.178 -4.559 7.454 337 HG22 VAL 42 HG22 VAL 42 0.541 -3.204 6.540 338 HG23 VAL 42 HG23 VAL 42 0.418 -4.823 5.812 339 H HIS 43 H HIS 43 1.053 -1.686 9.107 340 HA HIS 43 HA HIS 43 -1.327 -2.919 10.268 341 HB2 HIS 43 HB2 HIS 43 0.169 -0.922 11.992 342 HB3 HIS 43 HB3 HIS 43 -1.137 -2.007 12.445 343 HD2 HIS 43 HD2 HIS 43 2.664 -1.979 11.749 344 HE1 HIS 43 HE1 HIS 43 1.827 -5.547 13.905 345 HE2 HIS 43 HE2 HIS 43 3.672 -4.076 12.965 346 H ARG 44 H ARG 44 -2.887 -1.035 11.017 347 HA ARG 44 HA ARG 44 -2.812 0.996 8.941 348 HB2 ARG 44 HB2 ARG 44 -4.961 1.668 9.859 349 HB3 ARG 44 HB3 ARG 44 -4.891 -0.100 9.716 350 HG2 ARG 44 HG2 ARG 44 -4.167 -0.136 12.179 351 HG3 ARG 44 HG3 ARG 44 -4.592 1.591 12.225 352 HD2 ARG 44 HD2 ARG 44 -6.489 0.314 13.024 353 HD3 ARG 44 HD3 ARG 44 -6.904 0.961 11.432 354 HE ARG 44 HE ARG 44 -6.180 -1.865 12.080 355 HH11 ARG 44 HH11 ARG 44 -7.536 0.460 9.779 356 HH12 ARG 44 HH12 ARG 44 -8.058 -0.784 8.670 357 HH21 ARG 44 HH21 ARG 44 -6.818 -3.435 10.624 358 HH22 ARG 44 HH22 ARG 44 -7.661 -2.994 9.159 359 H GLU 45 H GLU 45 -3.187 3.360 9.644 360 HA GLU 45 HA GLU 45 -0.788 4.144 10.905 361 HB2 GLU 45 HB2 GLU 45 -2.244 5.309 9.161 362 HB3 GLU 45 HB3 GLU 45 -3.256 5.878 10.483 363 HG2 GLU 45 HG2 GLU 45 -0.250 6.392 10.270 364 HG3 GLU 45 HG3 GLU 45 -1.475 7.470 9.598 365 H GLU 46 H GLU 46 -3.874 3.326 12.308 366 HA GLU 46 HA GLU 46 -3.619 4.896 14.722 367 HB2 GLU 46 HB2 GLU 46 -5.758 3.993 13.765 368 HB3 GLU 46 HB3 GLU 46 -5.178 2.353 14.104 369 HG2 GLU 46 HG2 GLU 46 -6.700 3.064 15.866 370 HG3 GLU 46 HG3 GLU 46 -5.065 2.883 16.518 371 H ILE 47 H ILE 47 -2.971 1.472 13.826 372 HA ILE 47 HA ILE 47 -2.075 0.771 16.504 373 HB ILE 47 HB ILE 47 -2.217 -0.589 13.805 374 HG12 ILE 47 HG12 ILE 47 -3.631 -2.174 14.992 375 HG13 ILE 47 HG13 ILE 47 -3.245 -1.404 16.539 376 HG21 ILE 47 HG21 ILE 47 -0.079 -1.374 14.743 377 HG22 ILE 47 HG22 ILE 47 -0.867 -1.699 16.307 378 HG23 ILE 47 HG23 ILE 47 -1.298 -2.646 14.866 379 HD11 ILE 47 HD11 ILE 47 -5.529 -0.837 15.673 380 HD12 ILE 47 HD12 ILE 47 -4.507 0.587 15.921 381 HD13 ILE 47 HD13 ILE 47 -4.764 -0.050 14.276 382 H TYR 48 H TYR 48 -0.579 2.021 13.556 383 HA TYR 48 HA TYR 48 2.061 1.125 13.977 384 HB2 TYR 48 HB2 TYR 48 1.179 2.174 11.917 385 HB3 TYR 48 HB3 TYR 48 1.080 3.729 12.750 386 HD1 TYR 48 HD2 TYR 48 3.425 1.091 11.572 387 HD2 TYR 48 HD1 TYR 48 2.999 5.118 13.019 388 HE1 TYR 48 HE2 TYR 48 5.784 1.548 10.966 389 HE2 TYR 48 HE1 TYR 48 5.341 5.602 12.403 390 HH TYR 48 HH TYR 48 7.287 4.767 11.507 391 H GLN 49 H GLN 49 0.247 3.766 15.490 392 HA GLN 49 HA GLN 49 2.479 5.245 16.483 393 HB2 GLN 49 HB2 GLN 49 -0.455 5.098 17.237 394 HB3 GLN 49 HB3 GLN 49 0.685 6.243 17.978 395 HG2 GLN 49 HG2 GLN 49 1.199 7.256 15.850 396 HG3 GLN 49 HG3 GLN 49 0.318 6.009 14.972 397 HE21 GLN 49 HE22 GLN 49 -1.020 7.600 13.966 398 HE22 GLN 49 HE21 GLN 49 -2.317 8.386 14.820 399 H ARG 50 H ARG 50 1.092 2.236 17.566 400 HA ARG 50 HA ARG 50 1.991 2.541 20.346 401 HB2 ARG 50 HB2 ARG 50 0.772 0.341 18.654 402 HB3 ARG 50 HB3 ARG 50 1.534 -0.054 20.181 403 HG2 ARG 50 HG2 ARG 50 -0.819 0.221 20.557 404 HG3 ARG 50 HG3 ARG 50 0.055 1.535 21.367 405 HD2 ARG 50 HD2 ARG 50 -0.552 3.072 19.526 406 HD3 ARG 50 HD3 ARG 50 -1.348 1.734 18.665 407 HE ARG 50 HE ARG 50 -2.425 1.966 21.301 408 HH11 ARG 50 HH11 ARG 50 -2.499 3.625 18.172 409 HH12 ARG 50 HH12 ARG 50 -4.071 4.325 18.471 410 HH21 ARG 50 HH21 ARG 50 -4.464 2.885 21.638 411 HH22 ARG 50 HH22 ARG 50 -5.173 3.921 20.420 412 H ILE 51 H ILE 51 3.436 1.612 17.326 413 HA ILE 51 HA ILE 51 5.198 -0.430 18.520 414 HB ILE 51 HB ILE 51 4.538 0.594 15.748 415 HG12 ILE 51 HG12 ILE 51 4.135 -2.154 16.987 416 HG13 ILE 51 HG13 ILE 51 2.934 -0.860 17.133 417 HG21 ILE 51 HG21 ILE 51 5.926 -1.171 14.810 418 HG22 ILE 51 HG22 ILE 51 6.914 -0.071 15.786 419 HG23 ILE 51 HG23 ILE 51 6.443 -1.666 16.443 420 HD11 ILE 51 HD11 ILE 51 2.339 -2.271 15.282 421 HD12 ILE 51 HD12 ILE 51 2.809 -0.662 14.693 422 HD13 ILE 51 HD13 ILE 51 3.940 -2.032 14.523 423 H GLN 52 H GLN 52 5.851 2.350 16.290 424 HA GLN 52 HA GLN 52 8.643 2.344 16.825 425 HB2 GLN 52 HB2 GLN 52 8.492 4.659 15.713 426 HB3 GLN 52 HB3 GLN 52 7.972 3.266 14.760 427 HG2 GLN 52 HG2 GLN 52 6.497 5.375 14.693 428 HG3 GLN 52 HG3 GLN 52 5.720 3.803 14.895 429 HE21 GLN 52 HE22 GLN 52 4.566 3.326 16.717 430 HE22 GLN 52 HE21 GLN 52 4.351 4.394 18.068 431 H ALA 53 H ALA 53 6.375 3.005 19.077 432 HA ALA 53 HA ALA 53 7.048 5.544 20.108 433 HB1 ALA 53 HB1 ALA 53 5.020 4.255 20.680 434 HB2 ALA 53 HB2 ALA 53 6.032 3.053 21.524 435 HB3 ALA 53 HB3 ALA 53 5.924 4.723 22.134 436 H GLY 54 H GLY 54 8.926 2.611 20.161 437 HA2 GLY 54 HA2 GLY 54 11.297 3.394 20.898 438 HA3 GLY 54 HA3 GLY 54 10.524 3.590 22.484 439 H LEU 55 H LEU 55 9.526 0.956 20.326 440 HA LEU 55 HA LEU 55 11.083 -1.006 21.890 441 HB2 LEU 55 HB2 LEU 55 8.716 -2.116 22.304 442 HB3 LEU 55 HB3 LEU 55 9.443 -0.964 23.450 443 HG LEU 55 HG LEU 55 8.009 0.837 22.122 444 HD11 LEU 55 HD11 LEU 55 6.441 -1.728 21.617 445 HD12 LEU 55 HD12 LEU 55 5.881 -0.065 21.338 446 HD13 LEU 55 HD13 LEU 55 7.190 -0.723 20.347 447 HD21 LEU 55 HD21 LEU 55 7.765 0.213 24.478 448 HD22 LEU 55 HD22 LEU 55 6.190 0.446 23.687 449 HD23 LEU 55 HD23 LEU 55 6.796 -1.204 24.012 450 H THR 56 H THR 56 8.918 -0.263 19.215 451 HA THR 56 HA THR 56 8.139 -1.415 17.528 452 HB THR 56 HB THR 56 10.859 -2.766 17.392 453 HG1 THR 56 HG1 THR 56 11.133 -0.594 17.931 454 HG21 THR 56 HG21 THR 56 8.981 -1.594 15.296 455 HG22 THR 56 HG22 THR 56 10.609 -2.221 14.962 456 HG23 THR 56 HG23 THR 56 9.346 -3.325 15.528 457 H ALA 57 H ALA 57 7.869 -2.876 20.211 458 HA ALA 57 HA ALA 57 6.694 -5.267 19.028 459 HB1 ALA 57 HB1 ALA 57 8.948 -5.500 21.059 460 HB2 ALA 57 HB2 ALA 57 7.914 -6.833 20.485 461 HB3 ALA 57 HB3 ALA 57 9.005 -6.007 19.353 462 HA PRO 58 HA PRO 58 4.509 -3.174 22.664 463 HB2 PRO 58 HB2 PRO 58 2.292 -3.842 20.739 464 HB3 PRO 58 HB3 PRO 58 2.447 -2.445 21.850 465 HG2 PRO 58 HG2 PRO 58 2.997 -2.189 19.180 466 HG3 PRO 58 HG3 PRO 58 4.082 -1.431 20.397 467 HD2 PRO 58 HD2 PRO 58 4.483 -4.046 18.912 468 HD3 PRO 58 HD3 PRO 58 5.648 -2.731 19.253 469 H ASP 59 H ASP 59 2.601 -4.005 23.878 470 HA ASP 59 HA ASP 59 2.766 -6.825 24.409 471 HB2 ASP 59 HB2 ASP 59 2.126 -4.834 25.931 472 HB3 ASP 59 HB3 ASP 59 0.564 -4.849 25.145 473 H5' U 36 H5' U 36 -5.524 10.419 -16.947 474 H5'' U 36 H5'' U 36 -6.616 10.286 -15.552 475 H4' U 36 H4' U 36 -4.380 12.346 -15.753 476 H3' U 36 H3' U 36 -3.836 9.668 -15.578 477 H2' U 36 H2' U 36 -5.421 9.235 -13.858 478 HO2' U 36 HO2' U 36 -3.337 8.495 -13.151 479 H1' U 36 H1' U 36 -4.342 11.667 -12.415 480 H3 U 36 H3 U 36 -7.452 12.188 -9.219 481 H5 U 36 H5 U 36 -8.968 9.022 -11.521 482 H6 U 36 H6 U 36 -7.185 9.383 -13.107 483 HO5' U 36 HO5' U 36 -7.454 11.627 -17.234 484 H5' C 37 H5' C 37 -1.209 10.027 -18.188 485 H5'' C 37 H5'' C 37 -2.603 9.316 -17.352 486 H4' C 37 H4' C 37 0.160 8.032 -17.344 487 H3' C 37 H3' C 37 -1.204 8.363 -19.695 488 H2' C 37 H2' C 37 -3.264 7.553 -18.980 489 HO2' C 37 HO2' C 37 -2.608 6.217 -20.748 490 H1' C 37 H1' C 37 -1.986 5.238 -17.544 491 H41 C 37 H41 C 37 -7.733 4.950 -14.862 492 H42 C 37 H42 C 37 -8.079 6.625 -15.256 493 H5 C 37 H5 C 37 -6.456 8.085 -16.360 494 H6 C 37 H6 C 37 -4.221 8.182 -17.319 495 H5' A 38 H5' A 38 2.182 9.032 -17.869 496 H5'' A 38 H5'' A 38 3.593 8.524 -18.824 497 H4' A 38 H4' A 38 4.249 8.796 -16.524 498 H3' A 38 H3' A 38 4.924 6.551 -17.908 499 H2' A 38 H2' A 38 2.958 5.314 -17.335 500 HO2' A 38 HO2' A 38 5.002 4.721 -15.464 501 H1' A 38 H1' A 38 3.327 6.156 -14.463 502 H8 A 38 H8 A 38 1.089 4.684 -17.134 503 H61 A 38 H61 A 38 -3.282 4.397 -12.769 504 H62 A 38 H62 A 38 -2.816 3.897 -14.385 505 H2 A 38 H2 A 38 0.066 6.896 -11.201 506 H5' G 39 H5' G 39 4.828 9.267 -14.637 507 H5'' G 39 H5'' G 39 6.097 10.399 -15.151 508 H4' G 39 H4' G 39 5.582 11.194 -13.052 509 H3' G 39 H3' G 39 8.088 10.183 -13.233 510 H2' G 39 H2' G 39 7.603 7.973 -12.573 511 HO2' G 39 HO2' G 39 8.177 7.686 -10.404 512 H1' G 39 H1' G 39 5.762 8.733 -10.346 513 H8 G 39 H8 G 39 3.511 7.386 -12.629 514 H1 G 39 H1 G 39 7.342 2.595 -10.747 515 H21 G 39 H21 G 39 9.129 3.388 -9.777 516 H22 G 39 H22 G 39 9.419 5.101 -9.589 517 H5' G 40 H5' G 40 7.175 11.036 -8.753 518 H5'' G 40 H5'' G 40 8.185 12.440 -8.371 519 H4' G 40 H4' G 40 7.874 11.016 -6.422 520 H3' G 40 H3' G 40 10.414 11.948 -7.306 521 H2' G 40 H2' G 40 11.068 9.694 -7.898 522 HO2' G 40 HO2' G 40 11.624 10.088 -5.129 523 H1' G 40 H1' G 40 9.475 8.858 -5.448 524 H8 G 40 H8 G 40 9.961 7.507 -9.059 525 H1 G 40 H1 G 40 11.870 3.538 -4.388 526 H21 G 40 H21 G 40 11.656 4.541 -2.410 527 H22 G 40 H22 G 40 11.002 6.153 -2.263 528 H5' A 41 H5' A 41 7.530 13.973 -4.019 529 H5'' A 41 H5'' A 41 7.268 12.594 -5.098 530 H4' A 41 H4' A 41 7.088 15.459 -6.098 531 H3' A 41 H3' A 41 5.029 13.793 -4.644 532 H2' A 41 H2' A 41 3.379 14.408 -6.194 533 HO2' A 41 HO2' A 41 3.904 16.699 -5.927 534 H1' A 41 H1' A 41 5.111 14.882 -8.395 535 H8 A 41 H8 A 41 4.344 11.710 -6.240 536 H61 A 41 H61 A 41 1.737 9.601 -11.479 537 H62 A 41 H62 A 41 2.033 9.232 -9.791 538 H2 A 41 H2 A 41 3.372 13.634 -12.276 539 H5' C 42 H5' C 42 2.665 14.016 -1.997 540 H5'' C 42 H5'' C 42 3.086 13.888 -3.725 541 H4' C 42 H4' C 42 1.171 14.930 -4.448 542 H3' C 42 H3' C 42 1.020 16.125 -1.676 543 H2' C 42 H2' C 42 -1.342 16.193 -1.809 544 HO2' C 42 HO2' C 42 -1.415 16.894 -4.075 545 H1' C 42 H1' C 42 -1.679 13.832 -3.113 546 H41 C 42 H41 C 42 -2.376 13.094 3.254 547 H42 C 42 H42 C 42 -0.662 12.751 3.415 548 H5 C 42 H5 C 42 0.887 12.871 1.507 549 H6 C 42 H6 C 42 1.043 13.392 -0.882 550 H5' A 43 H5' A 43 -0.179 16.571 -5.575 551 H5'' A 43 H5'' A 43 0.576 18.046 -6.110 552 H4' A 43 H4' A 43 -0.958 18.288 -7.776 553 H3' A 43 H3' A 43 -3.131 17.610 -5.767 554 H2' A 43 H2' A 43 -4.574 17.566 -7.722 555 HO2' A 43 HO2' A 43 -3.584 19.260 -8.913 556 H1' A 43 H1' A 43 -2.857 15.926 -9.053 557 H8 A 43 H8 A 43 -2.433 14.747 -5.495 558 H61 A 43 H61 A 43 -8.085 12.241 -5.978 559 H62 A 43 H62 A 43 -6.629 12.311 -4.999 560 H2 A 43 H2 A 43 -7.475 14.896 -9.463 561 H5' U 44 H5' U 44 -5.355 20.467 -3.443 562 H5'' U 44 H5'' U 44 -3.707 19.821 -3.520 563 H4' U 44 H4' U 44 -4.940 18.742 -1.753 564 H3' U 44 H3' U 44 -3.480 17.390 -3.669 565 HO3' U 44 HO3' U 44 -3.692 15.754 -1.864 566 H2' U 44 H2' U 44 -5.060 16.148 -4.783 567 HO2' U 44 HO2' U 44 -4.450 14.495 -3.398 568 H1' U 44 H1' U 44 -7.216 16.152 -2.851 569 H3 U 44 H3 U 44 -10.530 16.938 -5.826 570 H5 U 44 H5 U 44 -6.995 17.776 -7.962 571 H6 U 44 H6 U 44 -5.761 17.418 -5.975 572 H1 MET 1 H1 MET 1 1.047 -11.660 5.042 573 H2 MET 1 H2 MET 1 1.139 -12.816 3.870 574 H3 MET 1 H3 MET 1 0.207 -13.061 5.205 575 HA MET 1 HA MET 1 -0.251 -11.028 3.128 576 HB2 MET 1 HB2 MET 1 -0.750 -13.399 2.456 577 HB3 MET 1 HB3 MET 1 -1.852 -13.526 3.840 578 HG2 MET 1 HG2 MET 1 -3.171 -13.047 1.890 579 HG3 MET 1 HG3 MET 1 -3.167 -11.604 2.895 580 HE1 MET 1 HE1 MET 1 -3.406 -9.919 -0.504 581 HE2 MET 1 HE2 MET 1 -4.275 -11.275 0.278 582 HE3 MET 1 HE3 MET 1 -3.842 -9.829 1.219 583 H LEU 2 H LEU 2 -1.804 -9.444 3.613 584 HA LEU 2 HA LEU 2 -3.461 -9.875 6.028 585 HB2 LEU 2 HB2 LEU 2 -1.284 -7.932 5.715 586 HB3 LEU 2 HB3 LEU 2 -2.834 -7.120 5.968 587 HG LEU 2 HG LEU 2 -1.594 -9.230 7.745 588 HD11 LEU 2 HD11 LEU 2 -2.130 -6.262 8.183 589 HD12 LEU 2 HD12 LEU 2 -1.389 -7.404 9.344 590 HD13 LEU 2 HD13 LEU 2 -0.552 -6.994 7.827 591 HD21 LEU 2 HD21 LEU 2 -3.443 -8.639 9.332 592 HD22 LEU 2 HD22 LEU 2 -4.206 -7.665 8.055 593 HD23 LEU 2 HD23 LEU 2 -4.062 -9.431 7.876 594 H ILE 3 H ILE 3 -5.448 -8.778 5.969 595 HA ILE 3 HA ILE 3 -6.065 -7.165 3.559 596 HB ILE 3 HB ILE 3 -7.719 -9.523 4.574 597 HG12 ILE 3 HG12 ILE 3 -7.548 -9.992 1.996 598 HG13 ILE 3 HG13 ILE 3 -6.101 -8.986 2.064 599 HG21 ILE 3 HG21 ILE 3 -8.291 -7.439 2.429 600 HG22 ILE 3 HG22 ILE 3 -9.273 -8.881 2.766 601 HG23 ILE 3 HG23 ILE 3 -9.154 -7.597 3.983 602 HD11 ILE 3 HD11 ILE 3 -6.632 -11.523 3.685 603 HD12 ILE 3 HD12 ILE 3 -5.583 -11.380 2.257 604 HD13 ILE 3 HD13 ILE 3 -5.132 -10.572 3.768 605 H LEU 4 H LEU 4 -7.215 -5.376 4.085 606 HA LEU 4 HA LEU 4 -8.970 -5.262 6.365 607 HB2 LEU 4 HB2 LEU 4 -7.599 -3.374 7.465 608 HB3 LEU 4 HB3 LEU 4 -7.170 -5.054 7.767 609 HG LEU 4 HG LEU 4 -5.370 -4.802 5.939 610 HD11 LEU 4 HD11 LEU 4 -5.897 -1.867 6.584 611 HD12 LEU 4 HD12 LEU 4 -4.500 -2.500 5.702 612 HD13 LEU 4 HD13 LEU 4 -6.134 -2.635 4.990 613 HD21 LEU 4 HD21 LEU 4 -5.146 -3.196 8.513 614 HD22 LEU 4 HD22 LEU 4 -4.978 -4.961 8.376 615 HD23 LEU 4 HD23 LEU 4 -3.807 -3.892 7.575 616 H THR 5 H THR 5 -9.819 -2.944 6.647 617 HA THR 5 HA THR 5 -10.056 -1.856 3.875 618 HB THR 5 HB THR 5 -12.242 -1.753 5.979 619 HG1 THR 5 HG1 THR 5 -11.746 -3.922 5.575 620 HG21 THR 5 HG21 THR 5 -12.494 -0.242 4.048 621 HG22 THR 5 HG22 THR 5 -12.243 -1.618 2.940 622 HG23 THR 5 HG23 THR 5 -13.677 -1.564 3.988 623 H ARG 6 H ARG 6 -10.425 0.354 3.620 624 HA ARG 6 HA ARG 6 -9.778 2.192 5.856 625 HB2 ARG 6 HB2 ARG 6 -7.682 1.314 4.599 626 HB3 ARG 6 HB3 ARG 6 -8.358 2.063 3.161 627 HG2 ARG 6 HG2 ARG 6 -6.786 3.586 3.897 628 HG3 ARG 6 HG3 ARG 6 -8.297 4.282 4.504 629 HD2 ARG 6 HD2 ARG 6 -6.452 2.480 6.137 630 HD3 ARG 6 HD3 ARG 6 -6.303 4.242 6.099 631 HE ARG 6 HE ARG 6 -8.986 3.557 6.764 632 HH11 ARG 6 HH11 ARG 6 -5.731 3.574 8.156 633 HH12 ARG 6 HH12 ARG 6 -6.320 3.730 9.796 634 HH21 ARG 6 HH21 ARG 6 -9.705 3.747 8.891 635 HH22 ARG 6 HH22 ARG 6 -8.565 3.792 10.216 636 H LYS 7 H LYS 7 -10.409 4.499 5.141 637 HA LYS 7 HA LYS 7 -11.789 4.513 2.497 638 HB2 LYS 7 HB2 LYS 7 -13.444 6.079 3.300 639 HB3 LYS 7 HB3 LYS 7 -13.611 4.525 4.108 640 HG2 LYS 7 HG2 LYS 7 -12.568 5.419 6.130 641 HG3 LYS 7 HG3 LYS 7 -12.179 6.949 5.293 642 HD2 LYS 7 HD2 LYS 7 -14.649 7.244 4.854 643 HD3 LYS 7 HD3 LYS 7 -14.956 5.849 5.896 644 HE2 LYS 7 HE2 LYS 7 -13.581 8.453 6.688 645 HE3 LYS 7 HE3 LYS 7 -15.228 7.980 7.106 646 HZ1 LYS 7 HZ1 LYS 7 -14.295 6.099 8.314 647 HZ2 LYS 7 HZ2 LYS 7 -12.766 6.621 7.988 648 HZ3 LYS 7 HZ3 LYS 7 -13.761 7.531 8.917 649 H VAL 8 H VAL 8 -12.185 6.826 1.764 650 HA VAL 8 HA VAL 8 -9.572 7.696 1.205 651 HB VAL 8 HB VAL 8 -10.519 9.489 -0.049 652 HG11 VAL 8 HG11 VAL 8 -12.395 7.076 -0.145 653 HG12 VAL 8 HG12 VAL 8 -12.080 8.225 -1.459 654 HG13 VAL 8 HG13 VAL 8 -10.782 7.154 -0.888 655 HG21 VAL 8 HG21 VAL 8 -12.179 10.401 1.502 656 HG22 VAL 8 HG22 VAL 8 -12.895 10.023 -0.072 657 HG23 VAL 8 HG23 VAL 8 -13.174 8.926 1.309 658 H GLY 9 H GLY 9 -8.198 9.142 1.937 659 HA2 GLY 9 HA2 GLY 9 -7.539 11.118 3.064 660 HA3 GLY 9 HA3 GLY 9 -9.069 11.122 3.957 661 H GLU 10 H GLU 10 -7.987 7.957 4.105 662 HA GLU 10 HA GLU 10 -6.673 8.446 6.738 663 HB2 GLU 10 HB2 GLU 10 -8.095 5.991 5.670 664 HB3 GLU 10 HB3 GLU 10 -7.406 6.180 7.299 665 HG2 GLU 10 HG2 GLU 10 -8.958 8.024 7.768 666 HG3 GLU 10 HG3 GLU 10 -9.628 7.909 6.136 667 H SER 11 H SER 11 -5.267 6.193 7.236 668 HA SER 11 HA SER 11 -3.442 5.814 4.924 669 HB2 SER 11 HB2 SER 11 -2.598 6.888 7.634 670 HB3 SER 11 HB3 SER 11 -1.509 6.495 6.288 671 HG SER 11 HG SER 11 -2.029 8.724 6.368 672 H ILE 12 H ILE 12 -1.659 4.342 5.419 673 HA ILE 12 HA ILE 12 -2.083 2.301 7.515 674 HB ILE 12 HB ILE 12 -1.824 1.755 4.523 675 HG12 ILE 12 HG12 ILE 12 -4.131 2.370 5.187 676 HG13 ILE 12 HG13 ILE 12 -3.980 0.722 4.590 677 HG21 ILE 12 HG21 ILE 12 -1.848 -0.195 6.865 678 HG22 ILE 12 HG22 ILE 12 -2.106 -0.665 5.177 679 HG23 ILE 12 HG23 ILE 12 -0.567 0.037 5.659 680 HD11 ILE 12 HD11 ILE 12 -4.218 1.541 7.514 681 HD12 ILE 12 HD12 ILE 12 -5.455 0.741 6.521 682 HD13 ILE 12 HD13 ILE 12 -3.975 -0.129 6.945 683 H ASN 13 H ASN 13 0.010 0.871 7.566 684 HA ASN 13 HA ASN 13 2.381 2.389 6.612 685 HB2 ASN 13 HB2 ASN 13 1.716 1.649 9.484 686 HB3 ASN 13 HB3 ASN 13 3.357 2.001 8.930 687 HD21 ASN 13 HD22 ASN 13 3.907 4.137 8.212 688 HD22 ASN 13 HD21 ASN 13 2.907 5.503 8.653 689 H ILE 14 H ILE 14 4.316 1.220 6.538 690 HA ILE 14 HA ILE 14 4.221 -1.694 7.051 691 HB ILE 14 HB ILE 14 5.138 -0.459 4.418 692 HG12 ILE 14 HG12 ILE 14 2.690 -2.169 5.054 693 HG13 ILE 14 HG13 ILE 14 2.673 -0.452 4.617 694 HG21 ILE 14 HG21 ILE 14 5.443 -2.806 3.709 695 HG22 ILE 14 HG22 ILE 14 6.441 -2.448 5.117 696 HG23 ILE 14 HG23 ILE 14 4.933 -3.365 5.321 697 HD11 ILE 14 HD11 ILE 14 3.542 -2.751 2.823 698 HD12 ILE 14 HD12 ILE 14 2.089 -1.746 2.672 699 HD13 ILE 14 HD13 ILE 14 3.691 -1.022 2.415 700 H GLY 15 H GLY 15 6.273 -2.577 7.486 701 HA2 GLY 15 HA2 GLY 15 8.385 -2.530 8.416 702 HA3 GLY 15 HA3 GLY 15 8.763 -1.313 7.180 703 H ASP 16 H ASP 16 9.987 0.051 8.404 704 HA ASP 16 HA ASP 16 8.518 1.593 10.483 705 HB2 ASP 16 HB2 ASP 16 11.436 0.731 10.519 706 HB3 ASP 16 HB3 ASP 16 10.694 1.848 11.676 707 H ASP 17 H ASP 17 9.387 1.691 7.450 708 HA ASP 17 HA ASP 17 10.195 4.541 7.498 709 HB2 ASP 17 HB2 ASP 17 11.613 2.390 5.877 710 HB3 ASP 17 HB3 ASP 17 11.911 4.128 5.784 711 H ILE 18 H ILE 18 7.811 2.514 6.598 712 HA ILE 18 HA ILE 18 7.438 3.988 4.041 713 HB ILE 18 HB ILE 18 6.659 1.083 4.492 714 HG12 ILE 18 HG12 ILE 18 8.362 0.940 2.437 715 HG13 ILE 18 HG13 ILE 18 9.090 2.340 3.224 716 HG21 ILE 18 HG21 ILE 18 5.137 2.241 3.001 717 HG22 ILE 18 HG22 ILE 18 6.507 2.928 2.079 718 HG23 ILE 18 HG23 ILE 18 6.188 1.189 2.043 719 HD11 ILE 18 HD11 ILE 18 9.331 1.009 5.329 720 HD12 ILE 18 HD12 ILE 18 8.495 -0.356 4.546 721 HD13 ILE 18 HD13 ILE 18 10.090 0.174 3.966 722 H THR 19 H THR 19 5.376 4.640 3.546 723 HA THR 19 HA THR 19 3.187 4.070 5.464 724 HB THR 19 HB THR 19 4.045 6.855 4.578 725 HG1 THR 19 HG1 THR 19 4.600 7.110 6.737 726 HG21 THR 19 HG21 THR 19 2.366 7.583 6.296 727 HG22 THR 19 HG22 THR 19 1.636 6.770 4.903 728 HG23 THR 19 HG23 THR 19 1.829 5.895 6.441 729 H ILE 20 H ILE 20 1.099 4.518 4.554 730 HA ILE 20 HA ILE 20 0.992 4.908 1.601 731 HB ILE 20 HB ILE 20 -0.443 2.779 3.236 732 HG12 ILE 20 HG12 ILE 20 1.933 2.221 2.793 733 HG13 ILE 20 HG13 ILE 20 0.789 1.113 2.025 734 HG21 ILE 20 HG21 ILE 20 -1.291 2.002 1.014 735 HG22 ILE 20 HG22 ILE 20 -1.904 3.596 1.482 736 HG23 ILE 20 HG23 ILE 20 -0.603 3.467 0.276 737 HD11 ILE 20 HD11 ILE 20 2.696 1.718 0.544 738 HD12 ILE 20 HD12 ILE 20 1.133 2.178 -0.146 739 HD13 ILE 20 HD13 ILE 20 2.186 3.413 0.584 740 H THR 21 H THR 21 -0.855 6.035 0.931 741 HA THR 21 HA THR 21 -2.839 6.802 3.014 742 HB THR 21 HB THR 21 -1.355 8.822 1.290 743 HG1 THR 21 HG1 THR 21 -0.439 9.443 3.271 744 HG21 THR 21 HG21 THR 21 -3.674 9.461 1.873 745 HG22 THR 21 HG22 THR 21 -3.336 9.134 3.587 746 HG23 THR 21 HG23 THR 21 -2.498 10.461 2.751 747 H ILE 22 H ILE 22 -4.818 6.478 2.176 748 HA ILE 22 HA ILE 22 -5.223 6.262 -0.712 749 HB ILE 22 HB ILE 22 -6.357 4.684 0.607 750 HG12 ILE 22 HG12 ILE 22 -8.741 5.089 0.253 751 HG13 ILE 22 HG13 ILE 22 -8.432 6.818 -0.023 752 HG21 ILE 22 HG21 ILE 22 -7.419 6.944 2.341 753 HG22 ILE 22 HG22 ILE 22 -7.934 5.246 2.417 754 HG23 ILE 22 HG23 ILE 22 -6.257 5.673 2.805 755 HD11 ILE 22 HD11 ILE 22 -7.374 4.540 -1.716 756 HD12 ILE 22 HD12 ILE 22 -8.712 5.654 -2.126 757 HD13 ILE 22 HD13 ILE 22 -7.062 6.286 -1.979 758 H LEU 23 H LEU 23 -5.059 8.188 -1.789 759 HA LEU 23 HA LEU 23 -5.788 10.669 -0.526 760 HB2 LEU 23 HB2 LEU 23 -5.425 10.187 -3.497 761 HB3 LEU 23 HB3 LEU 23 -5.329 11.712 -2.630 762 HG LEU 23 HG LEU 23 -3.313 9.476 -2.757 763 HD11 LEU 23 HD11 LEU 23 -3.254 12.512 -3.008 764 HD12 LEU 23 HD12 LEU 23 -1.830 11.455 -3.180 765 HD13 LEU 23 HD13 LEU 23 -3.170 11.345 -4.343 766 HD21 LEU 23 HD21 LEU 23 -1.983 10.651 -1.011 767 HD22 LEU 23 HD22 LEU 23 -3.415 11.631 -0.617 768 HD23 LEU 23 HD23 LEU 23 -3.438 9.867 -0.363 769 H GLY 24 H GLY 24 -7.525 8.386 -2.644 770 HA2 GLY 24 HA2 GLY 24 -10.068 9.016 -1.912 771 HA3 GLY 24 HA3 GLY 24 -9.753 10.270 -3.094 772 H VAL 25 H VAL 25 -11.706 9.046 -4.053 773 HA VAL 25 HA VAL 25 -10.645 6.980 -5.920 774 HB VAL 25 HB VAL 25 -12.588 5.624 -5.715 775 HG11 VAL 25 HG11 VAL 25 -11.822 6.409 -2.879 776 HG12 VAL 25 HG12 VAL 25 -12.514 4.864 -3.417 777 HG13 VAL 25 HG13 VAL 25 -10.875 5.334 -3.932 778 HG21 VAL 25 HG21 VAL 25 -14.314 7.306 -5.528 779 HG22 VAL 25 HG22 VAL 25 -14.460 6.166 -4.185 780 HG23 VAL 25 HG23 VAL 25 -13.744 7.769 -3.900 781 H SER 26 H SER 26 -11.983 6.668 -7.832 782 HA SER 26 HA SER 26 -13.879 8.780 -8.557 783 HB2 SER 26 HB2 SER 26 -11.719 9.804 -9.121 784 HB3 SER 26 HB3 SER 26 -11.266 8.369 -10.073 785 HG SER 26 HG SER 26 -12.977 8.818 -11.462 786 H GLY 27 H GLY 27 -15.428 7.105 -8.743 787 HA2 GLY 27 HA2 GLY 27 -16.616 5.581 -10.047 788 HA3 GLY 27 HA3 GLY 27 -15.283 5.588 -11.221 789 H GLN 28 H GLN 28 -13.847 3.876 -11.230 790 HA GLN 28 HA GLN 28 -13.886 2.066 -8.848 791 HB2 GLN 28 HB2 GLN 28 -13.111 1.439 -11.734 792 HB3 GLN 28 HB3 GLN 28 -12.966 0.337 -10.365 793 HG2 GLN 28 HG2 GLN 28 -15.597 1.514 -11.324 794 HG3 GLN 28 HG3 GLN 28 -14.954 -0.097 -11.735 795 HE21 GLN 28 HE22 GLN 28 -16.146 1.925 -9.017 796 HE22 GLN 28 HE21 GLN 28 -16.537 0.568 -7.980 797 H GLN 29 H GLN 29 -12.041 4.334 -10.746 798 HA GLN 29 HA GLN 29 -9.439 3.328 -10.048 799 HB2 GLN 29 HB2 GLN 29 -10.407 6.131 -10.783 800 HB3 GLN 29 HB3 GLN 29 -8.746 5.738 -10.389 801 HG2 GLN 29 HG2 GLN 29 -8.914 5.693 -12.770 802 HG3 GLN 29 HG3 GLN 29 -8.700 4.031 -12.215 803 HE21 GLN 29 HE22 GLN 29 -11.737 6.013 -12.237 804 HE22 GLN 29 HE21 GLN 29 -12.569 4.963 -13.369 805 H VAL 30 H VAL 30 -8.090 3.955 -8.407 806 HA VAL 30 HA VAL 30 -9.219 5.435 -6.094 807 HB VAL 30 HB VAL 30 -7.831 2.724 -6.047 808 HG11 VAL 30 HG11 VAL 30 -9.009 4.330 -3.757 809 HG12 VAL 30 HG12 VAL 30 -8.215 2.745 -3.651 810 HG13 VAL 30 HG13 VAL 30 -7.265 4.181 -4.107 811 HG21 VAL 30 HG21 VAL 30 -10.700 3.484 -5.384 812 HG22 VAL 30 HG22 VAL 30 -10.158 2.464 -6.738 813 HG23 VAL 30 HG23 VAL 30 -9.960 1.899 -5.070 814 H ARG 31 H ARG 31 -7.811 7.133 -5.941 815 HA ARG 31 HA ARG 31 -5.030 6.791 -6.843 816 HB2 ARG 31 HB2 ARG 31 -6.176 8.838 -7.492 817 HB3 ARG 31 HB3 ARG 31 -6.548 9.213 -5.795 818 HG2 ARG 31 HG2 ARG 31 -4.267 9.576 -5.245 819 HG3 ARG 31 HG3 ARG 31 -3.683 8.765 -6.704 820 HD2 ARG 31 HD2 ARG 31 -5.368 11.243 -6.974 821 HD3 ARG 31 HD3 ARG 31 -3.649 11.373 -6.557 822 HE ARG 31 HE ARG 31 -4.451 9.754 -8.919 823 HH11 ARG 31 HH11 ARG 31 -2.863 12.622 -7.621 824 HH12 ARG 31 HH12 ARG 31 -2.015 12.973 -9.116 825 HH21 ARG 31 HH21 ARG 31 -3.323 10.216 -10.846 826 HH22 ARG 31 HH22 ARG 31 -2.278 11.611 -10.932 827 H ILE 32 H ILE 32 -3.369 6.453 -5.567 828 HA ILE 32 HA ILE 32 -3.743 6.663 -2.618 829 HB ILE 32 HB ILE 32 -2.215 4.365 -3.811 830 HG12 ILE 32 HG12 ILE 32 -5.237 4.571 -3.676 831 HG13 ILE 32 HG13 ILE 32 -4.213 3.989 -4.976 832 HG21 ILE 32 HG21 ILE 32 -3.851 4.667 -1.261 833 HG22 ILE 32 HG22 ILE 32 -2.744 3.330 -1.674 834 HG23 ILE 32 HG23 ILE 32 -2.101 4.944 -1.385 835 HD11 ILE 32 HD11 ILE 32 -4.686 2.577 -2.315 836 HD12 ILE 32 HD12 ILE 32 -5.349 2.115 -3.887 837 HD13 ILE 32 HD13 ILE 32 -3.594 2.009 -3.606 838 H GLY 33 H GLY 33 -1.761 6.941 -1.453 839 HA2 GLY 33 HA2 GLY 33 0.539 7.839 -3.138 840 HA3 GLY 33 HA3 GLY 33 0.052 8.620 -1.620 841 H ILE 34 H ILE 34 2.614 7.568 -2.190 842 HA ILE 34 HA ILE 34 2.872 5.471 -0.104 843 HB ILE 34 HB ILE 34 4.234 5.381 -2.832 844 HG12 ILE 34 HG12 ILE 34 2.018 3.554 -1.815 845 HG13 ILE 34 HG13 ILE 34 1.791 4.858 -2.994 846 HG21 ILE 34 HG21 ILE 34 5.572 4.431 -1.000 847 HG22 ILE 34 HG22 ILE 34 4.196 3.433 -0.484 848 HG23 ILE 34 HG23 ILE 34 4.991 3.128 -2.041 849 HD11 ILE 34 HD11 ILE 34 2.013 2.799 -4.195 850 HD12 ILE 34 HD12 ILE 34 3.457 3.800 -4.487 851 HD13 ILE 34 HD13 ILE 34 3.535 2.405 -3.373 852 H ASN 35 H ASN 35 4.797 5.654 1.055 853 HA ASN 35 HA ASN 35 6.617 7.844 0.228 854 HB2 ASN 35 HB2 ASN 35 4.739 8.699 1.672 855 HB3 ASN 35 HB3 ASN 35 5.314 7.662 2.974 856 HD21 ASN 35 HD22 ASN 35 5.112 10.665 2.632 857 HD22 ASN 35 HD21 ASN 35 6.718 11.275 2.975 858 H ALA 36 H ALA 36 8.459 6.764 0.021 859 HA ALA 36 HA ALA 36 9.555 5.307 2.344 860 HB1 ALA 36 HB1 ALA 36 10.219 3.422 0.876 861 HB2 ALA 36 HB2 ALA 36 8.449 3.556 0.998 862 HB3 ALA 36 HB3 ALA 36 9.297 4.134 -0.460 863 HA PRO 37 HA PRO 37 13.286 7.239 0.959 864 HB2 PRO 37 HB2 PRO 37 15.137 5.292 1.650 865 HB3 PRO 37 HB3 PRO 37 14.363 6.417 2.827 866 HG2 PRO 37 HG2 PRO 37 13.650 3.555 2.176 867 HG3 PRO 37 HG3 PRO 37 13.740 4.346 3.779 868 HD2 PRO 37 HD2 PRO 37 11.383 3.963 2.474 869 HD3 PRO 37 HD3 PRO 37 11.673 5.434 3.452 870 H LYS 38 H LYS 38 14.953 7.093 -0.692 871 HA LYS 38 HA LYS 38 14.263 5.372 -2.922 872 HB2 LYS 38 HB2 LYS 38 16.594 7.275 -2.409 873 HB3 LYS 38 HB3 LYS 38 16.299 6.461 -3.962 874 HG2 LYS 38 HG2 LYS 38 14.232 8.233 -2.586 875 HG3 LYS 38 HG3 LYS 38 15.368 8.830 -3.801 876 HD2 LYS 38 HD2 LYS 38 13.605 6.421 -4.389 877 HD3 LYS 38 HD3 LYS 38 12.957 8.051 -4.473 878 HE2 LYS 38 HE2 LYS 38 15.438 7.086 -5.974 879 HE3 LYS 38 HE3 LYS 38 13.804 7.135 -6.662 880 HZ1 LYS 38 HZ1 LYS 38 15.286 9.481 -5.681 881 HZ2 LYS 38 HZ2 LYS 38 15.042 9.088 -7.255 882 HZ3 LYS 38 HZ3 LYS 38 13.766 9.490 -6.304 883 H ASP 39 H ASP 39 15.776 4.746 -0.107 884 HA ASP 39 HA ASP 39 17.822 2.869 -0.931 885 HB2 ASP 39 HB2 ASP 39 16.184 3.239 1.608 886 HB3 ASP 39 HB3 ASP 39 17.451 2.019 1.443 887 H VAL 40 H VAL 40 14.464 2.847 -1.308 888 HA VAL 40 HA VAL 40 14.458 -0.078 -1.786 889 HB VAL 40 HB VAL 40 12.259 -0.304 -0.751 890 HG11 VAL 40 HG11 VAL 40 14.153 1.100 1.171 891 HG12 VAL 40 HG12 VAL 40 12.859 -0.032 1.607 892 HG13 VAL 40 HG13 VAL 40 14.272 -0.622 0.705 893 HG21 VAL 40 HG21 VAL 40 11.490 2.056 -1.137 894 HG22 VAL 40 HG22 VAL 40 11.197 1.442 0.505 895 HG23 VAL 40 HG23 VAL 40 12.555 2.550 0.212 896 H ALA 41 H ALA 41 12.395 -0.641 -3.084 897 HA ALA 41 HA ALA 41 12.096 1.508 -5.127 898 HB1 ALA 41 HB1 ALA 41 11.943 -1.524 -5.425 899 HB2 ALA 41 HB2 ALA 41 11.775 -0.336 -6.729 900 HB3 ALA 41 HB3 ALA 41 13.329 -0.492 -5.884 901 H VAL 42 H VAL 42 10.062 1.656 -6.258 902 HA VAL 42 HA VAL 42 7.778 0.123 -5.323 903 HB VAL 42 HB VAL 42 7.588 1.636 -3.560 904 HG11 VAL 42 HG11 VAL 42 9.322 3.215 -4.030 905 HG12 VAL 42 HG12 VAL 42 8.470 3.825 -5.470 906 HG13 VAL 42 HG13 VAL 42 7.814 4.125 -3.837 907 HG21 VAL 42 HG21 VAL 42 6.013 2.959 -5.815 908 HG22 VAL 42 HG22 VAL 42 5.496 1.529 -4.876 909 HG23 VAL 42 HG23 VAL 42 5.702 3.110 -4.081 910 H HIS 43 H HIS 43 6.466 -0.195 -7.013 911 HA HIS 43 HA HIS 43 6.103 1.878 -9.044 912 HB2 HIS 43 HB2 HIS 43 6.986 -0.862 -10.010 913 HB3 HIS 43 HB3 HIS 43 6.878 0.649 -10.898 914 HD2 HIS 43 HD2 HIS 43 9.161 -1.219 -8.397 915 HE1 HIS 43 HE1 HIS 43 11.443 1.978 -10.024 916 HE2 HIS 43 HE2 HIS 43 11.526 -0.091 -8.561 917 H ARG 44 H ARG 44 4.495 1.050 -10.757 918 HA ARG 44 HA ARG 44 2.286 -0.338 -9.499 919 HB2 ARG 44 HB2 ARG 44 2.098 1.510 -11.151 920 HB3 ARG 44 HB3 ARG 44 2.846 0.480 -12.386 921 HG2 ARG 44 HG2 ARG 44 0.939 -1.017 -12.380 922 HG3 ARG 44 HG3 ARG 44 0.257 -0.222 -10.946 923 HD2 ARG 44 HD2 ARG 44 -0.895 0.518 -12.979 924 HD3 ARG 44 HD3 ARG 44 -0.048 1.866 -12.210 925 HE ARG 44 HE ARG 44 0.636 0.544 -14.773 926 HH11 ARG 44 HH11 ARG 44 1.491 2.998 -12.358 927 HH12 ARG 44 HH12 ARG 44 2.598 3.811 -13.442 928 HH21 ARG 44 HH21 ARG 44 2.003 1.668 -16.145 929 HH22 ARG 44 HH22 ARG 44 2.872 3.080 -15.587 930 H GLU 45 H GLU 45 1.407 -2.427 -10.396 931 HA GLU 45 HA GLU 45 3.428 -4.396 -10.425 932 HB2 GLU 45 HB2 GLU 45 0.979 -4.618 -9.832 933 HB3 GLU 45 HB3 GLU 45 0.606 -4.643 -11.556 934 HG2 GLU 45 HG2 GLU 45 2.459 -6.616 -10.138 935 HG3 GLU 45 HG3 GLU 45 0.732 -6.891 -10.385 936 H GLU 46 H GLU 46 2.151 -2.419 -12.993 937 HA GLU 46 HA GLU 46 2.888 -4.075 -15.214 938 HB2 GLU 46 HB2 GLU 46 1.221 -2.226 -15.240 939 HB3 GLU 46 HB3 GLU 46 2.523 -1.062 -14.947 940 HG2 GLU 46 HG2 GLU 46 3.572 -1.678 -17.096 941 HG3 GLU 46 HG3 GLU 46 2.344 -2.930 -17.350 942 H ILE 47 H ILE 47 4.610 -1.622 -13.264 943 HA ILE 47 HA ILE 47 6.876 -1.603 -15.167 944 HB ILE 47 HB ILE 47 6.080 0.000 -12.730 945 HG12 ILE 47 HG12 ILE 47 6.379 1.906 -14.224 946 HG13 ILE 47 HG13 ILE 47 6.996 0.847 -15.499 947 HG21 ILE 47 HG21 ILE 47 8.230 1.234 -12.927 948 HG22 ILE 47 HG22 ILE 47 8.496 -0.443 -12.430 949 HG23 ILE 47 HG23 ILE 47 8.798 0.042 -14.112 950 HD11 ILE 47 HD11 ILE 47 4.810 -0.191 -15.769 951 HD12 ILE 47 HD12 ILE 47 4.169 0.734 -14.377 952 HD13 ILE 47 HD13 ILE 47 4.648 1.565 -15.874 953 H TYR 48 H TYR 48 5.958 -2.931 -12.010 954 HA TYR 48 HA TYR 48 8.464 -3.412 -10.889 955 HB2 TYR 48 HB2 TYR 48 6.287 -3.752 -9.785 956 HB3 TYR 48 HB3 TYR 48 5.938 -5.103 -10.854 957 HD1 TYR 48 HD1 TYR 48 8.164 -3.936 -8.105 958 HD2 TYR 48 HD2 TYR 48 6.857 -7.308 -10.447 959 HE1 TYR 48 HE1 TYR 48 9.196 -5.465 -6.469 960 HE2 TYR 48 HE2 TYR 48 7.802 -8.843 -8.776 961 HH TYR 48 HH TYR 48 9.520 -7.673 -5.852 962 H GLN 49 H GLN 49 6.847 -5.057 -13.553 963 HA GLN 49 HA GLN 49 8.283 -7.499 -13.504 964 HB2 GLN 49 HB2 GLN 49 6.858 -5.974 -15.703 965 HB3 GLN 49 HB3 GLN 49 7.482 -7.634 -15.898 966 HG2 GLN 49 HG2 GLN 49 6.046 -8.480 -14.177 967 HG3 GLN 49 HG3 GLN 49 5.625 -6.871 -13.616 968 HE21 GLN 49 HE22 GLN 49 3.373 -7.531 -13.848 969 HE22 GLN 49 HE21 GLN 49 2.605 -7.484 -15.410 970 H ARG 50 H ARG 50 9.431 -4.329 -14.332 971 HA ARG 50 HA ARG 50 11.538 -5.326 -16.144 972 HB2 ARG 50 HB2 ARG 50 10.842 -2.629 -14.897 973 HB3 ARG 50 HB3 ARG 50 12.371 -2.915 -15.728 974 HG2 ARG 50 HG2 ARG 50 10.861 -1.898 -17.283 975 HG3 ARG 50 HG3 ARG 50 11.172 -3.563 -17.785 976 HD2 ARG 50 HD2 ARG 50 8.996 -4.263 -16.871 977 HD3 ARG 50 HD3 ARG 50 8.690 -2.606 -16.306 978 HE ARG 50 HE ARG 50 9.168 -2.207 -18.946 979 HH11 ARG 50 HH21 ARG 50 7.018 -4.465 -17.270 980 HH12 ARG 50 HH22 ARG 50 5.892 -4.554 -18.604 981 HH21 ARG 50 HH11 ARG 50 7.669 -2.329 -20.647 982 HH22 ARG 50 HH12 ARG 50 6.246 -3.336 -20.501 983 H ILE 51 H ILE 51 11.107 -4.164 -12.811 984 HA ILE 51 HA ILE 51 13.849 -4.278 -12.021 985 HB ILE 51 HB ILE 51 11.262 -4.444 -10.415 986 HG12 ILE 51 HG12 ILE 51 11.559 -2.149 -9.902 987 HG13 ILE 51 HG13 ILE 51 13.100 -2.035 -10.784 988 HG21 ILE 51 HG21 ILE 51 14.112 -3.838 -9.537 989 HG22 ILE 51 HG22 ILE 51 12.671 -3.610 -8.526 990 HG23 ILE 51 HG23 ILE 51 13.127 -5.238 -9.042 991 HD11 ILE 51 HD11 ILE 51 10.417 -2.628 -12.072 992 HD12 ILE 51 HD12 ILE 51 11.103 -0.991 -11.911 993 HD13 ILE 51 HD13 ILE 51 11.950 -2.187 -12.896 994 H GLN 52 H GLN 52 11.626 -6.691 -12.807 995 HA GLN 52 HA GLN 52 13.270 -8.687 -11.336 996 HB2 GLN 52 HB2 GLN 52 10.368 -9.005 -12.211 997 HB3 GLN 52 HB3 GLN 52 11.277 -10.130 -11.199 998 HG2 GLN 52 HG2 GLN 52 10.328 -7.346 -10.484 999 HG3 GLN 52 HG3 GLN 52 9.817 -8.887 -9.790 1000 HE21 GLN 52 HE22 GLN 52 10.953 -6.424 -8.540 1001 HE22 GLN 52 HE21 GLN 52 12.388 -6.921 -7.682 1002 H ALA 53 H ALA 53 12.975 -7.516 -14.429 1003 HA ALA 53 HA ALA 53 13.738 -10.164 -15.511 1004 HB1 ALA 53 HB1 ALA 53 11.607 -8.447 -16.817 1005 HB2 ALA 53 HB2 ALA 53 12.195 -10.028 -17.369 1006 HB3 ALA 53 HB3 ALA 53 11.285 -9.910 -15.848 1007 H GLY 54 H GLY 54 14.595 -6.953 -15.261 1008 HA2 GLY 54 HA2 GLY 54 16.598 -7.261 -17.342 1009 HA3 GLY 54 HA3 GLY 54 15.359 -6.065 -17.760 1010 H LEU 55 H LEU 55 15.169 -5.729 -14.660 1011 HA LEU 55 HA LEU 55 15.775 -4.292 -13.096 1012 HB2 LEU 55 HB2 LEU 55 18.620 -4.865 -13.990 1013 HB3 LEU 55 HB3 LEU 55 18.104 -4.224 -12.436 1014 HG LEU 55 HG LEU 55 18.410 -6.426 -11.878 1015 HD11 LEU 55 HD11 LEU 55 16.294 -7.508 -11.563 1016 HD12 LEU 55 HD12 LEU 55 16.114 -5.757 -11.320 1017 HD13 LEU 55 HD13 LEU 55 15.527 -6.525 -12.818 1018 HD21 LEU 55 HD21 LEU 55 17.982 -8.364 -13.218 1019 HD22 LEU 55 HD22 LEU 55 17.170 -7.413 -14.473 1020 HD23 LEU 55 HD23 LEU 55 18.917 -7.214 -14.190 1021 H THR 56 H THR 56 17.087 -2.266 -12.513 1022 HA THR 56 HA THR 56 17.290 -0.460 -14.855 1023 HB THR 56 HB THR 56 15.889 1.226 -13.667 1024 HG1 THR 56 HG1 THR 56 16.051 0.458 -11.578 1025 HG21 THR 56 HG21 THR 56 13.723 0.220 -14.142 1026 HG22 THR 56 HG22 THR 56 14.887 -0.270 -15.393 1027 HG23 THR 56 HG23 THR 56 14.426 -1.409 -14.108 1028 H ALA 57 H ALA 57 18.726 -1.677 -12.134 1029 HA ALA 57 HA ALA 57 20.600 0.567 -11.990 1030 HB1 ALA 57 HB1 ALA 57 19.014 -0.328 -9.552 1031 HB2 ALA 57 HB2 ALA 57 20.381 0.811 -9.541 1032 HB3 ALA 57 HB3 ALA 57 18.872 1.245 -10.374 1033 HA PRO 58 HA PRO 58 22.151 -3.929 -11.861 1034 HB2 PRO 58 HB2 PRO 58 24.158 -2.285 -13.424 1035 HB3 PRO 58 HB3 PRO 58 23.770 -4.017 -13.626 1036 HG2 PRO 58 HG2 PRO 58 22.672 -2.199 -15.288 1037 HG3 PRO 58 HG3 PRO 58 21.596 -3.444 -14.555 1038 HD2 PRO 58 HD2 PRO 58 21.959 -0.563 -13.734 1039 HD3 PRO 58 HD3 PRO 58 20.464 -1.542 -13.842 1040 H ASP 59 H ASP 59 23.712 -0.779 -11.290 1041 HA ASP 59 HA ASP 59 25.046 -1.744 -8.892 1042 HB2 ASP 59 HB2 ASP 59 26.444 -2.722 -10.695 1043 HB3 ASP 59 HB3 ASP 59 26.629 -1.140 -11.425 1044 H5' U 36 H5' U 36 -17.528 -4.785 10.118 1045 H5'' U 36 H5'' U 36 -17.329 -4.199 8.448 1046 H4' U 36 H4' U 36 -16.449 -6.960 9.400 1047 H3' U 36 H3' U 36 -15.211 -4.746 10.351 1048 H2' U 36 H2' U 36 -15.154 -3.572 8.297 1049 HO2' U 36 HO2' U 36 -12.994 -3.695 9.150 1050 H1' U 36 H1' U 36 -14.044 -6.019 6.932 1051 H3 U 36 H3 U 36 -14.841 -4.953 2.643 1052 H5 U 36 H5 U 36 -16.714 -1.851 4.761 1053 H6 U 36 H6 U 36 -16.238 -3.023 6.811 1054 HO5' U 36 HO5' U 36 -19.387 -5.192 8.834 1055 H5' C 37 H5' C 37 -14.589 -5.828 13.760 1056 H5'' C 37 H5'' C 37 -14.835 -4.731 12.385 1057 H4' C 37 H4' C 37 -12.269 -4.740 14.002 1058 H3' C 37 H3' C 37 -14.610 -4.115 15.258 1059 H2' C 37 H2' C 37 -15.445 -2.635 13.655 1060 HO2' C 37 HO2' C 37 -13.862 -1.070 15.417 1061 H1' C 37 H1' C 37 -12.779 -1.291 13.293 1062 H41 C 37 H41 C 37 -15.566 0.780 7.995 1063 H42 C 37 H42 C 37 -16.797 -0.469 8.055 1064 H5 C 37 H5 C 37 -16.796 -2.228 9.768 1065 H6 C 37 H6 C 37 -15.649 -3.049 11.748 1066 H5' A 38 H5' A 38 -11.770 -6.394 15.318 1067 H5'' A 38 H5'' A 38 -10.824 -6.535 16.812 1068 H4' A 38 H4' A 38 -9.515 -7.440 15.009 1069 H3' A 38 H3' A 38 -8.441 -5.559 16.686 1070 H2' A 38 H2' A 38 -9.101 -3.697 15.313 1071 HO2' A 38 HO2' A 38 -6.818 -3.566 15.692 1072 H1' A 38 H1' A 38 -8.014 -5.252 12.954 1073 H8 A 38 H8 A 38 -9.957 -2.260 14.173 1074 H61 A 38 H61 A 38 -10.994 -1.033 8.171 1075 H62 A 38 H62 A 38 -11.128 -0.410 9.810 1076 H2 A 38 H2 A 38 -9.454 -5.187 8.495 1077 H5' G 39 H5' G 39 -8.298 -8.438 13.437 1078 H5'' G 39 H5'' G 39 -8.188 -9.957 14.344 1079 H4' G 39 H4' G 39 -7.842 -10.732 12.208 1080 H3' G 39 H3' G 39 -5.617 -10.919 13.731 1081 H2' G 39 H2' G 39 -4.655 -8.815 13.184 1082 HO2' G 39 HO2' G 39 -3.721 -10.636 11.215 1083 H1' G 39 H1' G 39 -5.264 -8.983 10.273 1084 H8 G 39 H8 G 39 -7.543 -6.550 11.279 1085 H1 G 39 H1 G 39 -1.678 -4.050 12.056 1086 H21 G 39 H21 G 39 -0.177 -5.630 12.030 1087 H22 G 39 H22 G 39 -0.589 -7.324 11.844 1088 H5' G 40 H5' G 40 -4.459 -11.934 9.217 1089 H5'' G 40 H5'' G 40 -4.074 -13.657 9.342 1090 H4' G 40 H4' G 40 -2.728 -12.549 7.634 1091 H3' G 40 H3' G 40 -1.735 -14.312 9.590 1092 H2' G 40 H2' G 40 -0.746 -12.449 10.805 1093 HO2' G 40 HO2' G 40 0.886 -14.066 10.144 1094 H1' G 40 H1' G 40 -0.014 -11.426 8.044 1095 H8 G 40 H8 G 40 -1.157 -9.853 11.417 1096 H1 G 40 H1 G 40 4.538 -7.879 9.208 1097 H21 G 40 H21 G 40 5.046 -8.975 7.349 1098 H22 G 40 H22 G 40 3.952 -10.136 6.631 1099 H5' A 41 H5' A 41 -2.775 -15.317 5.050 1100 H5'' A 41 H5'' A 41 -3.024 -13.878 6.049 1101 H4' A 41 H4' A 41 -4.806 -16.331 6.316 1102 H3' A 41 H3' A 41 -4.835 -14.146 4.262 1103 H2' A 41 H2' A 41 -7.087 -13.655 4.638 1104 HO2' A 41 HO2' A 41 -7.762 -15.817 4.212 1105 H1' A 41 H1' A 41 -7.285 -14.738 7.287 1106 H8 A 41 H8 A 41 -5.436 -11.730 5.604 1107 H61 A 41 H61 A 41 -9.076 -8.306 9.317 1108 H62 A 41 H62 A 41 -7.874 -8.232 8.035 1109 H2 A 41 H2 A 41 -9.879 -12.569 10.149 1110 H5' C 42 H5' C 42 -6.090 -13.989 0.372 1111 H5'' C 42 H5'' C 42 -5.556 -13.315 1.920 1112 H4' C 42 H4' C 42 -7.750 -12.455 2.401 1113 H3' C 42 H3' C 42 -8.933 -14.541 1.226 1114 H2' C 42 H2' C 42 -7.919 -14.118 -0.952 1115 HO2' C 42 HO2' C 42 -9.728 -13.327 -2.236 1116 H1' C 42 H1' C 42 -8.940 -11.302 -0.599 1117 H41 C 42 H41 C 42 -5.933 -11.030 -6.262 1118 H42 C 42 H42 C 42 -4.399 -11.367 -5.486 1119 H5 C 42 H5 C 42 -4.215 -11.893 -3.096 1120 H6 C 42 H6 C 42 -5.479 -12.187 -1.041 1121 H5' A 43 H5' A 43 -10.739 -15.825 2.509 1122 H5'' A 43 H5'' A 43 -10.752 -15.027 0.924 1123 H4' A 43 H4' A 43 -13.384 -15.323 1.207 1124 H3' A 43 H3' A 43 -12.979 -16.970 3.232 1125 H2' A 43 H2' A 43 -10.936 -17.907 2.356 1126 HO2' A 43 HO2' A 43 -12.319 -19.643 3.000 1127 H1' A 43 H1' A 43 -12.155 -18.649 -0.267 1128 H8 A 43 H8 A 43 -10.024 -15.788 -0.807 1129 H61 A 43 H61 A 43 -5.095 -19.555 -1.086 1130 H62 A 43 H62 A 43 -5.682 -17.935 -1.415 1131 H2 A 43 H2 A 43 -8.476 -21.834 0.672 1132 H5' U 44 H5' U 44 -14.959 -14.138 1.136 1133 H5'' U 44 H5'' U 44 -16.527 -14.305 0.337 1134 H4' U 44 H4' U 44 -15.062 -12.888 -1.002 1135 H3' U 44 H3' U 44 -15.382 -15.634 -2.258 1136 HO3' U 44 HO3' U 44 -17.342 -14.478 -1.961 1137 H2' U 44 H2' U 44 -14.323 -14.625 -4.170 1138 HO2' U 44 HO2' U 44 -15.500 -12.589 -4.019 1139 H1' U 44 H1' U 44 -12.483 -13.222 -2.651 1140 H3 U 44 H3 U 44 -9.837 -16.213 -4.740 1141 H5 U 44 H5 U 44 -12.461 -18.650 -2.550 1142 H6 U 44 H6 U 44 -13.595 -16.664 -1.795 Start of MODEL 16 1 H1 MET 1 H1 MET 1 8.540 10.316 -1.172 2 H2 MET 1 H2 MET 1 8.576 10.841 -2.729 3 H3 MET 1 H3 MET 1 8.630 9.227 -2.403 4 HA MET 1 HA MET 1 6.415 9.276 -1.506 5 HB2 MET 1 HB2 MET 1 6.500 11.644 -0.735 6 HB3 MET 1 HB3 MET 1 6.549 12.182 -2.421 7 HG2 MET 1 HG2 MET 1 4.300 12.448 -1.611 8 HG3 MET 1 HG3 MET 1 4.314 11.156 -2.802 9 HE1 MET 1 HE1 MET 1 1.920 11.719 -0.999 10 HE2 MET 1 HE2 MET 1 2.004 10.364 -2.146 11 HE3 MET 1 HE3 MET 1 1.450 10.080 -0.473 12 H LEU 2 H LEU 2 4.835 8.476 -2.906 13 HA LEU 2 HA LEU 2 5.010 9.290 -5.751 14 HB2 LEU 2 HB2 LEU 2 5.635 6.664 -4.547 15 HB3 LEU 2 HB3 LEU 2 4.372 6.559 -5.785 16 HG LEU 2 HG LEU 2 7.138 7.731 -6.141 17 HD11 LEU 2 HD11 LEU 2 7.030 5.271 -5.943 18 HD12 LEU 2 HD12 LEU 2 5.824 5.215 -7.247 19 HD13 LEU 2 HD13 LEU 2 7.477 5.777 -7.591 20 HD21 LEU 2 HD21 LEU 2 5.547 8.905 -7.634 21 HD22 LEU 2 HD22 LEU 2 6.517 7.765 -8.571 22 HD23 LEU 2 HD23 LEU 2 4.845 7.349 -8.137 23 H ILE 3 H ILE 3 3.025 9.042 -6.879 24 HA ILE 3 HA ILE 3 0.650 8.200 -5.290 25 HB ILE 3 HB ILE 3 0.896 10.750 -6.945 26 HG12 ILE 3 HG12 ILE 3 -0.048 11.625 -4.634 27 HG13 ILE 3 HG13 ILE 3 0.705 10.160 -3.979 28 HG21 ILE 3 HG21 ILE 3 -1.493 9.533 -5.496 29 HG22 ILE 3 HG22 ILE 3 -1.436 11.147 -6.235 30 HG23 ILE 3 HG23 ILE 3 -1.311 9.712 -7.268 31 HD11 ILE 3 HD11 ILE 3 2.016 12.361 -5.614 32 HD12 ILE 3 HD12 ILE 3 2.211 12.107 -3.857 33 HD13 ILE 3 HD13 ILE 3 2.885 10.929 -4.988 34 H LEU 4 H LEU 4 -1.026 7.359 -6.581 35 HA LEU 4 HA LEU 4 -0.512 6.888 -9.460 36 HB2 LEU 4 HB2 LEU 4 -0.843 4.713 -7.357 37 HB3 LEU 4 HB3 LEU 4 -0.853 4.438 -9.101 38 HG LEU 4 HG LEU 4 1.531 5.512 -7.532 39 HD11 LEU 4 HD11 LEU 4 0.890 2.780 -8.705 40 HD12 LEU 4 HD12 LEU 4 2.426 3.239 -7.917 41 HD13 LEU 4 HD13 LEU 4 0.916 3.181 -6.975 42 HD21 LEU 4 HD21 LEU 4 1.548 6.208 -9.922 43 HD22 LEU 4 HD22 LEU 4 2.770 4.962 -9.621 44 HD23 LEU 4 HD23 LEU 4 1.238 4.528 -10.414 45 H THR 5 H THR 5 -2.408 5.686 -10.445 46 HA THR 5 HA THR 5 -4.830 5.780 -8.748 47 HB THR 5 HB THR 5 -5.086 6.527 -11.656 48 HG1 THR 5 HG1 THR 5 -4.486 8.249 -9.478 49 HG21 THR 5 HG21 THR 5 -7.102 7.596 -10.789 50 HG22 THR 5 HG22 THR 5 -7.032 5.889 -10.282 51 HG23 THR 5 HG23 THR 5 -6.620 7.174 -9.120 52 H ARG 6 H ARG 6 -4.959 3.689 -8.403 53 HA ARG 6 HA ARG 6 -4.812 1.738 -10.642 54 HB2 ARG 6 HB2 ARG 6 -3.439 1.584 -8.462 55 HB3 ARG 6 HB3 ARG 6 -4.970 1.397 -7.617 56 HG2 ARG 6 HG2 ARG 6 -4.233 -0.760 -7.790 57 HG3 ARG 6 HG3 ARG 6 -5.330 -0.679 -9.178 58 HD2 ARG 6 HD2 ARG 6 -2.319 -0.206 -9.325 59 HD3 ARG 6 HD3 ARG 6 -3.068 -1.796 -9.531 60 HE ARG 6 HE ARG 6 -4.194 0.196 -11.312 61 HH11 ARG 6 HH11 ARG 6 -1.467 -2.016 -10.833 62 HH12 ARG 6 HH12 ARG 6 -1.192 -2.216 -12.548 63 HH21 ARG 6 HH21 ARG 6 -3.777 -0.080 -13.551 64 HH22 ARG 6 HH22 ARG 6 -2.481 -1.131 -14.070 65 H LYS 7 H LYS 7 -6.623 0.030 -10.647 66 HA LYS 7 HA LYS 7 -9.030 0.939 -9.144 67 HB2 LYS 7 HB2 LYS 7 -10.476 0.202 -10.980 68 HB3 LYS 7 HB3 LYS 7 -9.531 1.618 -11.409 69 HG2 LYS 7 HG2 LYS 7 -8.043 0.286 -12.790 70 HG3 LYS 7 HG3 LYS 7 -8.732 -1.230 -12.152 71 HD2 LYS 7 HD2 LYS 7 -9.725 -0.792 -14.347 72 HD3 LYS 7 HD3 LYS 7 -10.950 -0.606 -13.088 73 HE2 LYS 7 HE2 LYS 7 -11.161 1.188 -14.693 74 HE3 LYS 7 HE3 LYS 7 -10.649 1.834 -13.129 75 HZ1 LYS 7 HZ1 LYS 7 -8.879 1.318 -15.430 76 HZ2 LYS 7 HZ2 LYS 7 -9.410 2.791 -14.938 77 HZ3 LYS 7 HZ3 LYS 7 -8.397 1.931 -13.980 78 H VAL 8 H VAL 8 -10.753 -0.823 -9.139 79 HA VAL 8 HA VAL 8 -9.620 -2.719 -7.420 80 HB VAL 8 HB VAL 8 -11.782 -3.652 -7.184 81 HG11 VAL 8 HG11 VAL 8 -13.070 -1.605 -6.707 82 HG12 VAL 8 HG12 VAL 8 -11.353 -1.347 -6.302 83 HG13 VAL 8 HG13 VAL 8 -12.032 -0.665 -7.791 84 HG21 VAL 8 HG21 VAL 8 -12.524 -3.929 -9.499 85 HG22 VAL 8 HG22 VAL 8 -13.696 -3.012 -8.542 86 HG23 VAL 8 HG23 VAL 8 -12.634 -2.157 -9.694 87 H GLY 9 H GLY 9 -8.827 -4.649 -7.529 88 HA2 GLY 9 HA2 GLY 9 -8.729 -6.874 -8.364 89 HA3 GLY 9 HA3 GLY 9 -9.273 -6.309 -9.951 90 H GLU 10 H GLU 10 -7.002 -4.047 -9.071 91 HA GLU 10 HA GLU 10 -4.845 -5.533 -10.503 92 HB2 GLU 10 HB2 GLU 10 -5.343 -2.562 -10.160 93 HB3 GLU 10 HB3 GLU 10 -3.993 -3.293 -11.058 94 HG2 GLU 10 HG2 GLU 10 -6.953 -3.604 -11.711 95 HG3 GLU 10 HG3 GLU 10 -5.797 -2.574 -12.561 96 H SER 11 H SER 11 -2.582 -4.276 -9.889 97 HA SER 11 HA SER 11 -2.347 -4.329 -6.926 98 HB2 SER 11 HB2 SER 11 -0.750 -6.098 -8.810 99 HB3 SER 11 HB3 SER 11 -0.551 -5.982 -7.052 100 HG SER 11 HG SER 11 -1.859 -7.754 -7.654 101 H ILE 12 H ILE 12 -0.114 -3.875 -6.212 102 HA ILE 12 HA ILE 12 1.590 -2.214 -7.965 103 HB ILE 12 HB ILE 12 0.410 -1.394 -5.276 104 HG12 ILE 12 HG12 ILE 12 -1.134 -0.971 -7.144 105 HG13 ILE 12 HG13 ILE 12 -0.528 0.520 -6.426 106 HG21 ILE 12 HG21 ILE 12 2.576 -0.031 -6.933 107 HG22 ILE 12 HG22 ILE 12 1.691 0.750 -5.615 108 HG23 ILE 12 HG23 ILE 12 2.703 -0.651 -5.271 109 HD11 ILE 12 HD11 ILE 12 0.425 -0.728 -9.033 110 HD12 ILE 12 HD12 ILE 12 -0.539 0.751 -8.842 111 HD13 ILE 12 HD13 ILE 12 1.143 0.711 -8.279 112 H ASN 13 H ASN 13 3.785 -1.903 -6.778 113 HA ASN 13 HA ASN 13 4.301 -4.144 -4.882 114 HB2 ASN 13 HB2 ASN 13 5.722 -3.617 -7.516 115 HB3 ASN 13 HB3 ASN 13 6.345 -4.673 -6.245 116 HD21 ASN 13 HD22 ASN 13 5.792 -6.782 -6.290 117 HD22 ASN 13 HD21 ASN 13 4.453 -7.445 -7.207 118 H ILE 14 H ILE 14 6.198 -3.981 -3.664 119 HA ILE 14 HA ILE 14 7.727 -1.450 -3.791 120 HB ILE 14 HB ILE 14 6.492 -2.541 -1.233 121 HG12 ILE 14 HG12 ILE 14 5.758 -0.073 -2.874 122 HG13 ILE 14 HG13 ILE 14 4.760 -1.524 -2.668 123 HG21 ILE 14 HG21 ILE 14 8.692 -1.411 -0.931 124 HG22 ILE 14 HG22 ILE 14 8.057 0.022 -1.768 125 HG23 ILE 14 HG23 ILE 14 7.381 -0.490 -0.205 126 HD11 ILE 14 HD11 ILE 14 5.526 0.456 -0.492 127 HD12 ILE 14 HD12 ILE 14 3.922 0.185 -1.198 128 HD13 ILE 14 HD13 ILE 14 4.679 -1.081 -0.206 129 H GLY 15 H GLY 15 9.838 -1.651 -2.939 130 HA2 GLY 15 HA2 GLY 15 11.833 -2.748 -2.613 131 HA3 GLY 15 HA3 GLY 15 10.928 -3.776 -1.495 132 H ASP 16 H ASP 16 11.770 -5.752 -1.985 133 HA ASP 16 HA ASP 16 11.176 -6.813 -4.702 134 HB2 ASP 16 HB2 ASP 16 13.644 -7.304 -2.994 135 HB3 ASP 16 HB3 ASP 16 13.216 -8.244 -4.431 136 H ASP 17 H ASP 17 10.064 -6.785 -1.737 137 HA ASP 17 HA ASP 17 9.360 -9.661 -1.706 138 HB2 ASP 17 HB2 ASP 17 10.497 -8.153 0.681 139 HB3 ASP 17 HB3 ASP 17 9.827 -9.786 0.719 140 H ILE 18 H ILE 18 8.108 -6.662 -1.970 141 HA ILE 18 HA ILE 18 5.810 -7.377 -0.216 142 HB ILE 18 HB ILE 18 6.878 -4.562 -0.637 143 HG12 ILE 18 HG12 ILE 18 7.068 -4.886 2.012 144 HG13 ILE 18 HG13 ILE 18 7.324 -6.574 1.561 145 HG21 ILE 18 HG21 ILE 18 5.214 -4.020 1.140 146 HG22 ILE 18 HG22 ILE 18 4.452 -4.623 -0.337 147 HG23 ILE 18 HG23 ILE 18 4.622 -5.699 1.068 148 HD11 ILE 18 HD11 ILE 18 8.877 -4.168 0.500 149 HD12 ILE 18 HD12 ILE 18 9.456 -5.284 1.753 150 HD13 ILE 18 HD13 ILE 18 9.215 -5.869 0.094 151 H THR 19 H THR 19 3.787 -6.953 -0.990 152 HA THR 19 HA THR 19 3.486 -5.671 -3.640 153 HB THR 19 HB THR 19 2.315 -8.389 -2.919 154 HG1 THR 19 HG1 THR 19 4.430 -7.698 -4.673 155 HG21 THR 19 HG21 THR 19 2.293 -6.787 -5.510 156 HG22 THR 19 HG22 THR 19 1.759 -8.478 -5.341 157 HG23 THR 19 HG23 THR 19 0.887 -7.190 -4.497 158 H ILE 20 H ILE 20 1.294 -4.986 -4.014 159 HA ILE 20 HA ILE 20 -0.475 -4.857 -1.620 160 HB ILE 20 HB ILE 20 0.346 -2.570 -3.450 161 HG12 ILE 20 HG12 ILE 20 2.079 -3.136 -1.774 162 HG13 ILE 20 HG13 ILE 20 1.382 -1.528 -1.556 163 HG21 ILE 20 HG21 ILE 20 -1.628 -2.659 -1.131 164 HG22 ILE 20 HG22 ILE 20 -1.032 -1.169 -1.899 165 HG23 ILE 20 HG23 ILE 20 -1.988 -2.326 -2.840 166 HD11 ILE 20 HD11 ILE 20 0.554 -3.987 0.051 167 HD12 ILE 20 HD12 ILE 20 1.695 -2.740 0.597 168 HD13 ILE 20 HD13 ILE 20 0.001 -2.313 0.301 169 H THR 21 H THR 21 -2.710 -4.761 -2.172 170 HA THR 21 HA THR 21 -3.359 -4.953 -5.066 171 HB THR 21 HB THR 21 -4.344 -6.947 -2.991 172 HG1 THR 21 HG1 THR 21 -2.917 -8.377 -4.022 173 HG21 THR 21 HG21 THR 21 -5.064 -8.220 -4.989 174 HG22 THR 21 HG22 THR 21 -5.831 -6.617 -4.961 175 HG23 THR 21 HG23 THR 21 -4.456 -6.926 -6.039 176 H ILE 22 H ILE 22 -5.438 -4.234 -5.570 177 HA ILE 22 HA ILE 22 -6.945 -2.990 -3.336 178 HB ILE 22 HB ILE 22 -6.215 -1.321 -4.800 179 HG12 ILE 22 HG12 ILE 22 -8.209 -0.374 -5.777 180 HG13 ILE 22 HG13 ILE 22 -9.013 -1.959 -5.802 181 HG21 ILE 22 HG21 ILE 22 -5.469 -2.608 -6.703 182 HG22 ILE 22 HG22 ILE 22 -7.149 -3.027 -7.134 183 HG23 ILE 22 HG23 ILE 22 -6.582 -1.341 -7.241 184 HD11 ILE 22 HD11 ILE 22 -9.796 -0.569 -3.939 185 HD12 ILE 22 HD12 ILE 22 -9.022 -2.066 -3.391 186 HD13 ILE 22 HD13 ILE 22 -8.135 -0.512 -3.281 187 H LEU 23 H LEU 23 -8.240 -4.611 -2.614 188 HA LEU 23 HA LEU 23 -9.264 -6.638 -4.345 189 HB2 LEU 23 HB2 LEU 23 -10.321 -5.908 -1.601 190 HB3 LEU 23 HB3 LEU 23 -10.420 -7.467 -2.429 191 HG LEU 23 HG LEU 23 -7.957 -6.154 -1.213 192 HD11 LEU 23 HD11 LEU 23 -9.453 -8.763 -0.733 193 HD12 LEU 23 HD12 LEU 23 -7.944 -8.302 0.080 194 HD13 LEU 23 HD13 LEU 23 -9.427 -7.345 0.335 195 HD21 LEU 23 HD21 LEU 23 -6.701 -8.152 -1.895 196 HD22 LEU 23 HD22 LEU 23 -8.089 -8.720 -2.849 197 HD23 LEU 23 HD23 LEU 23 -7.233 -7.227 -3.316 198 H GLY 24 H GLY 24 -10.584 -3.500 -3.307 199 HA2 GLY 24 HA2 GLY 24 -12.326 -3.126 -5.359 200 HA3 GLY 24 HA3 GLY 24 -13.281 -4.142 -4.312 201 H VAL 25 H VAL 25 -14.605 -2.005 -4.508 202 HA VAL 25 HA VAL 25 -13.940 -0.335 -2.142 203 HB VAL 25 HB VAL 25 -14.481 1.698 -3.246 204 HG11 VAL 25 HG11 VAL 25 -12.174 0.859 -3.626 205 HG12 VAL 25 HG12 VAL 25 -12.710 0.145 -5.165 206 HG13 VAL 25 HG13 VAL 25 -12.755 1.905 -4.943 207 HG21 VAL 25 HG21 VAL 25 -16.322 0.991 -4.656 208 HG22 VAL 25 HG22 VAL 25 -15.120 1.828 -5.633 209 HG23 VAL 25 HG23 VAL 25 -15.216 0.047 -5.687 210 H SER 26 H SER 26 -15.780 0.879 -1.318 211 HA SER 26 HA SER 26 -18.471 0.121 -2.202 212 HB2 SER 26 HB2 SER 26 -17.858 -1.717 -0.674 213 HB3 SER 26 HB3 SER 26 -17.464 -0.542 0.595 214 HG SER 26 HG SER 26 -19.626 0.130 0.561 215 H GLY 27 H GLY 27 -18.669 2.365 -2.682 216 HA2 GLY 27 HA2 GLY 27 -19.420 4.491 -2.111 217 HA3 GLY 27 HA3 GLY 27 -19.374 4.005 -0.397 218 H GLN 28 H GLN 28 -17.667 4.712 0.875 219 HA GLN 28 HA GLN 28 -15.374 6.019 -0.533 220 HB2 GLN 28 HB2 GLN 28 -16.298 6.228 2.370 221 HB3 GLN 28 HB3 GLN 28 -14.896 7.047 1.679 222 HG2 GLN 28 HG2 GLN 28 -17.777 7.520 0.864 223 HG3 GLN 28 HG3 GLN 28 -16.768 8.542 1.923 224 HE21 GLN 28 HE22 GLN 28 -16.975 7.240 -1.442 225 HE22 GLN 28 HE21 GLN 28 -16.099 8.561 -2.180 226 H GLN 29 H GLN 29 -16.402 3.259 1.329 227 HA GLN 29 HA GLN 29 -13.845 2.687 2.499 228 HB2 GLN 29 HB2 GLN 29 -16.197 0.869 1.820 229 HB3 GLN 29 HB3 GLN 29 -14.764 0.371 2.715 230 HG2 GLN 29 HG2 GLN 29 -16.568 2.670 3.582 231 HG3 GLN 29 HG3 GLN 29 -16.725 1.011 4.172 232 HE21 GLN 29 HE22 GLN 29 -15.952 3.644 5.509 233 HE22 GLN 29 HE21 GLN 29 -14.474 3.262 6.368 234 H VAL 30 H VAL 30 -12.290 1.254 1.803 235 HA VAL 30 HA VAL 30 -12.320 0.315 -1.008 236 HB VAL 30 HB VAL 30 -10.098 1.951 0.323 237 HG11 VAL 30 HG11 VAL 30 -10.313 0.913 -2.528 238 HG12 VAL 30 HG12 VAL 30 -8.955 1.804 -1.803 239 HG13 VAL 30 HG13 VAL 30 -9.326 0.155 -1.257 240 HG21 VAL 30 HG21 VAL 30 -10.564 3.594 -1.495 241 HG22 VAL 30 HG22 VAL 30 -11.985 2.637 -1.969 242 HG23 VAL 30 HG23 VAL 30 -11.928 3.428 -0.376 243 H ARG 31 H ARG 31 -12.046 -1.847 -0.764 244 HA ARG 31 HA ARG 31 -10.703 -2.849 1.642 245 HB2 ARG 31 HB2 ARG 31 -12.837 -3.825 0.531 246 HB3 ARG 31 HB3 ARG 31 -11.736 -4.531 -0.666 247 HG2 ARG 31 HG2 ARG 31 -10.475 -5.637 1.202 248 HG3 ARG 31 HG3 ARG 31 -11.571 -4.862 2.361 249 HD2 ARG 31 HD2 ARG 31 -13.478 -6.024 1.104 250 HD3 ARG 31 HD3 ARG 31 -12.224 -7.021 0.340 251 HE ARG 31 HE ARG 31 -12.864 -6.872 3.265 252 HH11 ARG 31 HH11 ARG 31 -11.420 -8.666 0.578 253 HH12 ARG 31 HH12 ARG 31 -11.056 -10.059 1.579 254 HH21 ARG 31 HH21 ARG 31 -12.422 -8.666 4.497 255 HH22 ARG 31 HH22 ARG 31 -11.597 -10.044 3.813 256 H ILE 32 H ILE 32 -8.626 -3.547 1.710 257 HA ILE 32 HA ILE 32 -7.088 -3.555 -0.849 258 HB ILE 32 HB ILE 32 -6.090 -2.190 1.665 259 HG12 ILE 32 HG12 ILE 32 -7.750 -0.969 -0.558 260 HG13 ILE 32 HG13 ILE 32 -8.095 -0.998 1.184 261 HG21 ILE 32 HG21 ILE 32 -4.566 -1.083 0.103 262 HG22 ILE 32 HG22 ILE 32 -4.447 -2.830 -0.105 263 HG23 ILE 32 HG23 ILE 32 -5.369 -1.867 -1.279 264 HD11 ILE 32 HD11 ILE 32 -5.880 0.567 -0.194 265 HD12 ILE 32 HD12 ILE 32 -7.322 1.208 0.609 266 HD13 ILE 32 HD13 ILE 32 -6.067 0.410 1.574 267 H GLY 33 H GLY 33 -5.066 -4.696 -0.723 268 HA2 GLY 33 HA2 GLY 33 -4.815 -6.509 1.635 269 HA3 GLY 33 HA3 GLY 33 -4.702 -7.108 -0.028 270 H ILE 34 H ILE 34 -2.703 -7.336 1.964 271 HA ILE 34 HA ILE 34 -0.445 -5.868 0.705 272 HB ILE 34 HB ILE 34 -0.910 -6.146 3.708 273 HG12 ILE 34 HG12 ILE 34 -1.040 -3.605 2.028 274 HG13 ILE 34 HG13 ILE 34 -2.449 -4.476 2.660 275 HG21 ILE 34 HG21 ILE 34 1.464 -6.201 3.058 276 HG22 ILE 34 HG22 ILE 34 1.260 -4.693 2.134 277 HG23 ILE 34 HG23 ILE 34 1.092 -4.694 3.900 278 HD11 ILE 34 HD11 ILE 34 -0.267 -3.171 4.330 279 HD12 ILE 34 HD12 ILE 34 -1.952 -2.655 4.170 280 HD13 ILE 34 HD13 ILE 34 -1.582 -4.195 4.973 281 H ASN 35 H ASN 35 1.438 -7.089 0.652 282 HA ASN 35 HA ASN 35 1.322 -9.767 1.900 283 HB2 ASN 35 HB2 ASN 35 0.317 -9.794 -0.411 284 HB3 ASN 35 HB3 ASN 35 1.876 -9.284 -1.047 285 HD21 ASN 35 HD22 ASN 35 0.430 -11.725 -1.668 286 HD22 ASN 35 HD21 ASN 35 1.414 -13.070 -1.133 287 H ALA 36 H ALA 36 3.027 -9.626 3.190 288 HA ALA 36 HA ALA 36 5.702 -9.192 2.005 289 HB1 ALA 36 HB1 ALA 36 5.048 -6.958 2.808 290 HB2 ALA 36 HB2 ALA 36 4.591 -7.642 4.385 291 HB3 ALA 36 HB3 ALA 36 6.292 -7.654 3.874 292 HA PRO 37 HA PRO 37 6.759 -12.424 4.848 293 HB2 PRO 37 HB2 PRO 37 9.316 -11.661 5.572 294 HB3 PRO 37 HB3 PRO 37 8.906 -12.412 3.986 295 HG2 PRO 37 HG2 PRO 37 9.271 -9.479 4.666 296 HG3 PRO 37 HG3 PRO 37 9.934 -10.389 3.265 297 HD2 PRO 37 HD2 PRO 37 7.700 -8.884 3.033 298 HD3 PRO 37 HD3 PRO 37 7.829 -10.485 2.224 299 H LYS 38 H LYS 38 7.135 -12.837 7.131 300 HA LYS 38 HA LYS 38 6.230 -10.725 8.893 301 HB2 LYS 38 HB2 LYS 38 7.416 -13.491 9.418 302 HB3 LYS 38 HB3 LYS 38 6.708 -12.454 10.676 303 HG2 LYS 38 HG2 LYS 38 5.172 -13.290 8.173 304 HG3 LYS 38 HG3 LYS 38 5.150 -14.232 9.675 305 HD2 LYS 38 HD2 LYS 38 4.520 -11.274 9.766 306 HD3 LYS 38 HD3 LYS 38 3.322 -12.422 9.139 307 HE2 LYS 38 HE2 LYS 38 3.525 -13.764 11.211 308 HE3 LYS 38 HE3 LYS 38 4.691 -12.598 11.862 309 HZ1 LYS 38 HZ1 LYS 38 2.975 -10.926 11.757 310 HZ2 LYS 38 HZ2 LYS 38 1.906 -12.012 11.122 311 HZ3 LYS 38 HZ3 LYS 38 2.463 -12.200 12.659 312 H ASP 39 H ASP 39 9.041 -11.216 7.344 313 HA ASP 39 HA ASP 39 11.050 -10.443 9.214 314 HB2 ASP 39 HB2 ASP 39 11.214 -11.400 6.815 315 HB3 ASP 39 HB3 ASP 39 10.945 -9.751 6.256 316 H VAL 40 H VAL 40 8.362 -8.765 7.946 317 HA VAL 40 HA VAL 40 9.449 -6.156 8.838 318 HB VAL 40 HB VAL 40 8.490 -5.024 6.924 319 HG11 VAL 40 HG11 VAL 40 9.942 -5.840 5.141 320 HG12 VAL 40 HG12 VAL 40 10.800 -5.933 6.696 321 HG13 VAL 40 HG13 VAL 40 10.126 -7.408 5.959 322 HG21 VAL 40 HG21 VAL 40 6.576 -6.566 6.530 323 HG22 VAL 40 HG22 VAL 40 7.476 -6.150 5.057 324 HG23 VAL 40 HG23 VAL 40 7.718 -7.739 5.807 325 H ALA 41 H ALA 41 7.541 -4.557 9.072 326 HA ALA 41 HA ALA 41 5.326 -6.094 10.345 327 HB1 ALA 41 HB1 ALA 41 6.532 -3.399 11.085 328 HB2 ALA 41 HB2 ALA 41 5.181 -4.201 11.917 329 HB3 ALA 41 HB3 ALA 41 6.800 -4.937 11.932 330 H VAL 42 H VAL 42 3.196 -5.094 10.325 331 HA VAL 42 HA VAL 42 2.745 -2.787 8.598 332 HB VAL 42 HB VAL 42 2.769 -4.249 6.786 333 HG11 VAL 42 HG11 VAL 42 1.737 -6.521 6.791 334 HG12 VAL 42 HG12 VAL 42 3.137 -6.341 7.862 335 HG13 VAL 42 HG13 VAL 42 1.491 -6.349 8.553 336 HG21 VAL 42 HG21 VAL 42 0.584 -3.080 6.875 337 HG22 VAL 42 HG22 VAL 42 0.475 -4.674 6.088 338 HG23 VAL 42 HG23 VAL 42 -0.112 -4.479 7.740 339 H HIS 43 H HIS 43 1.179 -1.630 9.479 340 HA HIS 43 HA HIS 43 -1.126 -2.926 10.739 341 HB2 HIS 43 HB2 HIS 43 0.364 -0.888 12.401 342 HB3 HIS 43 HB3 HIS 43 -0.862 -2.053 12.890 343 HD2 HIS 43 HD2 HIS 43 2.911 -1.808 12.114 344 HE1 HIS 43 HE1 HIS 43 2.304 -5.420 14.269 345 HE2 HIS 43 HE2 HIS 43 4.052 -3.845 13.312 346 H ARG 44 H ARG 44 -2.689 -1.126 11.582 347 HA ARG 44 HA ARG 44 -3.002 0.876 9.532 348 HB2 ARG 44 HB2 ARG 44 -4.882 -0.207 10.741 349 HB3 ARG 44 HB3 ARG 44 -4.335 0.532 12.254 350 HG2 ARG 44 HG2 ARG 44 -4.792 2.777 11.361 351 HG3 ARG 44 HG3 ARG 44 -5.224 2.079 9.783 352 HD2 ARG 44 HD2 ARG 44 -7.077 0.839 10.845 353 HD3 ARG 44 HD3 ARG 44 -6.649 1.530 12.422 354 HE ARG 44 HE ARG 44 -6.991 3.739 10.798 355 HH11 ARG 44 HH11 ARG 44 -9.018 0.958 11.638 356 HH12 ARG 44 HH12 ARG 44 -10.506 1.844 11.452 357 HH21 ARG 44 HH21 ARG 44 -8.957 4.866 10.558 358 HH22 ARG 44 HH22 ARG 44 -10.478 4.048 10.821 359 H GLU 45 H GLU 45 -2.964 3.253 9.958 360 HA GLU 45 HA GLU 45 -0.484 3.987 11.065 361 HB2 GLU 45 HB2 GLU 45 -1.837 5.192 9.335 362 HB3 GLU 45 HB3 GLU 45 -2.925 5.765 10.597 363 HG2 GLU 45 HG2 GLU 45 0.083 6.308 10.469 364 HG3 GLU 45 HG3 GLU 45 -1.154 7.405 9.843 365 H GLU 46 H GLU 46 -3.656 3.646 12.559 366 HA GLU 46 HA GLU 46 -3.194 5.065 14.987 367 HB2 GLU 46 HB2 GLU 46 -5.411 4.219 14.220 368 HB3 GLU 46 HB3 GLU 46 -4.817 2.559 14.372 369 HG2 GLU 46 HG2 GLU 46 -6.212 3.202 16.304 370 HG3 GLU 46 HG3 GLU 46 -4.556 2.839 16.798 371 H ILE 47 H ILE 47 -2.685 1.621 14.070 372 HA ILE 47 HA ILE 47 -1.821 0.894 16.733 373 HB ILE 47 HB ILE 47 -1.534 -0.615 14.123 374 HG12 ILE 47 HG12 ILE 47 -3.841 -0.036 14.203 375 HG13 ILE 47 HG13 ILE 47 -3.709 -1.718 14.722 376 HG21 ILE 47 HG21 ILE 47 -1.713 -2.617 15.614 377 HG22 ILE 47 HG22 ILE 47 -0.305 -1.613 15.995 378 HG23 ILE 47 HG23 ILE 47 -1.753 -1.537 17.026 379 HD11 ILE 47 HD11 ILE 47 -5.295 -0.508 16.120 380 HD12 ILE 47 HD12 ILE 47 -3.872 -0.961 17.100 381 HD13 ILE 47 HD13 ILE 47 -4.078 0.715 16.512 382 H TYR 48 H TYR 48 -0.249 1.899 13.725 383 HA TYR 48 HA TYR 48 2.325 0.847 14.102 384 HB2 TYR 48 HB2 TYR 48 1.473 1.942 12.059 385 HB3 TYR 48 HB3 TYR 48 1.441 3.492 12.889 386 HD1 TYR 48 HD2 TYR 48 3.613 0.867 11.462 387 HD2 TYR 48 HD1 TYR 48 3.510 4.752 13.318 388 HE1 TYR 48 HE2 TYR 48 5.947 1.290 10.722 389 HE2 TYR 48 HE1 TYR 48 5.793 5.203 12.536 390 HH TYR 48 HH TYR 48 7.616 4.399 11.375 391 H GLN 49 H GLN 49 0.733 3.587 15.675 392 HA GLN 49 HA GLN 49 3.067 4.929 16.582 393 HB2 GLN 49 HB2 GLN 49 0.198 4.835 17.557 394 HB3 GLN 49 HB3 GLN 49 1.420 5.962 18.202 395 HG2 GLN 49 HG2 GLN 49 1.751 6.994 16.058 396 HG3 GLN 49 HG3 GLN 49 0.854 5.738 15.220 397 HE21 GLN 49 HE22 GLN 49 -0.551 7.283 14.253 398 HE22 GLN 49 HE21 GLN 49 -1.819 8.062 15.152 399 H ARG 50 H ARG 50 1.736 1.886 17.577 400 HA ARG 50 HA ARG 50 2.868 2.004 20.291 401 HB2 ARG 50 HB2 ARG 50 1.621 -0.171 18.565 402 HB3 ARG 50 HB3 ARG 50 2.425 -0.536 20.089 403 HG2 ARG 50 HG2 ARG 50 0.046 -0.352 20.473 404 HG3 ARG 50 HG3 ARG 50 0.915 0.931 21.327 405 HD2 ARG 50 HD2 ARG 50 0.259 2.555 19.586 406 HD3 ARG 50 HD3 ARG 50 -0.580 1.269 18.700 407 HE ARG 50 HE ARG 50 -1.557 1.332 21.380 408 HH11 ARG 50 HH11 ARG 50 -1.694 3.259 18.412 409 HH12 ARG 50 HH12 ARG 50 -3.222 3.987 18.833 410 HH21 ARG 50 HH21 ARG 50 -3.550 2.296 21.881 411 HH22 ARG 50 HH22 ARG 50 -4.261 3.447 20.770 412 H ILE 51 H ILE 51 3.699 0.816 17.050 413 HA ILE 51 HA ILE 51 6.071 -0.609 17.839 414 HB ILE 51 HB ILE 51 5.105 0.530 15.186 415 HG12 ILE 51 HG12 ILE 51 4.423 -1.619 14.592 416 HG13 ILE 51 HG13 ILE 51 5.206 -2.397 15.981 417 HG21 ILE 51 HG21 ILE 51 6.690 -1.063 14.133 418 HG22 ILE 51 HG22 ILE 51 7.538 0.182 15.071 419 HG23 ILE 51 HG23 ILE 51 7.345 -1.455 15.741 420 HD11 ILE 51 HD11 ILE 51 3.505 -1.536 17.470 421 HD12 ILE 51 HD12 ILE 51 2.820 -0.532 16.143 422 HD13 ILE 51 HD13 ILE 51 2.713 -2.309 16.092 423 H GLN 52 H GLN 52 5.248 2.658 17.745 424 HA GLN 52 HA GLN 52 8.118 3.440 17.550 425 HB2 GLN 52 HB2 GLN 52 5.688 5.207 17.076 426 HB3 GLN 52 HB3 GLN 52 7.371 5.637 16.765 427 HG2 GLN 52 HG2 GLN 52 5.695 3.598 15.279 428 HG3 GLN 52 HG3 GLN 52 6.336 5.122 14.665 429 HE21 GLN 52 HE22 GLN 52 6.650 2.159 13.950 430 HE22 GLN 52 HE21 GLN 52 8.380 1.908 13.848 431 H ALA 53 H ALA 53 5.621 3.096 19.879 432 HA ALA 53 HA ALA 53 7.161 4.794 21.731 433 HB1 ALA 53 HB1 ALA 53 4.199 5.270 21.210 434 HB2 ALA 53 HB2 ALA 53 5.204 6.115 22.405 435 HB3 ALA 53 HB3 ALA 53 5.526 6.334 20.669 436 H GLY 54 H GLY 54 5.777 1.896 21.224 437 HA2 GLY 54 HA2 GLY 54 5.650 1.142 24.010 438 HA3 GLY 54 HA3 GLY 54 4.037 1.215 23.254 439 H LEU 55 H LEU 55 7.330 0.179 22.416 440 HA LEU 55 HA LEU 55 6.852 -1.228 20.151 441 HB2 LEU 55 HB2 LEU 55 8.930 -1.926 22.252 442 HB3 LEU 55 HB3 LEU 55 8.985 -2.353 20.547 443 HG LEU 55 HG LEU 55 10.433 -0.556 20.661 444 HD11 LEU 55 HD11 LEU 55 8.749 -0.285 18.887 445 HD12 LEU 55 HD12 LEU 55 7.788 0.765 19.962 446 HD13 LEU 55 HD13 LEU 55 9.409 1.269 19.443 447 HD21 LEU 55 HD21 LEU 55 9.818 0.158 22.989 448 HD22 LEU 55 HD22 LEU 55 10.179 1.481 21.863 449 HD23 LEU 55 HD23 LEU 55 8.501 1.137 22.290 450 H THR 56 H THR 56 6.814 -3.354 19.490 451 HA THR 56 HA THR 56 5.817 -5.342 21.449 452 HB THR 56 HB THR 56 4.166 -6.093 19.728 453 HG1 THR 56 HG1 THR 56 3.760 -4.658 18.024 454 HG21 THR 56 HG21 THR 56 2.553 -4.286 20.064 455 HG22 THR 56 HG22 THR 56 3.471 -4.554 21.559 456 HG23 THR 56 HG23 THR 56 3.857 -3.166 20.518 457 H ALA 57 H ALA 57 8.284 -4.561 19.572 458 HA ALA 57 HA ALA 57 9.002 -7.338 18.916 459 HB1 ALA 57 HB1 ALA 57 9.658 -6.696 16.607 460 HB2 ALA 57 HB2 ALA 57 7.910 -6.540 16.858 461 HB3 ALA 57 HB3 ALA 57 8.941 -5.090 16.859 462 HA PRO 58 HA PRO 58 11.964 -4.618 21.298 463 HB2 PRO 58 HB2 PRO 58 12.804 -7.492 21.763 464 HB3 PRO 58 HB3 PRO 58 12.954 -6.112 22.884 465 HG2 PRO 58 HG2 PRO 58 10.847 -7.788 23.135 466 HG3 PRO 58 HG3 PRO 58 10.542 -6.015 23.139 467 HD2 PRO 58 HD2 PRO 58 10.190 -7.984 20.868 468 HD3 PRO 58 HD3 PRO 58 9.134 -6.635 21.364 469 H ASP 59 H ASP 59 12.747 -7.341 19.095 470 HA ASP 59 HA ASP 59 15.002 -5.854 17.997 471 HB2 ASP 59 HB2 ASP 59 15.892 -6.713 20.163 472 HB3 ASP 59 HB3 ASP 59 15.424 -8.342 19.705 473 H5' U 36 H5' U 36 -5.119 4.736 -14.085 474 H5'' U 36 H5'' U 36 -6.402 5.739 -13.373 475 H4' U 36 H4' U 36 -6.765 4.142 -15.937 476 H3' U 36 H3' U 36 -4.929 6.103 -15.943 477 H2' U 36 H2' U 36 -6.247 7.589 -14.607 478 HO2' U 36 HO2' U 36 -6.610 8.281 -17.346 479 H1' U 36 H1' U 36 -8.498 7.101 -16.571 480 H3 U 36 H3 U 36 -12.092 8.554 -14.237 481 H5 U 36 H5 U 36 -8.801 9.642 -11.859 482 H6 U 36 H6 U 36 -7.379 8.386 -13.325 483 HO5' U 36 HO5' U 36 -6.316 3.548 -12.588 484 H5' C 37 H5' C 37 -2.539 4.724 -18.306 485 H5'' C 37 H5'' C 37 -3.218 5.911 -17.168 486 H4' C 37 H4' C 37 -2.076 6.702 -19.866 487 H3' C 37 H3' C 37 -0.409 5.548 -18.080 488 H2' C 37 H2' C 37 -1.028 6.735 -16.152 489 HO2' C 37 HO2' C 37 1.203 7.283 -16.482 490 H1' C 37 H1' C 37 -1.180 9.363 -17.550 491 H41 C 37 H41 C 37 -4.719 10.845 -12.545 492 H42 C 37 H42 C 37 -4.851 9.166 -12.059 493 H5 C 37 H5 C 37 -4.079 7.320 -13.478 494 H6 C 37 H6 C 37 -2.889 6.767 -15.504 495 H5' A 38 H5' A 38 2.686 8.312 -17.944 496 H5'' A 38 H5'' A 38 4.066 7.578 -18.769 497 H4' A 38 H4' A 38 4.631 8.092 -16.462 498 H3' A 38 H3' A 38 5.319 5.726 -17.575 499 H2' A 38 H2' A 38 3.243 4.637 -17.058 500 HO2' A 38 HO2' A 38 5.039 3.384 -16.228 501 H1' A 38 H1' A 38 3.504 5.665 -14.235 502 H8 A 38 H8 A 38 1.381 3.970 -16.809 503 H61 A 38 H61 A 38 -3.292 4.488 -12.747 504 H62 A 38 H62 A 38 -2.782 3.761 -14.258 505 H2 A 38 H2 A 38 0.053 7.074 -11.362 506 H5' G 39 H5' G 39 5.085 8.753 -14.622 507 H5'' G 39 H5'' G 39 6.410 9.791 -15.179 508 H4' G 39 H4' G 39 5.711 10.834 -13.223 509 H3' G 39 H3' G 39 8.248 9.958 -13.116 510 H2' G 39 H2' G 39 7.859 7.785 -12.283 511 HO2' G 39 HO2' G 39 8.071 9.446 -9.999 512 H1' G 39 H1' G 39 5.798 8.531 -10.279 513 H8 G 39 H8 G 39 3.639 7.111 -12.474 514 H1 G 39 H1 G 39 7.697 2.413 -10.870 515 H21 G 39 H21 G 39 9.526 3.239 -10.021 516 H22 G 39 H22 G 39 9.774 4.961 -9.816 517 H5' G 40 H5' G 40 7.044 11.226 -8.631 518 H5'' G 40 H5'' G 40 8.174 12.532 -8.294 519 H4' G 40 H4' G 40 7.752 11.121 -6.323 520 H3' G 40 H3' G 40 10.302 12.022 -7.102 521 H2' G 40 H2' G 40 10.679 9.814 -8.094 522 HO2' G 40 HO2' G 40 12.276 8.919 -6.768 523 H1' G 40 H1' G 40 9.453 8.927 -5.443 524 H8 G 40 H8 G 40 9.803 7.496 -9.066 525 H1 G 40 H1 G 40 11.755 3.676 -4.291 526 H21 G 40 H21 G 40 11.460 4.702 -2.332 527 H22 G 40 H22 G 40 10.748 6.288 -2.218 528 H5' A 41 H5' A 41 7.516 13.740 -3.674 529 H5'' A 41 H5'' A 41 7.192 12.578 -4.973 530 H4' A 41 H4' A 41 7.306 15.584 -5.437 531 H3' A 41 H3' A 41 5.101 13.861 -4.337 532 H2' A 41 H2' A 41 3.517 14.667 -5.855 533 HO2' A 41 HO2' A 41 4.029 16.901 -5.462 534 H1' A 41 H1' A 41 5.169 15.144 -8.045 535 H8 A 41 H8 A 41 4.441 12.095 -5.732 536 H61 A 41 H61 A 41 2.649 9.399 -11.055 537 H62 A 41 H62 A 41 2.727 9.181 -9.315 538 H2 A 41 H2 A 41 4.201 13.411 -12.005 539 H5' C 42 H5' C 42 1.536 15.347 -1.902 540 H5'' C 42 H5'' C 42 2.557 13.959 -2.324 541 H4' C 42 H4' C 42 1.539 13.916 -4.577 542 H3' C 42 H3' C 42 0.627 16.377 -4.419 543 H2' C 42 H2' C 42 -0.536 16.145 -2.330 544 HO2' C 42 HO2' C 42 -2.808 15.940 -2.881 545 H1' C 42 H1' C 42 -1.874 13.617 -3.193 546 H41 C 42 H41 C 42 -2.797 13.911 3.100 547 H42 C 42 H42 C 42 -1.111 13.520 3.383 548 H5 C 42 H5 C 42 0.520 13.337 1.559 549 H6 C 42 H6 C 42 0.809 13.505 -0.849 550 H5' A 43 H5' A 43 -2.508 15.959 -6.091 551 H5'' A 43 H5'' A 43 -2.538 15.842 -7.845 552 H4' A 43 H4' A 43 -4.110 17.509 -6.946 553 H3' A 43 H3' A 43 -2.719 18.144 -9.138 554 H2' A 43 H2' A 43 -0.697 18.751 -7.975 555 HO2' A 43 HO2' A 43 -0.546 21.029 -8.158 556 H1' A 43 H1' A 43 -2.186 20.550 -6.091 557 H8 A 43 H8 A 43 -1.170 18.160 -3.838 558 H61 A 43 H61 A 43 4.771 19.949 -4.085 559 H62 A 43 H62 A 43 3.609 18.986 -3.199 560 H2 A 43 H2 A 43 2.669 21.693 -7.575 561 H5' U 44 H5' U 44 -6.008 16.958 -6.898 562 H5'' U 44 H5'' U 44 -7.522 17.867 -6.760 563 H4' U 44 H4' U 44 -6.993 16.809 -4.630 564 H3' U 44 H3' U 44 -6.443 19.794 -4.533 565 HO3' U 44 HO3' U 44 -8.586 19.782 -3.676 566 H2' U 44 H2' U 44 -6.282 19.451 -2.156 567 HO2' U 44 HO2' U 44 -8.089 17.960 -2.021 568 H1' U 44 H1' U 44 -4.873 17.071 -2.439 569 H3 U 44 H3 U 44 -1.699 19.772 -0.704 570 H5 U 44 H5 U 44 -2.726 21.707 -4.290 571 H6 U 44 H6 U 44 -4.352 19.970 -4.703 572 H1 MET 1 H1 MET 1 -0.152 -13.045 5.184 573 H2 MET 1 H2 MET 1 0.774 -11.685 5.120 574 H3 MET 1 H3 MET 1 0.882 -12.805 3.922 575 HA MET 1 HA MET 1 -0.368 -10.922 3.168 576 HB2 MET 1 HB2 MET 1 -0.939 -13.188 2.294 577 HB3 MET 1 HB3 MET 1 -2.063 -13.413 3.646 578 HG2 MET 1 HG2 MET 1 -3.328 -12.770 1.713 579 HG3 MET 1 HG3 MET 1 -3.368 -11.448 2.874 580 HE1 MET 1 HE1 MET 1 -4.355 -11.105 0.024 581 HE2 MET 1 HE2 MET 1 -4.244 -9.756 1.172 582 HE3 MET 1 HE3 MET 1 -3.601 -9.560 -0.477 583 H LEU 2 H LEU 2 -1.741 -9.234 3.680 584 HA LEU 2 HA LEU 2 -3.592 -9.638 5.969 585 HB2 LEU 2 HB2 LEU 2 -1.326 -7.741 5.684 586 HB3 LEU 2 HB3 LEU 2 -2.859 -6.972 6.122 587 HG LEU 2 HG LEU 2 -1.575 -9.291 7.601 588 HD11 LEU 2 HD11 LEU 2 -1.768 -6.324 8.285 589 HD12 LEU 2 HD12 LEU 2 -1.101 -7.598 9.334 590 HD13 LEU 2 HD13 LEU 2 -0.299 -7.205 7.799 591 HD21 LEU 2 HD21 LEU 2 -4.035 -9.277 7.895 592 HD22 LEU 2 HD22 LEU 2 -3.247 -8.681 9.367 593 HD23 LEU 2 HD23 LEU 2 -3.997 -7.530 8.236 594 H ILE 3 H ILE 3 -5.446 -8.321 5.911 595 HA ILE 3 HA ILE 3 -5.919 -6.775 3.416 596 HB ILE 3 HB ILE 3 -7.768 -8.884 4.612 597 HG12 ILE 3 HG12 ILE 3 -7.641 -9.531 2.039 598 HG13 ILE 3 HG13 ILE 3 -6.084 -8.686 2.101 599 HG21 ILE 3 HG21 ILE 3 -8.229 -6.941 2.316 600 HG22 ILE 3 HG22 ILE 3 -9.288 -8.298 2.748 601 HG23 ILE 3 HG23 ILE 3 -9.095 -6.947 3.877 602 HD11 ILE 3 HD11 ILE 3 -7.021 -10.981 3.849 603 HD12 ILE 3 HD12 ILE 3 -5.841 -11.103 2.507 604 HD13 ILE 3 HD13 ILE 3 -5.406 -10.218 3.970 605 H LEU 4 H LEU 4 -7.485 -5.137 3.654 606 HA LEU 4 HA LEU 4 -8.373 -4.416 6.399 607 HB2 LEU 4 HB2 LEU 4 -6.743 -2.655 4.520 608 HB3 LEU 4 HB3 LEU 4 -7.491 -2.120 6.030 609 HG LEU 4 HG LEU 4 -5.283 -4.214 5.847 610 HD11 LEU 4 HD11 LEU 4 -5.299 -1.254 6.554 611 HD12 LEU 4 HD12 LEU 4 -3.891 -2.336 6.731 612 HD13 LEU 4 HD13 LEU 4 -4.562 -1.980 5.117 613 HD21 LEU 4 HD21 LEU 4 -5.094 -3.780 8.293 614 HD22 LEU 4 HD22 LEU 4 -6.497 -2.702 8.213 615 HD23 LEU 4 HD23 LEU 4 -6.688 -4.442 7.883 616 H THR 5 H THR 5 -9.934 -2.612 6.330 617 HA THR 5 HA THR 5 -10.870 -1.871 3.623 618 HB THR 5 HB THR 5 -13.021 -2.269 5.680 619 HG1 THR 5 HG1 THR 5 -12.032 -4.276 5.700 620 HG21 THR 5 HG21 THR 5 -13.368 -1.157 3.504 621 HG22 THR 5 HG22 THR 5 -12.802 -2.631 2.671 622 HG23 THR 5 HG23 THR 5 -14.301 -2.670 3.635 623 H ARG 6 H ARG 6 -10.176 0.119 3.634 624 HA ARG 6 HA ARG 6 -10.664 1.886 6.001 625 HB2 ARG 6 HB2 ARG 6 -8.295 1.121 4.782 626 HB3 ARG 6 HB3 ARG 6 -8.660 2.644 3.968 627 HG2 ARG 6 HG2 ARG 6 -8.822 3.796 6.157 628 HG3 ARG 6 HG3 ARG 6 -8.571 2.239 6.994 629 HD2 ARG 6 HD2 ARG 6 -6.413 3.427 6.812 630 HD3 ARG 6 HD3 ARG 6 -6.420 1.965 5.821 631 HE ARG 6 HE ARG 6 -6.953 4.681 4.686 632 HH11 ARG 6 HH21 ARG 6 -5.866 1.362 4.262 633 HH12 ARG 6 HH22 ARG 6 -4.841 1.714 2.895 634 HH21 ARG 6 HH11 ARG 6 -5.347 5.164 3.002 635 HH22 ARG 6 HH12 ARG 6 -4.607 3.821 2.148 636 H LYS 7 H LYS 7 -10.632 4.337 5.175 637 HA LYS 7 HA LYS 7 -11.963 4.436 2.524 638 HB2 LYS 7 HB2 LYS 7 -13.561 6.068 3.288 639 HB3 LYS 7 HB3 LYS 7 -13.767 4.580 4.209 640 HG2 LYS 7 HG2 LYS 7 -12.790 5.536 6.163 641 HG3 LYS 7 HG3 LYS 7 -11.981 6.809 5.231 642 HD2 LYS 7 HD2 LYS 7 -14.258 7.725 4.614 643 HD3 LYS 7 HD3 LYS 7 -14.998 6.490 5.640 644 HE2 LYS 7 HE2 LYS 7 -14.902 8.585 6.820 645 HE3 LYS 7 HE3 LYS 7 -13.791 7.434 7.601 646 HZ1 LYS 7 HZ1 LYS 7 -11.980 8.500 6.460 647 HZ2 LYS 7 HZ2 LYS 7 -12.999 9.533 5.687 648 HZ3 LYS 7 HZ3 LYS 7 -12.804 9.614 7.322 649 H VAL 8 H VAL 8 -12.248 6.798 1.809 650 HA VAL 8 HA VAL 8 -9.634 7.628 1.217 651 HB VAL 8 HB VAL 8 -10.567 9.454 0.044 652 HG11 VAL 8 HG11 VAL 8 -12.491 7.079 -0.054 653 HG12 VAL 8 HG12 VAL 8 -12.187 8.239 -1.358 654 HG13 VAL 8 HG13 VAL 8 -10.896 7.136 -0.838 655 HG21 VAL 8 HG21 VAL 8 -12.179 10.361 1.645 656 HG22 VAL 8 HG22 VAL 8 -12.922 10.031 0.066 657 HG23 VAL 8 HG23 VAL 8 -13.215 8.922 1.432 658 H GLY 9 H GLY 9 -8.176 8.882 2.091 659 HA2 GLY 9 HA2 GLY 9 -7.557 10.951 3.163 660 HA3 GLY 9 HA3 GLY 9 -8.986 10.821 4.192 661 H GLU 10 H GLU 10 -8.215 7.759 4.504 662 HA GLU 10 HA GLU 10 -6.553 8.267 6.887 663 HB2 GLU 10 HB2 GLU 10 -8.323 6.063 5.889 664 HB3 GLU 10 HB3 GLU 10 -7.021 5.637 7.010 665 HG2 GLU 10 HG2 GLU 10 -9.074 6.120 8.233 666 HG3 GLU 10 HG3 GLU 10 -7.792 7.256 8.650 667 H SER 11 H SER 11 -5.004 6.278 7.395 668 HA SER 11 HA SER 11 -3.299 5.718 5.040 669 HB2 SER 11 HB2 SER 11 -2.385 7.131 7.580 670 HB3 SER 11 HB3 SER 11 -1.306 6.521 6.311 671 HG SER 11 HG SER 11 -1.832 8.760 6.084 672 H ILE 12 H ILE 12 -1.551 4.258 5.540 673 HA ILE 12 HA ILE 12 -1.889 2.435 7.863 674 HB ILE 12 HB ILE 12 -1.806 1.629 4.923 675 HG12 ILE 12 HG12 ILE 12 -4.036 2.401 5.653 676 HG13 ILE 12 HG13 ILE 12 -4.004 0.679 5.251 677 HG21 ILE 12 HG21 ILE 12 -0.563 -0.050 6.167 678 HG22 ILE 12 HG22 ILE 12 -1.832 -0.102 7.422 679 HG23 ILE 12 HG23 ILE 12 -2.159 -0.703 5.788 680 HD11 ILE 12 HD11 ILE 12 -3.915 0.109 7.672 681 HD12 ILE 12 HD12 ILE 12 -3.977 1.843 8.058 682 HD13 ILE 12 HD13 ILE 12 -5.351 1.054 7.264 683 H ASN 13 H ASN 13 0.142 0.915 7.905 684 HA ASN 13 HA ASN 13 2.500 2.306 6.736 685 HB2 ASN 13 HB2 ASN 13 1.974 1.641 9.649 686 HB3 ASN 13 HB3 ASN 13 3.600 1.921 9.007 687 HD21 ASN 13 HD22 ASN 13 4.159 4.011 8.137 688 HD22 ASN 13 HD21 ASN 13 3.263 5.427 8.638 689 H ILE 14 H ILE 14 4.365 1.094 6.570 690 HA ILE 14 HA ILE 14 4.215 -1.823 7.057 691 HB ILE 14 HB ILE 14 5.032 -0.563 4.407 692 HG12 ILE 14 HG12 ILE 14 2.549 -2.181 5.130 693 HG13 ILE 14 HG13 ILE 14 2.598 -0.451 4.740 694 HG21 ILE 14 HG21 ILE 14 4.762 -3.473 5.273 695 HG22 ILE 14 HG22 ILE 14 5.163 -2.912 3.626 696 HG23 ILE 14 HG23 ILE 14 6.288 -2.620 4.946 697 HD11 ILE 14 HD11 ILE 14 3.470 -1.023 2.467 698 HD12 ILE 14 HD12 ILE 14 3.239 -2.748 2.857 699 HD13 ILE 14 HD13 ILE 14 1.842 -1.661 2.800 700 H GLY 15 H GLY 15 6.347 -2.799 7.167 701 HA2 GLY 15 HA2 GLY 15 8.517 -2.837 7.926 702 HA3 GLY 15 HA3 GLY 15 8.799 -1.469 6.831 703 H ASP 16 H ASP 16 10.072 -0.232 8.121 704 HA ASP 16 HA ASP 16 8.758 1.004 10.487 705 HB2 ASP 16 HB2 ASP 16 11.695 0.257 10.192 706 HB3 ASP 16 HB3 ASP 16 10.975 1.127 11.558 707 H ASP 17 H ASP 17 9.371 1.491 7.425 708 HA ASP 17 HA ASP 17 10.095 4.335 7.746 709 HB2 ASP 17 HB2 ASP 17 11.602 2.406 5.922 710 HB3 ASP 17 HB3 ASP 17 11.785 4.156 5.926 711 H ILE 18 H ILE 18 7.749 2.369 6.698 712 HA ILE 18 HA ILE 18 7.386 3.939 4.194 713 HB ILE 18 HB ILE 18 6.562 1.036 4.594 714 HG12 ILE 18 HG12 ILE 18 8.262 0.867 2.549 715 HG13 ILE 18 HG13 ILE 18 9.015 2.267 3.334 716 HG21 ILE 18 HG21 ILE 18 6.454 2.906 2.197 717 HG22 ILE 18 HG22 ILE 18 6.124 1.160 2.146 718 HG23 ILE 18 HG23 ILE 18 5.067 2.225 3.078 719 HD11 ILE 18 HD11 ILE 18 8.378 -0.420 4.638 720 HD12 ILE 18 HD12 ILE 18 9.983 0.084 4.066 721 HD13 ILE 18 HD13 ILE 18 9.225 0.923 5.437 722 H THR 19 H THR 19 5.317 4.571 3.671 723 HA THR 19 HA THR 19 3.112 3.993 5.578 724 HB THR 19 HB THR 19 3.865 6.786 4.630 725 HG1 THR 19 HG1 THR 19 4.545 7.102 6.747 726 HG21 THR 19 HG21 THR 19 1.822 5.765 6.647 727 HG22 THR 19 HG22 THR 19 2.245 7.477 6.411 728 HG23 THR 19 HG23 THR 19 1.481 6.567 5.096 729 H ILE 20 H ILE 20 1.036 4.361 4.620 730 HA ILE 20 HA ILE 20 0.974 4.709 1.657 731 HB ILE 20 HB ILE 20 -0.453 2.602 3.323 732 HG12 ILE 20 HG12 ILE 20 1.955 2.080 2.933 733 HG13 ILE 20 HG13 ILE 20 0.848 0.923 2.192 734 HG21 ILE 20 HG21 ILE 20 -0.578 3.205 0.344 735 HG22 ILE 20 HG22 ILE 20 -1.233 1.734 1.105 736 HG23 ILE 20 HG23 ILE 20 -1.903 3.313 1.525 737 HD11 ILE 20 HD11 ILE 20 2.751 1.510 0.713 738 HD12 ILE 20 HD12 ILE 20 1.187 1.925 -0.010 739 HD13 ILE 20 HD13 ILE 20 2.210 3.203 0.698 740 H THR 21 H THR 21 -0.935 5.737 0.914 741 HA THR 21 HA THR 21 -2.932 6.537 2.965 742 HB THR 21 HB THR 21 -1.511 8.485 1.113 743 HG1 THR 21 HG1 THR 21 -1.307 8.114 3.917 744 HG21 THR 21 HG21 THR 21 -3.831 9.158 1.664 745 HG22 THR 21 HG22 THR 21 -3.488 8.924 3.392 746 HG23 THR 21 HG23 THR 21 -2.653 10.204 2.480 747 H ILE 22 H ILE 22 -4.955 7.038 2.134 748 HA ILE 22 HA ILE 22 -5.395 6.234 -0.698 749 HB ILE 22 HB ILE 22 -6.438 4.709 0.779 750 HG12 ILE 22 HG12 ILE 22 -8.744 4.801 0.225 751 HG13 ILE 22 HG13 ILE 22 -8.687 6.557 -0.065 752 HG21 ILE 22 HG21 ILE 22 -6.526 6.201 2.826 753 HG22 ILE 22 HG22 ILE 22 -7.932 6.999 2.121 754 HG23 ILE 22 HG23 ILE 22 -8.005 5.267 2.517 755 HD11 ILE 22 HD11 ILE 22 -7.195 6.256 -1.947 756 HD12 ILE 22 HD12 ILE 22 -7.208 4.480 -1.699 757 HD13 ILE 22 HD13 ILE 22 -8.705 5.344 -2.164 758 H LEU 23 H LEU 23 -5.163 8.140 -1.805 759 HA LEU 23 HA LEU 23 -5.908 10.656 -0.663 760 HB2 LEU 23 HB2 LEU 23 -5.512 10.038 -3.608 761 HB3 LEU 23 HB3 LEU 23 -5.363 11.599 -2.803 762 HG LEU 23 HG LEU 23 -3.486 9.213 -2.623 763 HD11 LEU 23 HD11 LEU 23 -3.156 12.139 -3.412 764 HD12 LEU 23 HD12 LEU 23 -1.852 10.936 -3.385 765 HD13 LEU 23 HD13 LEU 23 -3.206 10.756 -4.529 766 HD21 LEU 23 HD21 LEU 23 -3.643 10.093 -0.341 767 HD22 LEU 23 HD22 LEU 23 -2.099 10.566 -1.085 768 HD23 LEU 23 HD23 LEU 23 -3.411 11.755 -0.944 769 H GLY 24 H GLY 24 -7.704 8.315 -2.657 770 HA2 GLY 24 HA2 GLY 24 -10.189 8.997 -1.852 771 HA3 GLY 24 HA3 GLY 24 -9.927 10.205 -3.105 772 H VAL 25 H VAL 25 -11.937 8.903 -3.912 773 HA VAL 25 HA VAL 25 -10.909 6.863 -5.815 774 HB VAL 25 HB VAL 25 -12.708 5.382 -5.478 775 HG11 VAL 25 HG11 VAL 25 -12.512 4.670 -3.170 776 HG12 VAL 25 HG12 VAL 25 -10.926 5.228 -3.746 777 HG13 VAL 25 HG13 VAL 25 -11.908 6.268 -2.682 778 HG21 VAL 25 HG21 VAL 25 -14.559 6.917 -5.231 779 HG22 VAL 25 HG22 VAL 25 -14.554 5.809 -3.861 780 HG23 VAL 25 HG23 VAL 25 -13.945 7.471 -3.648 781 H SER 26 H SER 26 -12.252 6.539 -7.668 782 HA SER 26 HA SER 26 -14.360 8.492 -8.282 783 HB2 SER 26 HB2 SER 26 -11.793 8.281 -9.904 784 HB3 SER 26 HB3 SER 26 -13.245 9.198 -10.368 785 HG SER 26 HG SER 26 -12.928 10.470 -8.488 786 H GLY 27 H GLY 27 -15.744 6.652 -8.404 787 HA2 GLY 27 HA2 GLY 27 -16.820 4.995 -9.621 788 HA3 GLY 27 HA3 GLY 27 -15.613 5.208 -10.908 789 H GLN 28 H GLN 28 -14.139 3.548 -11.190 790 HA GLN 28 HA GLN 28 -13.802 1.647 -8.908 791 HB2 GLN 28 HB2 GLN 28 -12.924 1.266 -11.813 792 HB3 GLN 28 HB3 GLN 28 -12.877 0.087 -10.505 793 HG2 GLN 28 HG2 GLN 28 -15.301 1.214 -11.894 794 HG3 GLN 28 HG3 GLN 28 -14.751 -0.472 -11.784 795 HE21 GLN 28 HE22 GLN 28 -14.415 -1.101 -9.229 796 HE22 GLN 28 HE21 GLN 28 -15.808 -0.724 -8.235 797 H GLN 29 H GLN 29 -12.307 4.215 -10.688 798 HA GLN 29 HA GLN 29 -9.580 3.456 -10.140 799 HB2 GLN 29 HB2 GLN 29 -10.871 6.169 -10.725 800 HB3 GLN 29 HB3 GLN 29 -9.161 5.914 -10.458 801 HG2 GLN 29 HG2 GLN 29 -9.385 5.907 -12.789 802 HG3 GLN 29 HG3 GLN 29 -9.157 4.221 -12.332 803 HE21 GLN 29 HE22 GLN 29 -12.286 5.945 -11.931 804 HE22 GLN 29 HE21 GLN 29 -13.108 5.042 -13.191 805 H VAL 30 H VAL 30 -8.259 4.070 -8.478 806 HA VAL 30 HA VAL 30 -9.447 5.336 -6.075 807 HB VAL 30 HB VAL 30 -7.891 2.704 -6.206 808 HG11 VAL 30 HG11 VAL 30 -9.098 4.118 -3.808 809 HG12 VAL 30 HG12 VAL 30 -8.149 2.608 -3.816 810 HG13 VAL 30 HG13 VAL 30 -7.368 4.158 -4.217 811 HG21 VAL 30 HG21 VAL 30 -9.953 1.739 -5.206 812 HG22 VAL 30 HG22 VAL 30 -10.768 3.309 -5.402 813 HG23 VAL 30 HG23 VAL 30 -10.236 2.390 -6.831 814 H ARG 31 H ARG 31 -8.161 7.105 -5.806 815 HA ARG 31 HA ARG 31 -5.460 7.067 -6.956 816 HB2 ARG 31 HB2 ARG 31 -7.137 9.017 -7.069 817 HB3 ARG 31 HB3 ARG 31 -6.724 9.328 -5.367 818 HG2 ARG 31 HG2 ARG 31 -4.325 9.540 -6.008 819 HG3 ARG 31 HG3 ARG 31 -4.739 9.099 -7.677 820 HD2 ARG 31 HD2 ARG 31 -6.310 11.107 -7.677 821 HD3 ARG 31 HD3 ARG 31 -5.480 11.639 -6.200 822 HE ARG 31 HE ARG 31 -4.254 11.267 -8.908 823 HH11 ARG 31 HH11 ARG 31 -4.115 12.759 -5.687 824 HH12 ARG 31 HH12 ARG 31 -2.682 13.687 -6.084 825 HH21 ARG 31 HH21 ARG 31 -2.442 12.501 -9.372 826 HH22 ARG 31 HH22 ARG 31 -1.736 13.532 -8.157 827 H ILE 32 H ILE 32 -3.673 6.662 -5.831 828 HA ILE 32 HA ILE 32 -3.923 6.398 -2.858 829 HB ILE 32 HB ILE 32 -2.445 4.399 -4.592 830 HG12 ILE 32 HG12 ILE 32 -5.358 4.347 -3.722 831 HG13 ILE 32 HG13 ILE 32 -4.701 4.268 -5.365 832 HG21 ILE 32 HG21 ILE 32 -3.565 4.236 -1.765 833 HG22 ILE 32 HG22 ILE 32 -2.612 2.981 -2.590 834 HG23 ILE 32 HG23 ILE 32 -1.856 4.520 -2.176 835 HD11 ILE 32 HD11 ILE 32 -4.450 2.125 -3.221 836 HD12 ILE 32 HD12 ILE 32 -5.413 2.061 -4.708 837 HD13 ILE 32 HD13 ILE 32 -3.646 2.076 -4.817 838 H GLY 33 H GLY 33 -1.961 6.587 -1.685 839 HA2 GLY 33 HA2 GLY 33 0.332 7.716 -3.229 840 HA3 GLY 33 HA3 GLY 33 -0.237 8.430 -1.708 841 H ILE 34 H ILE 34 2.381 7.401 -2.265 842 HA ILE 34 HA ILE 34 2.625 5.269 -0.206 843 HB ILE 34 HB ILE 34 4.007 5.285 -2.930 844 HG12 ILE 34 HG12 ILE 34 1.889 3.325 -1.960 845 HG13 ILE 34 HG13 ILE 34 1.567 4.674 -3.070 846 HG21 ILE 34 HG21 ILE 34 4.858 3.057 -2.218 847 HG22 ILE 34 HG22 ILE 34 5.380 4.342 -1.121 848 HG23 ILE 34 HG23 ILE 34 4.047 3.256 -0.653 849 HD11 ILE 34 HD11 ILE 34 3.285 3.796 -4.626 850 HD12 ILE 34 HD12 ILE 34 3.449 2.352 -3.591 851 HD13 ILE 34 HD13 ILE 34 1.900 2.692 -4.387 852 H ASN 35 H ASN 35 4.453 5.512 1.042 853 HA ASN 35 HA ASN 35 6.277 7.734 0.300 854 HB2 ASN 35 HB2 ASN 35 4.343 8.534 1.693 855 HB3 ASN 35 HB3 ASN 35 4.882 7.465 2.985 856 HD21 ASN 35 HD22 ASN 35 4.655 10.373 3.054 857 HD22 ASN 35 HD21 ASN 35 6.261 11.015 3.332 858 H ALA 36 H ALA 36 8.105 6.641 0.089 859 HA ALA 36 HA ALA 36 9.209 5.263 2.455 860 HB1 ALA 36 HB1 ALA 36 8.247 3.451 1.069 861 HB2 ALA 36 HB2 ALA 36 9.100 4.092 -0.357 862 HB3 ALA 36 HB3 ALA 36 10.029 3.422 0.998 863 HA PRO 37 HA PRO 37 12.779 7.503 1.249 864 HB2 PRO 37 HB2 PRO 37 14.794 5.674 1.791 865 HB3 PRO 37 HB3 PRO 37 13.952 6.662 3.041 866 HG2 PRO 37 HG2 PRO 37 13.444 3.798 2.202 867 HG3 PRO 37 HG3 PRO 37 13.511 4.470 3.862 868 HD2 PRO 37 HD2 PRO 37 11.154 4.017 2.596 869 HD3 PRO 37 HD3 PRO 37 11.375 5.462 3.622 870 H LYS 38 H LYS 38 14.315 7.680 -0.443 871 HA LYS 38 HA LYS 38 13.692 6.236 -2.839 872 HB2 LYS 38 HB2 LYS 38 16.126 7.924 -2.159 873 HB3 LYS 38 HB3 LYS 38 15.575 7.521 -3.789 874 HG2 LYS 38 HG2 LYS 38 13.844 9.089 -1.804 875 HG3 LYS 38 HG3 LYS 38 15.000 9.843 -2.917 876 HD2 LYS 38 HD2 LYS 38 13.732 8.811 -4.816 877 HD3 LYS 38 HD3 LYS 38 12.554 8.171 -3.649 878 HE2 LYS 38 HE2 LYS 38 11.622 10.218 -4.352 879 HE3 LYS 38 HE3 LYS 38 12.276 10.517 -2.736 880 HZ1 LYS 38 HZ1 LYS 38 13.619 11.180 -5.264 881 HZ2 LYS 38 HZ2 LYS 38 12.819 12.253 -4.321 882 HZ3 LYS 38 HZ3 LYS 38 14.189 11.527 -3.756 883 H ASP 39 H ASP 39 15.347 5.287 -0.145 884 HA ASP 39 HA ASP 39 17.503 3.696 -1.219 885 HB2 ASP 39 HB2 ASP 39 15.984 3.816 1.407 886 HB3 ASP 39 HB3 ASP 39 17.312 2.682 1.141 887 H VAL 40 H VAL 40 14.118 3.260 -1.357 888 HA VAL 40 HA VAL 40 14.509 0.350 -1.841 889 HB VAL 40 HB VAL 40 12.325 -0.113 -0.812 890 HG11 VAL 40 HG11 VAL 40 14.125 1.461 1.083 891 HG12 VAL 40 HG12 VAL 40 12.917 0.236 1.543 892 HG13 VAL 40 HG13 VAL 40 14.365 -0.233 0.626 893 HG21 VAL 40 HG21 VAL 40 11.330 2.119 -1.247 894 HG22 VAL 40 HG22 VAL 40 11.109 1.543 0.426 895 HG23 VAL 40 HG23 VAL 40 12.340 2.780 0.074 896 H ALA 41 H ALA 41 12.523 -0.524 -3.107 897 HA ALA 41 HA ALA 41 12.083 1.486 -5.246 898 HB1 ALA 41 HB1 ALA 41 11.819 -0.469 -6.724 899 HB2 ALA 41 HB2 ALA 41 13.365 -0.546 -5.851 900 HB3 ALA 41 HB3 ALA 41 11.995 -1.561 -5.332 901 H VAL 42 H VAL 42 10.082 1.615 -6.328 902 HA VAL 42 HA VAL 42 7.790 0.077 -5.413 903 HB VAL 42 HB VAL 42 7.538 1.616 -3.686 904 HG11 VAL 42 HG11 VAL 42 8.503 3.775 -5.584 905 HG12 VAL 42 HG12 VAL 42 7.835 4.096 -3.962 906 HG13 VAL 42 HG13 VAL 42 9.318 3.146 -4.122 907 HG21 VAL 42 HG21 VAL 42 5.485 1.548 -5.096 908 HG22 VAL 42 HG22 VAL 42 5.689 3.115 -4.274 909 HG23 VAL 42 HG23 VAL 42 6.069 2.974 -5.989 910 H HIS 43 H HIS 43 6.572 -0.310 -7.144 911 HA HIS 43 HA HIS 43 6.208 1.737 -9.210 912 HB2 HIS 43 HB2 HIS 43 7.102 -0.982 -10.175 913 HB3 HIS 43 HB3 HIS 43 7.065 0.554 -11.022 914 HD2 HIS 43 HD2 HIS 43 9.215 -1.347 -8.416 915 HE1 HIS 43 HE1 HIS 43 11.648 1.706 -10.099 916 HE2 HIS 43 HE2 HIS 43 11.619 -0.315 -8.554 917 H ARG 44 H ARG 44 4.683 0.795 -10.980 918 HA ARG 44 HA ARG 44 2.425 -0.514 -9.734 919 HB2 ARG 44 HB2 ARG 44 3.165 0.179 -12.611 920 HB3 ARG 44 HB3 ARG 44 1.580 -0.456 -12.132 921 HG2 ARG 44 HG2 ARG 44 1.056 1.479 -10.858 922 HG3 ARG 44 HG3 ARG 44 2.736 2.047 -10.843 923 HD2 ARG 44 HD2 ARG 44 1.321 3.350 -12.413 924 HD3 ARG 44 HD3 ARG 44 2.675 2.551 -13.202 925 HE ARG 44 HE ARG 44 -0.179 1.641 -13.324 926 HH11 ARG 44 HH11 ARG 44 3.080 1.775 -14.726 927 HH12 ARG 44 HH12 ARG 44 2.593 0.891 -16.159 928 HH21 ARG 44 HH21 ARG 44 -0.748 0.560 -15.267 929 HH22 ARG 44 HH22 ARG 44 0.498 0.244 -16.464 930 H GLU 45 H GLU 45 1.554 -2.637 -10.513 931 HA GLU 45 HA GLU 45 3.544 -4.629 -10.362 932 HB2 GLU 45 HB2 GLU 45 1.097 -4.787 -9.796 933 HB3 GLU 45 HB3 GLU 45 0.730 -4.893 -11.517 934 HG2 GLU 45 HG2 GLU 45 2.522 -6.831 -9.980 935 HG3 GLU 45 HG3 GLU 45 0.794 -7.081 -10.280 936 H GLU 46 H GLU 46 2.267 -2.838 -13.083 937 HA GLU 46 HA GLU 46 3.063 -4.586 -15.196 938 HB2 GLU 46 HB2 GLU 46 1.467 -2.654 -15.360 939 HB3 GLU 46 HB3 GLU 46 2.821 -1.545 -15.096 940 HG2 GLU 46 HG2 GLU 46 3.885 -2.309 -17.177 941 HG3 GLU 46 HG3 GLU 46 2.623 -3.541 -17.390 942 H ILE 47 H ILE 47 4.779 -2.055 -13.347 943 HA ILE 47 HA ILE 47 7.018 -2.100 -15.265 944 HB ILE 47 HB ILE 47 6.690 -0.519 -12.697 945 HG12 ILE 47 HG12 ILE 47 4.784 0.068 -14.002 946 HG13 ILE 47 HG13 ILE 47 5.963 1.374 -14.178 947 HG21 ILE 47 HG21 ILE 47 8.980 -0.566 -13.559 948 HG22 ILE 47 HG22 ILE 47 8.418 -0.083 -15.171 949 HG23 ILE 47 HG23 ILE 47 8.270 1.044 -13.804 950 HD11 ILE 47 HD11 ILE 47 5.386 -0.840 -16.184 951 HD12 ILE 47 HD12 ILE 47 4.919 0.862 -16.318 952 HD13 ILE 47 HD13 ILE 47 6.642 0.414 -16.383 953 H TYR 48 H TYR 48 6.152 -3.290 -12.069 954 HA TYR 48 HA TYR 48 8.655 -3.707 -10.894 955 HB2 TYR 48 HB2 TYR 48 6.462 -3.979 -9.808 956 HB3 TYR 48 HB3 TYR 48 6.123 -5.385 -10.809 957 HD1 TYR 48 HD1 TYR 48 8.307 -4.094 -8.091 958 HD2 TYR 48 HD2 TYR 48 7.024 -7.565 -10.299 959 HE1 TYR 48 HE1 TYR 48 9.287 -5.550 -6.358 960 HE2 TYR 48 HE2 TYR 48 7.947 -9.027 -8.549 961 HH TYR 48 HH TYR 48 9.590 -7.720 -5.636 962 H GLN 49 H GLN 49 7.064 -5.431 -13.511 963 HA GLN 49 HA GLN 49 8.457 -7.898 -13.329 964 HB2 GLN 49 HB2 GLN 49 7.065 -6.445 -15.595 965 HB3 GLN 49 HB3 GLN 49 7.681 -8.106 -15.739 966 HG2 GLN 49 HG2 GLN 49 6.251 -8.894 -13.958 967 HG3 GLN 49 HG3 GLN 49 5.822 -7.257 -13.483 968 HE21 GLN 49 HE22 GLN 49 3.585 -7.823 -13.668 969 HE22 GLN 49 HE21 GLN 49 2.797 -7.907 -15.217 970 H ARG 50 H ARG 50 9.666 -4.775 -14.262 971 HA ARG 50 HA ARG 50 11.786 -5.881 -15.994 972 HB2 ARG 50 HB2 ARG 50 11.070 -3.131 -14.895 973 HB3 ARG 50 HB3 ARG 50 12.640 -3.451 -15.632 974 HG2 ARG 50 HG2 ARG 50 11.179 -2.507 -17.303 975 HG3 ARG 50 HG3 ARG 50 11.587 -4.171 -17.725 976 HD2 ARG 50 HD2 ARG 50 9.372 -4.922 -16.896 977 HD3 ARG 50 HD3 ARG 50 8.971 -3.250 -16.459 978 HE ARG 50 HE ARG 50 9.767 -3.285 -19.175 979 HH11 ARG 50 HH11 ARG 50 7.100 -4.491 -17.175 980 HH12 ARG 50 HH12 ARG 50 5.969 -4.512 -18.503 981 HH21 ARG 50 HH21 ARG 50 8.247 -3.295 -20.874 982 HH22 ARG 50 HH22 ARG 50 6.606 -3.814 -20.577 983 H ILE 51 H ILE 51 11.316 -4.542 -12.715 984 HA ILE 51 HA ILE 51 14.036 -4.631 -11.905 985 HB ILE 51 HB ILE 51 11.443 -4.724 -10.309 986 HG12 ILE 51 HG12 ILE 51 11.712 -2.406 -9.914 987 HG13 ILE 51 HG13 ILE 51 13.276 -2.336 -10.762 988 HG21 ILE 51 HG21 ILE 51 14.288 -4.071 -9.429 989 HG22 ILE 51 HG22 ILE 51 12.829 -3.810 -8.444 990 HG23 ILE 51 HG23 ILE 51 13.313 -5.453 -8.888 991 HD11 ILE 51 HD11 ILE 51 11.285 -1.354 -11.975 992 HD12 ILE 51 HD12 ILE 51 12.180 -2.575 -12.887 993 HD13 ILE 51 HD13 ILE 51 10.626 -3.004 -12.082 994 H GLN 52 H GLN 52 11.812 -7.087 -12.573 995 HA GLN 52 HA GLN 52 13.449 -9.015 -10.997 996 HB2 GLN 52 HB2 GLN 52 10.550 -9.360 -11.873 997 HB3 GLN 52 HB3 GLN 52 11.446 -10.432 -10.798 998 HG2 GLN 52 HG2 GLN 52 10.503 -7.620 -10.218 999 HG3 GLN 52 HG3 GLN 52 9.995 -9.127 -9.452 1000 HE21 GLN 52 HE22 GLN 52 11.158 -6.578 -8.377 1001 HE22 GLN 52 HE21 GLN 52 12.571 -7.047 -7.463 1002 H ALA 53 H ALA 53 13.145 -8.001 -14.164 1003 HA ALA 53 HA ALA 53 13.996 -10.687 -15.059 1004 HB1 ALA 53 HB1 ALA 53 11.526 -10.549 -15.424 1005 HB2 ALA 53 HB2 ALA 53 11.794 -9.145 -16.484 1006 HB3 ALA 53 HB3 ALA 53 12.447 -10.741 -16.930 1007 H GLY 54 H GLY 54 14.712 -7.440 -15.051 1008 HA2 GLY 54 HA2 GLY 54 16.696 -7.799 -17.158 1009 HA3 GLY 54 HA3 GLY 54 15.414 -6.647 -17.576 1010 H LEU 55 H LEU 55 15.385 -6.282 -14.442 1011 HA LEU 55 HA LEU 55 16.005 -4.728 -12.972 1012 HB2 LEU 55 HB2 LEU 55 18.816 -5.386 -13.898 1013 HB3 LEU 55 HB3 LEU 55 18.328 -4.686 -12.354 1014 HG LEU 55 HG LEU 55 18.610 -6.878 -11.734 1015 HD11 LEU 55 HD11 LEU 55 16.317 -6.182 -11.181 1016 HD12 LEU 55 HD12 LEU 55 15.718 -6.984 -12.650 1017 HD13 LEU 55 HD13 LEU 55 16.489 -7.937 -11.375 1018 HD21 LEU 55 HD21 LEU 55 17.345 -7.907 -14.299 1019 HD22 LEU 55 HD22 LEU 55 19.095 -7.715 -14.042 1020 HD23 LEU 55 HD23 LEU 55 18.162 -8.847 -13.043 1021 H THR 56 H THR 56 17.954 -2.824 -12.709 1022 HA THR 56 HA THR 56 17.505 -1.049 -15.049 1023 HB THR 56 HB THR 56 17.041 0.810 -13.491 1024 HG1 THR 56 HG1 THR 56 16.547 0.202 -11.317 1025 HG21 THR 56 HG21 THR 56 14.781 0.155 -12.862 1026 HG22 THR 56 HG22 THR 56 15.167 -0.524 -14.456 1027 HG23 THR 56 HG23 THR 56 15.195 -1.568 -13.015 1028 H ALA 57 H ALA 57 19.761 -2.663 -13.423 1029 HA ALA 57 HA ALA 57 21.867 -0.742 -14.116 1030 HB1 ALA 57 HB1 ALA 57 21.364 -0.072 -11.826 1031 HB2 ALA 57 HB2 ALA 57 21.425 -1.766 -11.280 1032 HB3 ALA 57 HB3 ALA 57 22.903 -0.959 -11.844 1033 HA PRO 58 HA PRO 58 23.354 -4.795 -15.463 1034 HB2 PRO 58 HB2 PRO 58 25.841 -3.069 -15.552 1035 HB3 PRO 58 HB3 PRO 58 25.313 -4.294 -16.735 1036 HG2 PRO 58 HG2 PRO 58 24.882 -1.679 -17.241 1037 HG3 PRO 58 HG3 PRO 58 23.536 -2.841 -17.507 1038 HD2 PRO 58 HD2 PRO 58 23.994 -1.001 -15.146 1039 HD3 PRO 58 HD3 PRO 58 22.473 -1.354 -16.019 1040 H ASP 59 H ASP 59 25.121 -2.689 -13.157 1041 HA ASP 59 HA ASP 59 25.591 -4.853 -11.292 1042 HB2 ASP 59 HB2 ASP 59 27.226 -5.411 -13.108 1043 HB3 ASP 59 HB3 ASP 59 27.904 -3.798 -12.973 1044 H5' U 36 H5' U 36 -16.604 -4.346 8.676 1045 H5'' U 36 H5'' U 36 -17.606 -5.663 9.310 1046 H4' U 36 H4' U 36 -15.614 -6.892 10.048 1047 H3' U 36 H3' U 36 -14.221 -4.577 10.228 1048 H2' U 36 H2' U 36 -14.545 -3.906 7.966 1049 HO2' U 36 HO2' U 36 -12.074 -5.293 8.156 1050 H1' U 36 H1' U 36 -13.697 -6.637 7.012 1051 H3 U 36 H3 U 36 -15.219 -6.400 2.801 1052 H5 U 36 H5 U 36 -17.050 -3.099 4.638 1053 H6 U 36 H6 U 36 -16.089 -3.786 6.731 1054 HO5' U 36 HO5' U 36 -17.435 -3.973 10.817 1055 H5' C 37 H5' C 37 -13.688 -5.385 13.670 1056 H5'' C 37 H5'' C 37 -13.998 -4.385 12.238 1057 H4' C 37 H4' C 37 -11.506 -4.098 13.955 1058 H3' C 37 H3' C 37 -14.010 -3.569 14.971 1059 H2' C 37 H2' C 37 -14.764 -2.113 13.322 1060 HO2' C 37 HO2' C 37 -13.274 -0.491 15.115 1061 H1' C 37 H1' C 37 -12.103 -0.749 13.053 1062 H41 C 37 H41 C 37 -14.609 0.944 7.474 1063 H42 C 37 H42 C 37 -15.696 -0.434 7.456 1064 H5 C 37 H5 C 37 -15.717 -2.119 9.237 1065 H6 C 37 H6 C 37 -14.707 -2.764 11.338 1066 H5' A 38 H5' A 38 -9.129 -3.970 17.094 1067 H5'' A 38 H5'' A 38 -9.531 -3.060 15.632 1068 H4' A 38 H4' A 38 -8.987 -6.063 15.628 1069 H3' A 38 H3' A 38 -6.974 -4.403 16.290 1070 H2' A 38 H2' A 38 -7.754 -2.659 14.795 1071 HO2' A 38 HO2' A 38 -5.681 -3.978 13.364 1072 H1' A 38 H1' A 38 -7.640 -4.736 12.594 1073 H8 A 38 H8 A 38 -9.323 -1.470 13.860 1074 H61 A 38 H61 A 38 -10.648 -0.533 7.875 1075 H62 A 38 H62 A 38 -10.599 0.200 9.469 1076 H2 A 38 H2 A 38 -8.992 -4.641 8.297 1077 H5' G 39 H5' G 39 -7.868 -8.004 13.626 1078 H5'' G 39 H5'' G 39 -7.602 -9.423 14.652 1079 H4' G 39 H4' G 39 -7.634 -10.300 12.489 1080 H3' G 39 H3' G 39 -5.322 -10.682 13.814 1081 H2' G 39 H2' G 39 -4.197 -8.722 13.143 1082 HO2' G 39 HO2' G 39 -3.629 -10.644 11.141 1083 H1' G 39 H1' G 39 -5.047 -8.768 10.290 1084 H8 G 39 H8 G 39 -7.008 -6.193 11.059 1085 H1 G 39 H1 G 39 -1.141 -4.171 12.685 1086 H21 G 39 H21 G 39 0.222 -5.874 12.881 1087 H22 G 39 H22 G 39 -0.286 -7.526 12.580 1088 H5' G 40 H5' G 40 -4.498 -11.913 9.283 1089 H5'' G 40 H5'' G 40 -4.071 -13.624 9.365 1090 H4' G 40 H4' G 40 -2.744 -12.350 7.704 1091 H3' G 40 H3' G 40 -1.758 -14.291 9.503 1092 H2' G 40 H2' G 40 -0.677 -12.557 10.817 1093 HO2' G 40 HO2' G 40 0.904 -14.115 10.004 1094 H1' G 40 H1' G 40 -0.063 -11.349 8.097 1095 H8 G 40 H8 G 40 -0.952 -9.973 11.639 1096 H1 G 40 H1 G 40 4.596 -7.897 9.164 1097 H21 G 40 H21 G 40 4.986 -8.908 7.227 1098 H22 G 40 H22 G 40 3.849 -10.027 6.524 1099 H5' A 41 H5' A 41 -2.817 -15.019 4.981 1100 H5'' A 41 H5'' A 41 -3.194 -13.694 6.104 1101 H4' A 41 H4' A 41 -4.772 -16.285 6.089 1102 H3' A 41 H3' A 41 -4.889 -13.950 4.219 1103 H2' A 41 H2' A 41 -7.175 -13.607 4.494 1104 HO2' A 41 HO2' A 41 -8.575 -15.212 4.936 1105 H1' A 41 H1' A 41 -7.465 -14.466 7.134 1106 H8 A 41 H8 A 41 -5.266 -11.856 5.260 1107 H61 A 41 H61 A 41 -7.984 -7.816 9.142 1108 H62 A 41 H62 A 41 -6.907 -7.950 7.763 1109 H2 A 41 H2 A 41 -9.333 -11.878 10.210 1110 H5' C 42 H5' C 42 -6.818 -13.947 0.055 1111 H5'' C 42 H5'' C 42 -5.631 -13.183 1.136 1112 H4' C 42 H4' C 42 -7.458 -12.319 2.527 1113 H3' C 42 H3' C 42 -9.223 -14.049 1.623 1114 H2' C 42 H2' C 42 -9.020 -13.595 -0.711 1115 HO2' C 42 HO2' C 42 -11.254 -13.133 0.003 1116 H1' C 42 H1' C 42 -9.080 -10.644 -0.399 1117 H41 C 42 H41 C 42 -6.690 -11.769 -6.214 1118 H42 C 42 H42 C 42 -5.139 -12.175 -5.497 1119 H5 C 42 H5 C 42 -4.806 -12.322 -3.071 1120 H6 C 42 H6 C 42 -5.903 -12.123 -0.917 1121 H5' A 43 H5' A 43 -12.080 -11.790 1.492 1122 H5'' A 43 H5'' A 43 -13.060 -11.589 2.937 1123 H4' A 43 H4' A 43 -14.322 -12.261 0.897 1124 H3' A 43 H3' A 43 -14.972 -13.258 3.314 1125 H2' A 43 H2' A 43 -13.321 -14.965 3.372 1126 HO2' A 43 HO2' A 43 -14.418 -16.933 3.057 1127 H1' A 43 H1' A 43 -14.013 -15.926 0.615 1128 H8 A 43 H8 A 43 -10.978 -14.896 -0.271 1129 H61 A 43 H61 A 43 -7.923 -19.045 3.204 1130 H62 A 43 H62 A 43 -7.766 -17.903 1.884 1131 H2 A 43 H2 A 43 -12.095 -18.833 4.666 1132 H5' U 44 H5' U 44 -17.237 -12.816 -1.742 1133 H5'' U 44 H5'' U 44 -16.027 -13.921 -1.059 1134 H4' U 44 H4' U 44 -15.337 -11.223 -2.317 1135 H3' U 44 H3' U 44 -15.424 -14.026 -3.469 1136 HO3' U 44 HO3' U 44 -16.204 -12.813 -5.275 1137 H2' U 44 H2' U 44 -13.576 -13.408 -4.876 1138 HO2' U 44 HO2' U 44 -14.257 -11.213 -5.270 1139 H1' U 44 H1' U 44 -12.131 -12.337 -2.835 1140 H3 U 44 H3 U 44 -10.451 -16.507 -3.715 1141 H5 U 44 H5 U 44 -13.760 -17.167 -1.202 1142 H6 U 44 H6 U 44 -14.328 -14.841 -1.430 Start of MODEL 17 1 H1 MET 1 H1 MET 1 8.627 8.828 -2.370 2 H2 MET 1 H2 MET 1 8.608 9.914 -1.129 3 H3 MET 1 H3 MET 1 8.703 10.441 -2.683 4 HA MET 1 HA MET 1 6.431 9.030 -1.484 5 HB2 MET 1 HB2 MET 1 6.729 11.410 -0.715 6 HB3 MET 1 HB3 MET 1 6.694 11.925 -2.417 7 HG2 MET 1 HG2 MET 1 4.517 12.294 -1.471 8 HG3 MET 1 HG3 MET 1 4.401 10.973 -2.628 9 HE1 MET 1 HE1 MET 1 2.157 10.206 -1.823 10 HE2 MET 1 HE2 MET 1 1.699 10.003 -0.110 11 HE3 MET 1 HE3 MET 1 2.169 11.615 -0.740 12 H LEU 2 H LEU 2 4.851 8.286 -2.908 13 HA LEU 2 HA LEU 2 5.026 9.189 -5.718 14 HB2 LEU 2 HB2 LEU 2 5.632 6.511 -4.637 15 HB3 LEU 2 HB3 LEU 2 4.398 6.482 -5.912 16 HG LEU 2 HG LEU 2 7.191 7.650 -6.125 17 HD11 LEU 2 HD11 LEU 2 7.549 5.777 -7.668 18 HD12 LEU 2 HD12 LEU 2 7.053 5.192 -6.063 19 HD13 LEU 2 HD13 LEU 2 5.874 5.213 -7.386 20 HD21 LEU 2 HD21 LEU 2 5.648 8.925 -7.586 21 HD22 LEU 2 HD22 LEU 2 6.625 7.822 -8.564 22 HD23 LEU 2 HD23 LEU 2 4.933 7.408 -8.180 23 H ILE 3 H ILE 3 3.064 8.993 -6.858 24 HA ILE 3 HA ILE 3 0.686 8.079 -5.314 25 HB ILE 3 HB ILE 3 0.965 10.714 -6.827 26 HG12 ILE 3 HG12 ILE 3 -0.069 11.437 -4.523 27 HG13 ILE 3 HG13 ILE 3 0.639 9.927 -3.917 28 HG21 ILE 3 HG21 ILE 3 -1.475 9.358 -5.601 29 HG22 ILE 3 HG22 ILE 3 -1.416 11.034 -6.176 30 HG23 ILE 3 HG23 ILE 3 -1.209 9.703 -7.329 31 HD11 ILE 3 HD11 ILE 3 2.057 12.248 -5.285 32 HD12 ILE 3 HD12 ILE 3 2.183 11.797 -3.559 33 HD13 ILE 3 HD13 ILE 3 2.888 10.751 -4.784 34 H LEU 4 H LEU 4 -0.942 7.210 -6.611 35 HA LEU 4 HA LEU 4 -0.469 6.904 -9.518 36 HB2 LEU 4 HB2 LEU 4 -0.730 4.614 -7.523 37 HB3 LEU 4 HB3 LEU 4 -0.767 4.436 -9.277 38 HG LEU 4 HG LEU 4 1.625 5.438 -7.676 39 HD11 LEU 4 HD11 LEU 4 2.537 3.199 -8.219 40 HD12 LEU 4 HD12 LEU 4 1.022 3.065 -7.286 41 HD13 LEU 4 HD13 LEU 4 1.008 2.789 -9.041 42 HD21 LEU 4 HD21 LEU 4 1.320 4.640 -10.617 43 HD22 LEU 4 HD22 LEU 4 1.604 6.293 -10.020 44 HD23 LEU 4 HD23 LEU 4 2.851 5.053 -9.812 45 H THR 5 H THR 5 -2.352 5.739 -10.523 46 HA THR 5 HA THR 5 -4.779 5.782 -8.810 47 HB THR 5 HB THR 5 -5.045 6.561 -11.704 48 HG1 THR 5 HG1 THR 5 -3.593 8.069 -10.785 49 HG21 THR 5 HG21 THR 5 -7.062 7.618 -10.759 50 HG22 THR 5 HG22 THR 5 -6.971 5.896 -10.303 51 HG23 THR 5 HG23 THR 5 -6.544 7.134 -9.114 52 H ARG 6 H ARG 6 -4.875 3.699 -8.485 53 HA ARG 6 HA ARG 6 -4.782 1.715 -10.712 54 HB2 ARG 6 HB2 ARG 6 -3.297 1.597 -8.620 55 HB3 ARG 6 HB3 ARG 6 -4.772 1.522 -7.666 56 HG2 ARG 6 HG2 ARG 6 -4.210 -0.668 -7.717 57 HG3 ARG 6 HG3 ARG 6 -5.275 -0.624 -9.129 58 HD2 ARG 6 HD2 ARG 6 -2.238 -0.303 -9.245 59 HD3 ARG 6 HD3 ARG 6 -3.055 -1.870 -9.371 60 HE ARG 6 HE ARG 6 -4.139 -0.039 -11.288 61 HH11 ARG 6 HH11 ARG 6 -1.288 -2.030 -10.629 62 HH12 ARG 6 HH12 ARG 6 -0.935 -2.294 -12.321 63 HH21 ARG 6 HH21 ARG 6 -3.635 -0.372 -13.479 64 HH22 ARG 6 HH22 ARG 6 -2.234 -1.320 -13.931 65 H LYS 7 H LYS 7 -6.627 0.105 -10.783 66 HA LYS 7 HA LYS 7 -8.982 1.058 -9.205 67 HB2 LYS 7 HB2 LYS 7 -10.476 0.200 -10.865 68 HB3 LYS 7 HB3 LYS 7 -9.517 1.518 -11.503 69 HG2 LYS 7 HG2 LYS 7 -8.212 0.017 -12.852 70 HG3 LYS 7 HG3 LYS 7 -8.770 -1.406 -11.936 71 HD2 LYS 7 HD2 LYS 7 -11.060 -1.070 -12.699 72 HD3 LYS 7 HD3 LYS 7 -10.598 0.413 -13.553 73 HE2 LYS 7 HE2 LYS 7 -10.857 -1.556 -15.035 74 HE3 LYS 7 HE3 LYS 7 -9.240 -0.822 -15.114 75 HZ1 LYS 7 HZ1 LYS 7 -9.198 -3.239 -14.999 76 HZ2 LYS 7 HZ2 LYS 7 -8.411 -2.551 -13.741 77 HZ3 LYS 7 HZ3 LYS 7 -9.910 -3.201 -13.513 78 H VAL 8 H VAL 8 -10.710 -0.716 -9.071 79 HA VAL 8 HA VAL 8 -9.595 -2.537 -7.252 80 HB VAL 8 HB VAL 8 -11.773 -3.506 -7.051 81 HG11 VAL 8 HG11 VAL 8 -11.340 -1.210 -6.133 82 HG12 VAL 8 HG12 VAL 8 -11.978 -0.504 -7.628 83 HG13 VAL 8 HG13 VAL 8 -13.047 -1.440 -6.574 84 HG21 VAL 8 HG21 VAL 8 -12.468 -3.768 -9.365 85 HG22 VAL 8 HG22 VAL 8 -13.655 -2.847 -8.416 86 HG23 VAL 8 HG23 VAL 8 -12.575 -1.995 -9.556 87 H GLY 9 H GLY 9 -8.883 -4.537 -7.279 88 HA2 GLY 9 HA2 GLY 9 -8.760 -6.768 -8.041 89 HA3 GLY 9 HA3 GLY 9 -9.357 -6.261 -9.634 90 H GLU 10 H GLU 10 -7.040 -4.001 -8.819 91 HA GLU 10 HA GLU 10 -4.956 -5.481 -10.352 92 HB2 GLU 10 HB2 GLU 10 -5.370 -2.507 -9.943 93 HB3 GLU 10 HB3 GLU 10 -4.139 -3.263 -10.977 94 HG2 GLU 10 HG2 GLU 10 -5.898 -4.282 -12.366 95 HG3 GLU 10 HG3 GLU 10 -7.154 -3.605 -11.321 96 H SER 11 H SER 11 -2.651 -4.229 -9.765 97 HA SER 11 HA SER 11 -2.373 -4.319 -6.810 98 HB2 SER 11 HB2 SER 11 -0.769 -6.031 -8.743 99 HB3 SER 11 HB3 SER 11 -0.566 -5.953 -6.983 100 HG SER 11 HG SER 11 -1.854 -7.730 -7.641 101 H ILE 12 H ILE 12 -0.158 -3.843 -6.112 102 HA ILE 12 HA ILE 12 1.533 -2.174 -7.885 103 HB ILE 12 HB ILE 12 0.404 -1.344 -5.173 104 HG12 ILE 12 HG12 ILE 12 -1.171 -0.939 -7.032 105 HG13 ILE 12 HG13 ILE 12 -0.571 0.555 -6.311 106 HG21 ILE 12 HG21 ILE 12 2.548 -0.012 -6.883 107 HG22 ILE 12 HG22 ILE 12 1.674 0.805 -5.584 108 HG23 ILE 12 HG23 ILE 12 2.691 -0.590 -5.210 109 HD11 ILE 12 HD11 ILE 12 0.366 -0.666 -8.942 110 HD12 ILE 12 HD12 ILE 12 -0.586 0.814 -8.726 111 HD13 ILE 12 HD13 ILE 12 1.095 0.762 -8.180 112 H ASN 13 H ASN 13 3.733 -1.814 -6.649 113 HA ASN 13 HA ASN 13 4.286 -4.126 -4.865 114 HB2 ASN 13 HB2 ASN 13 5.777 -3.510 -7.447 115 HB3 ASN 13 HB3 ASN 13 6.173 -4.797 -6.301 116 HD21 ASN 13 HD22 ASN 13 4.863 -6.712 -6.246 117 HD22 ASN 13 HD21 ASN 13 3.669 -7.027 -7.491 118 H ILE 14 H ILE 14 6.244 -3.986 -3.686 119 HA ILE 14 HA ILE 14 7.745 -1.443 -3.796 120 HB ILE 14 HB ILE 14 6.559 -2.584 -1.231 121 HG12 ILE 14 HG12 ILE 14 5.789 -0.076 -2.794 122 HG13 ILE 14 HG13 ILE 14 4.806 -1.540 -2.626 123 HG21 ILE 14 HG21 ILE 14 8.120 -0.017 -1.740 124 HG22 ILE 14 HG22 ILE 14 7.474 -0.563 -0.180 125 HG23 ILE 14 HG23 ILE 14 8.764 -1.475 -0.953 126 HD11 ILE 14 HD11 ILE 14 5.602 0.369 -0.396 127 HD12 ILE 14 HD12 ILE 14 3.988 0.116 -1.083 128 HD13 ILE 14 HD13 ILE 14 4.770 -1.185 -0.150 129 H GLY 15 H GLY 15 9.887 -1.650 -2.992 130 HA2 GLY 15 HA2 GLY 15 11.883 -2.773 -2.791 131 HA3 GLY 15 HA3 GLY 15 11.013 -3.796 -1.633 132 H ASP 16 H ASP 16 11.863 -5.780 -2.195 133 HA ASP 16 HA ASP 16 11.021 -6.808 -4.844 134 HB2 ASP 16 HB2 ASP 16 13.062 -8.106 -5.027 135 HB3 ASP 16 HB3 ASP 16 13.447 -6.391 -4.891 136 H ASP 17 H ASP 17 10.205 -6.823 -1.799 137 HA ASP 17 HA ASP 17 9.443 -9.689 -1.799 138 HB2 ASP 17 HB2 ASP 17 10.654 -8.202 0.567 139 HB3 ASP 17 HB3 ASP 17 9.917 -9.797 0.643 140 H ILE 18 H ILE 18 8.216 -6.681 -2.032 141 HA ILE 18 HA ILE 18 5.929 -7.399 -0.261 142 HB ILE 18 HB ILE 18 7.003 -4.590 -0.693 143 HG12 ILE 18 HG12 ILE 18 7.216 -4.909 1.951 144 HG13 ILE 18 HG13 ILE 18 7.463 -6.600 1.499 145 HG21 ILE 18 HG21 ILE 18 4.758 -5.704 1.046 146 HG22 ILE 18 HG22 ILE 18 5.351 -4.031 1.095 147 HG23 ILE 18 HG23 ILE 18 4.578 -4.638 -0.371 148 HD11 ILE 18 HD11 ILE 18 9.339 -5.880 0.000 149 HD12 ILE 18 HD12 ILE 18 9.011 -4.190 0.435 150 HD13 ILE 18 HD13 ILE 18 9.594 -5.328 1.671 151 H THR 19 H THR 19 3.907 -6.984 -1.024 152 HA THR 19 HA THR 19 3.567 -5.671 -3.658 153 HB THR 19 HB THR 19 2.576 -8.463 -2.936 154 HG1 THR 19 HG1 THR 19 4.726 -8.369 -3.646 155 HG21 THR 19 HG21 THR 19 2.065 -6.761 -5.403 156 HG22 THR 19 HG22 THR 19 1.690 -8.498 -5.256 157 HG23 THR 19 HG23 THR 19 0.853 -7.317 -4.232 158 H ILE 20 H ILE 20 1.349 -5.007 -4.000 159 HA ILE 20 HA ILE 20 -0.352 -4.873 -1.557 160 HB ILE 20 HB ILE 20 0.456 -2.584 -3.403 161 HG12 ILE 20 HG12 ILE 20 2.226 -3.171 -1.771 162 HG13 ILE 20 HG13 ILE 20 1.558 -1.556 -1.529 163 HG21 ILE 20 HG21 ILE 20 -1.469 -2.641 -1.044 164 HG22 ILE 20 HG22 ILE 20 -0.864 -1.159 -1.826 165 HG23 ILE 20 HG23 ILE 20 -1.854 -2.301 -2.745 166 HD11 ILE 20 HD11 ILE 20 0.743 -4.009 0.085 167 HD12 ILE 20 HD12 ILE 20 1.915 -2.779 0.603 168 HD13 ILE 20 HD13 ILE 20 0.211 -2.339 0.365 169 H THR 21 H THR 21 -2.597 -4.694 -2.059 170 HA THR 21 HA THR 21 -3.331 -4.907 -4.934 171 HB THR 21 HB THR 21 -4.421 -6.789 -2.822 172 HG1 THR 21 HG1 THR 21 -3.010 -8.316 -3.745 173 HG21 THR 21 HG21 THR 21 -5.793 -6.495 -4.888 174 HG22 THR 21 HG22 THR 21 -4.374 -6.896 -5.871 175 HG23 THR 21 HG23 THR 21 -5.087 -8.120 -4.797 176 H ILE 22 H ILE 22 -5.566 -4.419 -5.337 177 HA ILE 22 HA ILE 22 -6.934 -2.922 -3.149 178 HB ILE 22 HB ILE 22 -6.059 -1.293 -4.603 179 HG12 ILE 22 HG12 ILE 22 -7.955 -0.222 -5.646 180 HG13 ILE 22 HG13 ILE 22 -8.868 -1.733 -5.681 181 HG21 ILE 22 HG21 ILE 22 -7.020 -2.976 -6.936 182 HG22 ILE 22 HG22 ILE 22 -6.412 -1.314 -7.070 183 HG23 ILE 22 HG23 ILE 22 -5.339 -2.596 -6.475 184 HD11 ILE 22 HD11 ILE 22 -7.974 -0.320 -3.151 185 HD12 ILE 22 HD12 ILE 22 -9.618 -0.303 -3.863 186 HD13 ILE 22 HD13 ILE 22 -8.935 -1.824 -3.250 187 H LEU 23 H LEU 23 -8.205 -4.719 -2.537 188 HA LEU 23 HA LEU 23 -9.224 -6.535 -4.466 189 HB2 LEU 23 HB2 LEU 23 -10.460 -6.095 -1.745 190 HB3 LEU 23 HB3 LEU 23 -10.441 -7.553 -2.717 191 HG LEU 23 HG LEU 23 -8.215 -6.375 -1.045 192 HD11 LEU 23 HD11 LEU 23 -9.543 -9.096 -1.339 193 HD12 LEU 23 HD12 LEU 23 -8.232 -8.713 -0.186 194 HD13 LEU 23 HD13 LEU 23 -9.821 -7.932 -0.027 195 HD21 LEU 23 HD21 LEU 23 -7.029 -6.928 -3.075 196 HD22 LEU 23 HD22 LEU 23 -6.764 -8.232 -1.896 197 HD23 LEU 23 HD23 LEU 23 -7.916 -8.467 -3.234 198 H GLY 24 H GLY 24 -10.560 -3.485 -3.205 199 HA2 GLY 24 HA2 GLY 24 -12.312 -3.016 -5.247 200 HA3 GLY 24 HA3 GLY 24 -13.260 -4.060 -4.208 201 H VAL 25 H VAL 25 -14.561 -1.915 -4.355 202 HA VAL 25 HA VAL 25 -13.856 -0.284 -1.967 203 HB VAL 25 HB VAL 25 -14.503 1.752 -3.035 204 HG11 VAL 25 HG11 VAL 25 -12.708 0.262 -4.986 205 HG12 VAL 25 HG12 VAL 25 -12.810 2.019 -4.760 206 HG13 VAL 25 HG13 VAL 25 -12.177 0.991 -3.453 207 HG21 VAL 25 HG21 VAL 25 -16.334 0.991 -4.440 208 HG22 VAL 25 HG22 VAL 25 -15.157 1.871 -5.419 209 HG23 VAL 25 HG23 VAL 25 -15.202 0.092 -5.486 210 H SER 26 H SER 26 -15.701 0.892 -1.071 211 HA SER 26 HA SER 26 -18.400 0.063 -1.869 212 HB2 SER 26 HB2 SER 26 -17.681 -1.732 -0.320 213 HB3 SER 26 HB3 SER 26 -17.298 -0.510 0.908 214 HG SER 26 HG SER 26 -19.404 -1.395 1.163 215 H GLY 27 H GLY 27 -18.683 2.274 -2.383 216 HA2 GLY 27 HA2 GLY 27 -19.394 4.424 -1.866 217 HA3 GLY 27 HA3 GLY 27 -19.332 3.995 -0.144 218 H GLN 28 H GLN 28 -17.607 4.714 1.085 219 HA GLN 28 HA GLN 28 -15.354 6.021 -0.382 220 HB2 GLN 28 HB2 GLN 28 -16.155 6.274 2.549 221 HB3 GLN 28 HB3 GLN 28 -14.864 7.155 1.727 222 HG2 GLN 28 HG2 GLN 28 -17.846 7.429 1.369 223 HG3 GLN 28 HG3 GLN 28 -16.659 8.641 1.907 224 HE21 GLN 28 HE22 GLN 28 -14.678 8.626 0.040 225 HE22 GLN 28 HE21 GLN 28 -15.294 8.902 -1.578 226 H GLN 29 H GLN 29 -16.292 3.290 1.536 227 HA GLN 29 HA GLN 29 -13.722 2.806 2.726 228 HB2 GLN 29 HB2 GLN 29 -16.028 0.906 2.104 229 HB3 GLN 29 HB3 GLN 29 -14.656 0.512 3.121 230 HG2 GLN 29 HG2 GLN 29 -16.216 2.994 3.805 231 HG3 GLN 29 HG3 GLN 29 -16.967 1.429 4.120 232 HE21 GLN 29 HE22 GLN 29 -13.495 2.461 4.423 233 HE22 GLN 29 HE21 GLN 29 -13.389 2.048 6.123 234 H VAL 30 H VAL 30 -12.108 1.358 2.041 235 HA VAL 30 HA VAL 30 -12.261 0.366 -0.747 236 HB VAL 30 HB VAL 30 -9.955 1.956 0.480 237 HG11 VAL 30 HG11 VAL 30 -9.319 0.122 -1.123 238 HG12 VAL 30 HG12 VAL 30 -10.365 0.890 -2.339 239 HG13 VAL 30 HG13 VAL 30 -8.940 1.759 -1.725 240 HG21 VAL 30 HG21 VAL 30 -11.786 3.462 -0.142 241 HG22 VAL 30 HG22 VAL 30 -10.463 3.600 -1.312 242 HG23 VAL 30 HG23 VAL 30 -11.927 2.675 -1.730 243 H ARG 31 H ARG 31 -11.903 -1.750 -0.645 244 HA ARG 31 HA ARG 31 -10.650 -2.948 1.730 245 HB2 ARG 31 HB2 ARG 31 -12.635 -3.684 -0.227 246 HB3 ARG 31 HB3 ARG 31 -11.312 -4.856 -0.332 247 HG2 ARG 31 HG2 ARG 31 -12.645 -4.053 2.287 248 HG3 ARG 31 HG3 ARG 31 -13.151 -5.440 1.312 249 HD2 ARG 31 HD2 ARG 31 -10.994 -6.492 1.532 250 HD3 ARG 31 HD3 ARG 31 -10.296 -5.062 2.292 251 HE ARG 31 HE ARG 31 -11.783 -5.438 4.224 252 HH11 ARG 31 HH11 ARG 31 -11.373 -8.196 2.026 253 HH12 ARG 31 HH12 ARG 31 -11.598 -9.375 3.289 254 HH21 ARG 31 HH21 ARG 31 -12.052 -6.994 5.839 255 HH22 ARG 31 HH22 ARG 31 -12.028 -8.697 5.431 256 H ILE 32 H ILE 32 -8.529 -3.327 1.793 257 HA ILE 32 HA ILE 32 -7.009 -3.322 -0.781 258 HB ILE 32 HB ILE 32 -6.072 -2.085 1.825 259 HG12 ILE 32 HG12 ILE 32 -7.606 -0.792 -0.460 260 HG13 ILE 32 HG13 ILE 32 -8.037 -0.841 1.262 261 HG21 ILE 32 HG21 ILE 32 -5.185 -1.658 -1.060 262 HG22 ILE 32 HG22 ILE 32 -4.431 -0.968 0.397 263 HG23 ILE 32 HG23 ILE 32 -4.350 -2.703 0.109 264 HD11 ILE 32 HD11 ILE 32 -7.212 1.359 0.729 265 HD12 ILE 32 HD12 ILE 32 -6.032 0.548 1.782 266 HD13 ILE 32 HD13 ILE 32 -5.723 0.690 0.027 267 H GLY 33 H GLY 33 -5.064 -4.575 -0.760 268 HA2 GLY 33 HA2 GLY 33 -4.816 -6.472 1.536 269 HA3 GLY 33 HA3 GLY 33 -4.712 -7.002 -0.148 270 H ILE 34 H ILE 34 -2.711 -7.346 1.837 271 HA ILE 34 HA ILE 34 -0.432 -5.872 0.637 272 HB ILE 34 HB ILE 34 -0.926 -6.187 3.627 273 HG12 ILE 34 HG12 ILE 34 -1.011 -3.630 1.967 274 HG13 ILE 34 HG13 ILE 34 -2.434 -4.477 2.607 275 HG21 ILE 34 HG21 ILE 34 1.286 -4.755 2.078 276 HG22 ILE 34 HG22 ILE 34 1.105 -4.749 3.843 277 HG23 ILE 34 HG23 ILE 34 1.457 -6.262 3.006 278 HD11 ILE 34 HD11 ILE 34 -1.542 -4.218 4.910 279 HD12 ILE 34 HD12 ILE 34 -0.230 -3.199 4.256 280 HD13 ILE 34 HD13 ILE 34 -1.916 -2.674 4.107 281 H ASN 35 H ASN 35 1.455 -7.082 0.606 282 HA ASN 35 HA ASN 35 1.346 -9.775 1.846 283 HB2 ASN 35 HB2 ASN 35 0.399 -9.809 -0.481 284 HB3 ASN 35 HB3 ASN 35 1.951 -9.259 -1.090 285 HD21 ASN 35 HD22 ASN 35 0.517 -11.765 -1.669 286 HD22 ASN 35 HD21 ASN 35 1.555 -13.077 -1.151 287 H ALA 36 H ALA 36 3.042 -9.641 3.171 288 HA ALA 36 HA ALA 36 5.713 -9.158 2.017 289 HB1 ALA 36 HB1 ALA 36 6.294 -7.629 3.882 290 HB2 ALA 36 HB2 ALA 36 5.004 -6.939 2.862 291 HB3 ALA 36 HB3 ALA 36 4.614 -7.669 4.440 292 HA PRO 37 HA PRO 37 6.793 -12.427 4.811 293 HB2 PRO 37 HB2 PRO 37 9.384 -11.669 5.469 294 HB3 PRO 37 HB3 PRO 37 8.918 -12.448 3.916 295 HG2 PRO 37 HG2 PRO 37 9.365 -9.521 4.540 296 HG3 PRO 37 HG3 PRO 37 9.915 -10.459 3.105 297 HD2 PRO 37 HD2 PRO 37 7.715 -8.861 3.051 298 HD3 PRO 37 HD3 PRO 37 7.760 -10.409 2.156 299 H LYS 38 H LYS 38 7.220 -12.872 7.068 300 HA LYS 38 HA LYS 38 6.348 -10.780 8.879 301 HB2 LYS 38 HB2 LYS 38 7.458 -13.588 9.347 302 HB3 LYS 38 HB3 LYS 38 6.799 -12.553 10.626 303 HG2 LYS 38 HG2 LYS 38 5.221 -13.353 8.144 304 HG3 LYS 38 HG3 LYS 38 5.151 -14.243 9.668 305 HD2 LYS 38 HD2 LYS 38 4.634 -11.245 9.588 306 HD3 LYS 38 HD3 LYS 38 3.385 -12.391 9.126 307 HE2 LYS 38 HE2 LYS 38 4.883 -12.424 11.790 308 HE3 LYS 38 HE3 LYS 38 3.304 -11.665 11.538 309 HZ1 LYS 38 HZ1 LYS 38 2.425 -13.795 10.913 310 HZ2 LYS 38 HZ2 LYS 38 3.878 -14.523 11.157 311 HZ3 LYS 38 HZ3 LYS 38 3.061 -13.864 12.426 312 H ASP 39 H ASP 39 9.175 -11.269 7.349 313 HA ASP 39 HA ASP 39 11.100 -10.485 9.367 314 HB2 ASP 39 HB2 ASP 39 11.047 -10.332 6.331 315 HB3 ASP 39 HB3 ASP 39 12.442 -9.852 7.300 316 H VAL 40 H VAL 40 8.473 -8.842 8.009 317 HA VAL 40 HA VAL 40 9.574 -6.228 8.862 318 HB VAL 40 HB VAL 40 8.613 -5.120 6.911 319 HG11 VAL 40 HG11 VAL 40 10.324 -7.469 6.004 320 HG12 VAL 40 HG12 VAL 40 10.129 -5.914 5.167 321 HG13 VAL 40 HG13 VAL 40 10.955 -5.969 6.741 322 HG21 VAL 40 HG21 VAL 40 6.773 -6.784 6.506 323 HG22 VAL 40 HG22 VAL 40 7.672 -6.302 5.048 324 HG23 VAL 40 HG23 VAL 40 8.007 -7.874 5.806 325 H ALA 41 H ALA 41 7.674 -4.600 9.042 326 HA ALA 41 HA ALA 41 5.428 -6.112 10.289 327 HB1 ALA 41 HB1 ALA 41 5.217 -4.183 11.789 328 HB2 ALA 41 HB2 ALA 41 6.873 -4.823 11.840 329 HB3 ALA 41 HB3 ALA 41 6.518 -3.337 10.924 330 H VAL 42 H VAL 42 3.301 -5.172 10.195 331 HA VAL 42 HA VAL 42 2.803 -2.865 8.488 332 HB VAL 42 HB VAL 42 2.874 -4.313 6.663 333 HG11 VAL 42 HG11 VAL 42 3.222 -6.427 7.706 334 HG12 VAL 42 HG12 VAL 42 1.594 -6.433 8.417 335 HG13 VAL 42 HG13 VAL 42 1.802 -6.586 6.653 336 HG21 VAL 42 HG21 VAL 42 -0.016 -4.528 7.611 337 HG22 VAL 42 HG22 VAL 42 0.692 -3.130 6.768 338 HG23 VAL 42 HG23 VAL 42 0.564 -4.702 5.946 339 H HIS 43 H HIS 43 1.079 -1.796 9.256 340 HA HIS 43 HA HIS 43 -1.145 -3.230 10.523 341 HB2 HIS 43 HB2 HIS 43 0.164 -0.985 12.089 342 HB3 HIS 43 HB3 HIS 43 -1.031 -2.149 12.623 343 HD2 HIS 43 HD2 HIS 43 2.745 -1.755 12.024 344 HE1 HIS 43 HE1 HIS 43 2.217 -5.383 14.181 345 HE2 HIS 43 HE2 HIS 43 3.932 -3.723 13.293 346 H ARG 44 H ARG 44 -2.909 -1.584 11.140 347 HA ARG 44 HA ARG 44 -3.299 0.401 9.094 348 HB2 ARG 44 HB2 ARG 44 -4.520 -0.007 11.861 349 HB3 ARG 44 HB3 ARG 44 -5.137 1.142 10.660 350 HG2 ARG 44 HG2 ARG 44 -5.690 -0.640 9.123 351 HG3 ARG 44 HG3 ARG 44 -4.856 -1.848 10.123 352 HD2 ARG 44 HD2 ARG 44 -7.299 -1.962 10.407 353 HD3 ARG 44 HD3 ARG 44 -6.472 -1.557 11.919 354 HE ARG 44 HE ARG 44 -7.861 0.448 10.174 355 HH11 ARG 44 HH11 ARG 44 -7.065 -0.828 13.387 356 HH12 ARG 44 HH12 ARG 44 -7.860 0.479 14.226 357 HH21 ARG 44 HH21 ARG 44 -8.953 2.103 11.316 358 HH22 ARG 44 HH22 ARG 44 -8.919 2.121 13.066 359 H GLU 45 H GLU 45 -3.124 2.763 9.357 360 HA GLU 45 HA GLU 45 -0.793 3.512 10.819 361 HB2 GLU 45 HB2 GLU 45 -1.575 4.603 8.749 362 HB3 GLU 45 HB3 GLU 45 -2.987 5.243 9.604 363 HG2 GLU 45 HG2 GLU 45 -1.102 6.878 9.259 364 HG3 GLU 45 HG3 GLU 45 -1.600 6.684 10.945 365 H GLU 46 H GLU 46 -3.967 2.933 11.858 366 HA GLU 46 HA GLU 46 -4.036 4.736 14.126 367 HB2 GLU 46 HB2 GLU 46 -6.033 3.675 13.054 368 HB3 GLU 46 HB3 GLU 46 -5.435 2.082 13.550 369 HG2 GLU 46 HG2 GLU 46 -5.589 2.783 15.931 370 HG3 GLU 46 HG3 GLU 46 -6.214 4.365 15.413 371 H ILE 47 H ILE 47 -3.208 1.264 13.613 372 HA ILE 47 HA ILE 47 -2.514 0.788 16.385 373 HB ILE 47 HB ILE 47 -2.306 -0.722 13.773 374 HG12 ILE 47 HG12 ILE 47 -3.703 -2.350 14.950 375 HG13 ILE 47 HG13 ILE 47 -3.556 -1.429 16.450 376 HG21 ILE 47 HG21 ILE 47 -1.121 -1.580 16.445 377 HG22 ILE 47 HG22 ILE 47 -1.370 -2.654 15.055 378 HG23 ILE 47 HG23 ILE 47 -0.227 -1.311 14.926 379 HD11 ILE 47 HD11 ILE 47 -4.906 -0.421 13.915 380 HD12 ILE 47 HD12 ILE 47 -5.750 -1.110 15.318 381 HD13 ILE 47 HD13 ILE 47 -4.858 0.411 15.500 382 H TYR 48 H TYR 48 -0.783 1.876 13.491 383 HA TYR 48 HA TYR 48 1.848 1.219 14.326 384 HB2 TYR 48 HB2 TYR 48 1.123 1.865 12.050 385 HB3 TYR 48 HB3 TYR 48 0.842 3.512 12.607 386 HD1 TYR 48 HD2 TYR 48 3.496 0.922 12.097 387 HD2 TYR 48 HD1 TYR 48 2.613 5.077 12.807 388 HE1 TYR 48 HE2 TYR 48 5.828 1.517 11.499 389 HE2 TYR 48 HE1 TYR 48 4.928 5.676 12.223 390 HH TYR 48 HH TYR 48 6.991 4.911 11.554 391 H GLN 49 H GLN 49 -0.311 3.901 15.218 392 HA GLN 49 HA GLN 49 1.807 5.518 16.335 393 HB2 GLN 49 HB2 GLN 49 -1.222 5.590 16.614 394 HB3 GLN 49 HB3 GLN 49 -0.132 6.824 17.286 395 HG2 GLN 49 HG2 GLN 49 0.727 7.346 15.052 396 HG3 GLN 49 HG3 GLN 49 -0.239 6.045 14.350 397 HE21 GLN 49 HE22 GLN 49 -2.024 6.750 13.341 398 HE22 GLN 49 HE21 GLN 49 -2.978 8.152 13.796 399 H ARG 50 H ARG 50 -0.092 2.814 17.490 400 HA ARG 50 HA ARG 50 0.345 3.326 20.337 401 HB2 ARG 50 HB2 ARG 50 -0.614 0.965 18.669 402 HB3 ARG 50 HB3 ARG 50 -0.176 0.757 20.361 403 HG2 ARG 50 HG2 ARG 50 -2.547 1.106 20.247 404 HG3 ARG 50 HG3 ARG 50 -1.809 2.531 21.000 405 HD2 ARG 50 HD2 ARG 50 -1.975 3.752 18.862 406 HD3 ARG 50 HD3 ARG 50 -2.645 2.301 18.087 407 HE ARG 50 HE ARG 50 -4.278 2.799 20.295 408 HH11 ARG 50 HH11 ARG 50 -3.404 4.512 17.338 409 HH12 ARG 50 HH12 ARG 50 -4.842 5.508 17.352 410 HH21 ARG 50 HH21 ARG 50 -6.169 4.051 20.256 411 HH22 ARG 50 HH22 ARG 50 -6.443 5.193 18.967 412 H ILE 51 H ILE 51 2.220 2.228 17.696 413 HA ILE 51 HA ILE 51 4.014 0.604 19.407 414 HB ILE 51 HB ILE 51 3.704 0.956 16.407 415 HG12 ILE 51 HG12 ILE 51 3.178 -1.465 18.180 416 HG13 ILE 51 HG13 ILE 51 1.915 -0.289 17.768 417 HG21 ILE 51 HG21 ILE 51 5.495 -0.953 17.954 418 HG22 ILE 51 HG22 ILE 51 5.309 -0.890 16.183 419 HG23 ILE 51 HG23 ILE 51 6.061 0.468 17.044 420 HD11 ILE 51 HD11 ILE 51 2.248 -0.734 15.378 421 HD12 ILE 51 HD12 ILE 51 3.467 -1.977 15.772 422 HD13 ILE 51 HD13 ILE 51 1.773 -2.187 16.283 423 H GLN 52 H GLN 52 4.047 3.420 17.124 424 HA GLN 52 HA GLN 52 6.842 3.941 17.599 425 HB2 GLN 52 HB2 GLN 52 4.632 5.656 16.384 426 HB3 GLN 52 HB3 GLN 52 6.353 6.064 16.367 427 HG2 GLN 52 HG2 GLN 52 5.001 3.716 15.015 428 HG3 GLN 52 HG3 GLN 52 5.929 5.030 14.277 429 HE21 GLN 52 HE22 GLN 52 6.035 1.815 15.177 430 HE22 GLN 52 HE21 GLN 52 7.768 1.607 15.324 431 H ALA 53 H ALA 53 4.388 4.144 19.776 432 HA ALA 53 HA ALA 53 4.826 6.685 20.976 433 HB1 ALA 53 HB1 ALA 53 2.872 5.229 21.418 434 HB2 ALA 53 HB2 ALA 53 3.943 4.036 22.197 435 HB3 ALA 53 HB3 ALA 53 3.721 5.653 22.918 436 H GLY 54 H GLY 54 6.823 3.826 20.850 437 HA2 GLY 54 HA2 GLY 54 9.142 4.844 21.705 438 HA3 GLY 54 HA3 GLY 54 8.346 4.596 23.264 439 H LEU 55 H LEU 55 7.698 2.307 20.627 440 HA LEU 55 HA LEU 55 9.604 0.344 21.677 441 HB2 LEU 55 HB2 LEU 55 7.730 -1.159 22.484 442 HB3 LEU 55 HB3 LEU 55 8.046 0.277 23.448 443 HG LEU 55 HG LEU 55 6.133 1.429 22.184 444 HD11 LEU 55 HD11 LEU 55 5.862 -0.141 20.306 445 HD12 LEU 55 HD12 LEU 55 5.520 -1.467 21.455 446 HD13 LEU 55 HD13 LEU 55 4.399 -0.097 21.303 447 HD21 LEU 55 HD21 LEU 55 4.469 0.391 23.655 448 HD22 LEU 55 HD22 LEU 55 5.591 -0.964 23.967 449 HD23 LEU 55 HD23 LEU 55 6.012 0.688 24.483 450 H THR 56 H THR 56 8.600 -1.986 20.867 451 HA THR 56 HA THR 56 7.505 -1.678 18.140 452 HB THR 56 HB THR 56 9.929 -3.432 18.607 453 HG1 THR 56 HG1 THR 56 10.525 -1.288 19.021 454 HG21 THR 56 HG21 THR 56 10.154 -3.102 16.135 455 HG22 THR 56 HG22 THR 56 8.639 -3.915 16.571 456 HG23 THR 56 HG23 THR 56 8.619 -2.189 16.145 457 H ALA 57 H ALA 57 7.096 -2.939 21.085 458 HA ALA 57 HA ALA 57 5.662 -5.302 20.096 459 HB1 ALA 57 HB1 ALA 57 7.893 -5.482 22.165 460 HB2 ALA 57 HB2 ALA 57 6.771 -6.792 21.729 461 HB3 ALA 57 HB3 ALA 57 7.922 -6.172 20.528 462 HA PRO 58 HA PRO 58 3.436 -2.644 23.235 463 HB2 PRO 58 HB2 PRO 58 1.290 -4.046 21.643 464 HB3 PRO 58 HB3 PRO 58 1.278 -2.392 22.324 465 HG2 PRO 58 HG2 PRO 58 1.818 -2.775 19.697 466 HG3 PRO 58 HG3 PRO 58 2.843 -1.645 20.652 467 HD2 PRO 58 HD2 PRO 58 3.417 -4.506 19.863 468 HD3 PRO 58 HD3 PRO 58 4.510 -3.085 19.829 469 H ASP 59 H ASP 59 2.220 -3.204 25.030 470 HA ASP 59 HA ASP 59 1.641 -4.473 26.812 471 HB2 ASP 59 HB2 ASP 59 -0.220 -4.633 25.182 472 HB3 ASP 59 HB3 ASP 59 0.397 -6.201 24.663 473 H5' U 36 H5' U 36 -6.131 11.537 -17.450 474 H5'' U 36 H5'' U 36 -4.997 10.402 -18.189 475 H4' U 36 H4' U 36 -3.903 11.703 -16.446 476 H3' U 36 H3' U 36 -3.573 9.003 -16.689 477 H2' U 36 H2' U 36 -5.335 8.412 -15.192 478 HO2' U 36 HO2' U 36 -2.941 8.629 -13.672 479 H1' U 36 H1' U 36 -4.312 10.525 -13.280 480 H3 U 36 H3 U 36 -7.788 10.714 -10.443 481 H5 U 36 H5 U 36 -9.263 8.338 -13.573 482 H6 U 36 H6 U 36 -7.214 8.746 -14.785 483 HO5' U 36 HO5' U 36 -7.050 9.472 -17.714 484 H5' C 37 H5' C 37 -0.566 9.372 -18.796 485 H5'' C 37 H5'' C 37 -1.964 8.554 -18.065 486 H4' C 37 H4' C 37 0.874 7.472 -17.874 487 H3' C 37 H3' C 37 -0.334 7.680 -20.302 488 H2' C 37 H2' C 37 -2.419 6.783 -19.694 489 HO2' C 37 HO2' C 37 -0.807 4.595 -20.535 490 H1' C 37 H1' C 37 -1.116 4.535 -18.168 491 H41 C 37 H41 C 37 -6.896 4.125 -15.560 492 H42 C 37 H42 C 37 -7.292 5.772 -16.014 493 H5 C 37 H5 C 37 -5.715 7.240 -17.188 494 H6 C 37 H6 C 37 -3.483 7.384 -18.119 495 H5' A 38 H5' A 38 2.824 8.631 -18.263 496 H5'' A 38 H5'' A 38 4.361 8.038 -18.914 497 H4' A 38 H4' A 38 4.658 8.554 -16.581 498 H3' A 38 H3' A 38 5.450 6.127 -17.593 499 H2' A 38 H2' A 38 3.361 5.045 -17.074 500 HO2' A 38 HO2' A 38 5.107 4.632 -14.863 501 H1' A 38 H1' A 38 3.574 6.349 -14.344 502 H8 A 38 H8 A 38 1.511 4.355 -16.788 503 H61 A 38 H61 A 38 -3.080 4.719 -12.627 504 H62 A 38 H62 A 38 -2.537 3.943 -14.100 505 H2 A 38 H2 A 38 0.139 7.550 -11.408 506 H5' G 39 H5' G 39 5.211 9.170 -14.580 507 H5'' G 39 H5'' G 39 6.521 10.263 -15.060 508 H4' G 39 H4' G 39 5.867 11.164 -13.031 509 H3' G 39 H3' G 39 8.386 10.225 -13.010 510 H2' G 39 H2' G 39 7.931 7.998 -12.314 511 HO2' G 39 HO2' G 39 8.256 9.528 -9.956 512 H1' G 39 H1' G 39 5.932 8.723 -10.236 513 H8 G 39 H8 G 39 3.723 7.460 -12.489 514 H1 G 39 H1 G 39 7.544 2.538 -10.977 515 H21 G 39 H21 G 39 9.400 3.258 -10.086 516 H22 G 39 H22 G 39 9.714 4.965 -9.825 517 H5' G 40 H5' G 40 7.211 11.343 -8.469 518 H5'' G 40 H5'' G 40 8.410 12.567 -8.038 519 H4' G 40 H4' G 40 7.858 11.014 -6.187 520 H3' G 40 H3' G 40 10.457 11.908 -6.829 521 H2' G 40 H2' G 40 10.853 9.766 -7.947 522 HO2' G 40 HO2' G 40 12.555 10.247 -6.484 523 H1' G 40 H1' G 40 9.444 8.757 -5.441 524 H8 G 40 H8 G 40 9.943 7.548 -9.127 525 H1 G 40 H1 G 40 11.609 3.426 -4.499 526 H21 G 40 H21 G 40 11.243 4.342 -2.513 527 H22 G 40 H22 G 40 10.571 5.945 -2.340 528 H5' A 41 H5' A 41 7.763 13.430 -3.232 529 H5'' A 41 H5'' A 41 7.457 12.284 -4.559 530 H4' A 41 H4' A 41 7.390 15.307 -4.887 531 H3' A 41 H3' A 41 5.163 13.378 -4.149 532 H2' A 41 H2' A 41 3.705 14.637 -5.514 533 HO2' A 41 HO2' A 41 4.398 16.714 -4.907 534 H1' A 41 H1' A 41 5.482 15.071 -7.584 535 H8 A 41 H8 A 41 4.423 11.971 -5.475 536 H61 A 41 H61 A 41 2.674 9.683 -10.999 537 H62 A 41 H62 A 41 2.659 9.373 -9.276 538 H2 A 41 H2 A 41 4.574 13.622 -11.663 539 H5' C 42 H5' C 42 1.589 15.488 -1.779 540 H5'' C 42 H5'' C 42 1.562 13.808 -1.247 541 H4' C 42 H4' C 42 1.806 13.704 -4.060 542 H3' C 42 H3' C 42 0.734 16.053 -4.030 543 H2' C 42 H2' C 42 -0.346 15.791 -1.871 544 HO2' C 42 HO2' C 42 -2.524 15.977 -2.324 545 H1' C 42 H1' C 42 -1.849 13.366 -2.729 546 H41 C 42 H41 C 42 -1.346 13.378 3.763 547 H42 C 42 H42 C 42 -0.392 11.933 3.483 548 H5 C 42 H5 C 42 0.328 11.230 1.263 549 H6 C 42 H6 C 42 0.220 11.800 -1.130 550 H5' A 43 H5' A 43 -0.543 17.959 -5.805 551 H5'' A 43 H5'' A 43 -1.363 16.500 -5.296 552 H4' A 43 H4' A 43 -1.669 17.904 -7.971 553 H3' A 43 H3' A 43 -3.485 17.199 -5.644 554 H2' A 43 H2' A 43 -5.326 17.182 -7.228 555 HO2' A 43 HO2' A 43 -4.636 18.880 -8.605 556 H1' A 43 H1' A 43 -4.041 15.540 -8.918 557 H8 A 43 H8 A 43 -2.831 14.679 -5.301 558 H61 A 43 H61 A 43 -8.141 11.539 -4.866 559 H62 A 43 H62 A 43 -6.596 11.875 -4.097 560 H2 A 43 H2 A 43 -8.228 13.781 -8.688 561 H5' U 44 H5' U 44 -5.999 20.074 -3.297 562 H5'' U 44 H5'' U 44 -4.309 19.547 -3.161 563 H4' U 44 H4' U 44 -5.590 18.358 -1.515 564 H3' U 44 H3' U 44 -4.027 17.082 -3.464 565 HO3' U 44 HO3' U 44 -4.090 15.495 -1.619 566 H2' U 44 H2' U 44 -5.583 15.790 -4.505 567 HO2' U 44 HO2' U 44 -4.897 14.090 -3.358 568 H1' U 44 H1' U 44 -7.560 15.704 -2.341 569 H3 U 44 H3 U 44 -10.902 15.139 -5.377 570 H5 U 44 H5 U 44 -7.866 17.090 -7.564 571 H6 U 44 H6 U 44 -6.588 17.221 -5.569 572 H1 MET 1 H1 MET 1 0.090 -12.938 5.261 573 H2 MET 1 H2 MET 1 0.980 -11.560 5.092 574 H3 MET 1 H3 MET 1 1.069 -12.747 3.951 575 HA MET 1 HA MET 1 -0.247 -10.918 3.160 576 HB2 MET 1 HB2 MET 1 -0.774 -13.257 2.431 577 HB3 MET 1 HB3 MET 1 -1.900 -13.397 3.795 578 HG2 MET 1 HG2 MET 1 -3.173 -12.860 1.824 579 HG3 MET 1 HG3 MET 1 -3.189 -11.458 2.886 580 HE1 MET 1 HE1 MET 1 -3.773 -9.578 1.360 581 HE2 MET 1 HE2 MET 1 -3.349 -9.555 -0.371 582 HE3 MET 1 HE3 MET 1 -4.270 -10.925 0.317 583 H LEU 2 H LEU 2 -1.705 -9.268 3.615 584 HA LEU 2 HA LEU 2 -3.509 -9.630 5.932 585 HB2 LEU 2 HB2 LEU 2 -1.235 -7.746 5.671 586 HB3 LEU 2 HB3 LEU 2 -2.770 -6.972 6.111 587 HG LEU 2 HG LEU 2 -1.475 -9.280 7.590 588 HD11 LEU 2 HD11 LEU 2 -1.066 -7.592 9.332 589 HD12 LEU 2 HD12 LEU 2 -0.273 -7.138 7.805 590 HD13 LEU 2 HD13 LEU 2 -1.780 -6.328 8.296 591 HD21 LEU 2 HD21 LEU 2 -3.947 -7.580 8.204 592 HD22 LEU 2 HD22 LEU 2 -3.936 -9.328 7.861 593 HD23 LEU 2 HD23 LEU 2 -3.178 -8.717 9.340 594 H ILE 3 H ILE 3 -5.380 -8.319 5.843 595 HA ILE 3 HA ILE 3 -5.786 -6.704 3.386 596 HB ILE 3 HB ILE 3 -7.710 -8.830 4.440 597 HG12 ILE 3 HG12 ILE 3 -7.413 -9.519 1.917 598 HG13 ILE 3 HG13 ILE 3 -5.861 -8.680 2.042 599 HG21 ILE 3 HG21 ILE 3 -7.919 -6.956 2.045 600 HG22 ILE 3 HG22 ILE 3 -9.062 -8.233 2.482 601 HG23 ILE 3 HG23 ILE 3 -8.871 -6.826 3.552 602 HD11 ILE 3 HD11 ILE 3 -6.842 -11.000 3.766 603 HD12 ILE 3 HD12 ILE 3 -5.652 -11.108 2.447 604 HD13 ILE 3 HD13 ILE 3 -5.239 -10.237 3.927 605 H LEU 4 H LEU 4 -7.297 -5.003 3.698 606 HA LEU 4 HA LEU 4 -8.246 -4.464 6.454 607 HB2 LEU 4 HB2 LEU 4 -6.358 -2.706 4.836 608 HB3 LEU 4 HB3 LEU 4 -7.217 -2.178 6.283 609 HG LEU 4 HG LEU 4 -5.159 -4.429 6.221 610 HD11 LEU 4 HD11 LEU 4 -3.775 -2.705 7.406 611 HD12 LEU 4 HD12 LEU 4 -4.177 -2.259 5.732 612 HD13 LEU 4 HD13 LEU 4 -5.057 -1.507 7.080 613 HD21 LEU 4 HD21 LEU 4 -6.774 -4.726 8.052 614 HD22 LEU 4 HD22 LEU 4 -5.240 -4.135 8.699 615 HD23 LEU 4 HD23 LEU 4 -6.606 -3.010 8.503 616 H THR 5 H THR 5 -9.654 -2.497 6.491 617 HA THR 5 HA THR 5 -10.584 -1.676 3.794 618 HB THR 5 HB THR 5 -12.670 -2.027 5.936 619 HG1 THR 5 HG1 THR 5 -11.799 -4.056 5.836 620 HG21 THR 5 HG21 THR 5 -12.568 -2.127 2.901 621 HG22 THR 5 HG22 THR 5 -14.035 -2.364 3.887 622 HG23 THR 5 HG23 THR 5 -13.190 -0.800 3.911 623 H ARG 6 H ARG 6 -9.616 0.250 3.874 624 HA ARG 6 HA ARG 6 -10.157 2.102 6.139 625 HB2 ARG 6 HB2 ARG 6 -8.209 2.065 3.796 626 HB3 ARG 6 HB3 ARG 6 -8.364 3.450 4.878 627 HG2 ARG 6 HG2 ARG 6 -7.987 0.821 6.243 628 HG3 ARG 6 HG3 ARG 6 -6.624 1.371 5.262 629 HD2 ARG 6 HD2 ARG 6 -6.416 2.142 7.571 630 HD3 ARG 6 HD3 ARG 6 -6.540 3.496 6.437 631 HE ARG 6 HE ARG 6 -9.145 3.135 7.200 632 HH11 ARG 6 HH11 ARG 6 -6.118 3.636 8.952 633 HH12 ARG 6 HH12 ARG 6 -6.900 4.368 10.333 634 HH21 ARG 6 HH21 ARG 6 -10.144 4.054 9.044 635 HH22 ARG 6 HH22 ARG 6 -9.162 4.638 10.367 636 H LYS 7 H LYS 7 -10.297 4.521 5.149 637 HA LYS 7 HA LYS 7 -11.926 4.446 2.675 638 HB2 LYS 7 HB2 LYS 7 -13.465 6.130 3.498 639 HB3 LYS 7 HB3 LYS 7 -13.609 4.678 4.457 640 HG2 LYS 7 HG2 LYS 7 -12.246 5.734 6.255 641 HG3 LYS 7 HG3 LYS 7 -11.997 7.164 5.230 642 HD2 LYS 7 HD2 LYS 7 -14.528 7.374 5.075 643 HD3 LYS 7 HD3 LYS 7 -14.642 6.138 6.332 644 HE2 LYS 7 HE2 LYS 7 -13.232 8.833 6.545 645 HE3 LYS 7 HE3 LYS 7 -14.801 8.425 7.249 646 HZ1 LYS 7 HZ1 LYS 7 -12.200 7.249 7.991 647 HZ2 LYS 7 HZ2 LYS 7 -13.123 8.248 8.896 648 HZ3 LYS 7 HZ3 LYS 7 -13.664 6.731 8.565 649 H VAL 8 H VAL 8 -12.250 6.886 1.918 650 HA VAL 8 HA VAL 8 -9.600 7.634 1.236 651 HB VAL 8 HB VAL 8 -10.532 9.455 0.026 652 HG11 VAL 8 HG11 VAL 8 -12.463 7.084 -0.023 653 HG12 VAL 8 HG12 VAL 8 -12.171 8.227 -1.342 654 HG13 VAL 8 HG13 VAL 8 -10.871 7.126 -0.813 655 HG21 VAL 8 HG21 VAL 8 -13.163 8.953 1.462 656 HG22 VAL 8 HG22 VAL 8 -12.135 10.405 1.604 657 HG23 VAL 8 HG23 VAL 8 -12.899 10.019 0.049 658 H GLY 9 H GLY 9 -8.159 8.986 1.981 659 HA2 GLY 9 HA2 GLY 9 -7.395 10.927 3.118 660 HA3 GLY 9 HA3 GLY 9 -8.869 10.924 4.108 661 H GLU 10 H GLU 10 -8.123 7.750 4.170 662 HA GLU 10 HA GLU 10 -6.783 7.998 6.775 663 HB2 GLU 10 HB2 GLU 10 -7.838 5.579 5.268 664 HB3 GLU 10 HB3 GLU 10 -7.276 5.576 6.939 665 HG2 GLU 10 HG2 GLU 10 -9.622 7.234 5.916 666 HG3 GLU 10 HG3 GLU 10 -9.771 5.646 6.674 667 H SER 11 H SER 11 -5.232 5.960 7.186 668 HA SER 11 HA SER 11 -3.270 5.701 4.991 669 HB2 SER 11 HB2 SER 11 -2.658 6.907 7.712 670 HB3 SER 11 HB3 SER 11 -1.438 6.422 6.521 671 HG SER 11 HG SER 11 -1.985 8.657 6.414 672 H ILE 12 H ILE 12 -1.424 4.315 5.679 673 HA ILE 12 HA ILE 12 -1.982 2.230 7.699 674 HB ILE 12 HB ILE 12 -1.483 1.582 4.766 675 HG12 ILE 12 HG12 ILE 12 -4.105 1.414 6.299 676 HG13 ILE 12 HG13 ILE 12 -3.727 2.576 5.008 677 HG21 ILE 12 HG21 ILE 12 -0.680 -0.137 6.353 678 HG22 ILE 12 HG22 ILE 12 -2.302 -0.201 7.098 679 HG23 ILE 12 HG23 ILE 12 -2.044 -0.728 5.423 680 HD11 ILE 12 HD11 ILE 12 -3.973 -0.428 4.700 681 HD12 ILE 12 HD12 ILE 12 -5.033 0.820 4.035 682 HD13 ILE 12 HD13 ILE 12 -3.361 0.672 3.437 683 H ASN 13 H ASN 13 0.112 0.804 7.879 684 HA ASN 13 HA ASN 13 2.476 2.332 6.899 685 HB2 ASN 13 HB2 ASN 13 1.666 2.590 9.516 686 HB3 ASN 13 HB3 ASN 13 2.697 1.169 9.622 687 HD21 ASN 13 HD22 ASN 13 2.477 4.591 9.100 688 HD22 ASN 13 HD21 ASN 13 4.186 4.939 8.924 689 H ILE 14 H ILE 14 4.426 1.170 6.748 690 HA ILE 14 HA ILE 14 4.340 -1.763 7.116 691 HB ILE 14 HB ILE 14 5.245 -0.421 4.534 692 HG12 ILE 14 HG12 ILE 14 2.741 -2.080 5.095 693 HG13 ILE 14 HG13 ILE 14 2.784 -0.348 4.722 694 HG21 ILE 14 HG21 ILE 14 5.498 -2.738 3.722 695 HG22 ILE 14 HG22 ILE 14 6.475 -2.491 5.171 696 HG23 ILE 14 HG23 ILE 14 4.934 -3.365 5.289 697 HD11 ILE 14 HD11 ILE 14 3.585 -2.616 2.855 698 HD12 ILE 14 HD12 ILE 14 2.174 -1.552 2.719 699 HD13 ILE 14 HD13 ILE 14 3.809 -0.885 2.503 700 H GLY 15 H GLY 15 6.372 -2.613 7.624 701 HA2 GLY 15 HA2 GLY 15 8.454 -2.512 8.624 702 HA3 GLY 15 HA3 GLY 15 8.860 -1.347 7.347 703 H ASP 16 H ASP 16 10.006 0.119 8.533 704 HA ASP 16 HA ASP 16 8.406 1.742 10.442 705 HB2 ASP 16 HB2 ASP 16 9.975 0.282 11.666 706 HB3 ASP 16 HB3 ASP 16 11.316 0.935 10.718 707 H ASP 17 H ASP 17 9.479 1.680 7.452 708 HA ASP 17 HA ASP 17 10.241 4.544 7.425 709 HB2 ASP 17 HB2 ASP 17 11.694 2.402 5.813 710 HB3 ASP 17 HB3 ASP 17 12.007 4.133 5.802 711 H ILE 18 H ILE 18 7.908 2.443 6.517 712 HA ILE 18 HA ILE 18 7.493 3.917 3.965 713 HB ILE 18 HB ILE 18 6.836 0.985 4.435 714 HG12 ILE 18 HG12 ILE 18 8.490 0.940 2.310 715 HG13 ILE 18 HG13 ILE 18 9.199 2.326 3.158 716 HG21 ILE 18 HG21 ILE 18 6.498 2.820 2.031 717 HG22 ILE 18 HG22 ILE 18 6.277 1.056 1.998 718 HG23 ILE 18 HG23 ILE 18 5.211 2.063 2.988 719 HD11 ILE 18 HD11 ILE 18 9.438 0.940 5.205 720 HD12 ILE 18 HD12 ILE 18 8.623 -0.404 4.380 721 HD13 ILE 18 HD13 ILE 18 10.226 0.147 3.820 722 H THR 19 H THR 19 5.432 4.620 3.607 723 HA THR 19 HA THR 19 3.281 3.837 5.512 724 HB THR 19 HB THR 19 3.959 6.699 4.731 725 HG1 THR 19 HG1 THR 19 4.633 6.893 6.870 726 HG21 THR 19 HG21 THR 19 1.973 5.548 6.736 727 HG22 THR 19 HG22 THR 19 2.360 7.276 6.547 728 HG23 THR 19 HG23 THR 19 1.574 6.405 5.222 729 H ILE 20 H ILE 20 1.147 4.299 4.640 730 HA ILE 20 HA ILE 20 1.058 4.665 1.680 731 HB ILE 20 HB ILE 20 -0.399 2.569 3.329 732 HG12 ILE 20 HG12 ILE 20 1.992 1.996 2.989 733 HG13 ILE 20 HG13 ILE 20 0.874 0.878 2.214 734 HG21 ILE 20 HG21 ILE 20 -0.467 3.187 0.351 735 HG22 ILE 20 HG22 ILE 20 -1.154 1.724 1.094 736 HG23 ILE 20 HG23 ILE 20 -1.810 3.317 1.512 737 HD11 ILE 20 HD11 ILE 20 2.839 1.449 0.772 738 HD12 ILE 20 HD12 ILE 20 1.285 1.880 0.025 739 HD13 ILE 20 HD13 ILE 20 2.306 3.143 0.750 740 H THR 21 H THR 21 -0.855 5.647 0.951 741 HA THR 21 HA THR 21 -2.825 6.514 2.996 742 HB THR 21 HB THR 21 -1.384 8.430 1.115 743 HG1 THR 21 HG1 THR 21 -1.155 8.071 3.917 744 HG21 THR 21 HG21 THR 21 -3.312 8.936 3.420 745 HG22 THR 21 HG22 THR 21 -2.503 10.179 2.441 746 HG23 THR 21 HG23 THR 21 -3.705 9.109 1.692 747 H ILE 22 H ILE 22 -4.856 6.840 2.158 748 HA ILE 22 HA ILE 22 -5.217 6.212 -0.729 749 HB ILE 22 HB ILE 22 -6.304 4.574 0.539 750 HG12 ILE 22 HG12 ILE 22 -8.707 4.926 0.243 751 HG13 ILE 22 HG13 ILE 22 -8.448 6.666 0.016 752 HG21 ILE 22 HG21 ILE 22 -7.394 6.753 2.353 753 HG22 ILE 22 HG22 ILE 22 -7.814 5.025 2.435 754 HG23 ILE 22 HG23 ILE 22 -6.157 5.539 2.769 755 HD11 ILE 22 HD11 ILE 22 -8.741 5.536 -2.122 756 HD12 ILE 22 HD12 ILE 22 -7.112 6.239 -1.981 757 HD13 ILE 22 HD13 ILE 22 -7.346 4.480 -1.766 758 H LEU 23 H LEU 23 -5.164 8.172 -1.809 759 HA LEU 23 HA LEU 23 -5.913 10.594 -0.438 760 HB2 LEU 23 HB2 LEU 23 -5.606 10.261 -3.426 761 HB3 LEU 23 HB3 LEU 23 -5.430 11.731 -2.466 762 HG LEU 23 HG LEU 23 -3.512 9.397 -2.683 763 HD11 LEU 23 HD11 LEU 23 -3.404 12.396 -3.191 764 HD12 LEU 23 HD12 LEU 23 -2.001 11.307 -3.337 765 HD13 LEU 23 HD13 LEU 23 -3.397 11.119 -4.428 766 HD21 LEU 23 HD21 LEU 23 -3.539 10.084 -0.295 767 HD22 LEU 23 HD22 LEU 23 -2.038 10.562 -1.131 768 HD23 LEU 23 HD23 LEU 23 -3.283 11.781 -0.800 769 H GLY 24 H GLY 24 -7.639 8.330 -2.587 770 HA2 GLY 24 HA2 GLY 24 -10.181 8.997 -1.852 771 HA3 GLY 24 HA3 GLY 24 -9.844 10.211 -3.069 772 H VAL 25 H VAL 25 -11.827 8.964 -3.939 773 HA VAL 25 HA VAL 25 -10.846 6.838 -5.782 774 HB VAL 25 HB VAL 25 -12.819 5.538 -5.489 775 HG11 VAL 25 HG11 VAL 25 -11.863 6.332 -2.710 776 HG12 VAL 25 HG12 VAL 25 -12.640 4.806 -3.179 777 HG13 VAL 25 HG13 VAL 25 -11.026 5.195 -3.802 778 HG21 VAL 25 HG21 VAL 25 -14.488 7.267 -5.209 779 HG22 VAL 25 HG22 VAL 25 -14.595 6.131 -3.866 780 HG23 VAL 25 HG23 VAL 25 -13.819 7.706 -3.610 781 H SER 26 H SER 26 -12.191 6.521 -7.677 782 HA SER 26 HA SER 26 -14.196 8.557 -8.349 783 HB2 SER 26 HB2 SER 26 -12.036 9.587 -9.025 784 HB3 SER 26 HB3 SER 26 -11.691 8.163 -10.031 785 HG SER 26 HG SER 26 -12.682 9.876 -11.206 786 H GLY 27 H GLY 27 -15.648 6.787 -8.336 787 HA2 GLY 27 HA2 GLY 27 -16.838 5.095 -9.394 788 HA3 GLY 27 HA3 GLY 27 -15.720 5.227 -10.767 789 H GLN 28 H GLN 28 -14.129 3.664 -11.011 790 HA GLN 28 HA GLN 28 -13.790 1.735 -8.753 791 HB2 GLN 28 HB2 GLN 28 -13.033 1.411 -11.691 792 HB3 GLN 28 HB3 GLN 28 -12.880 0.197 -10.418 793 HG2 GLN 28 HG2 GLN 28 -15.386 1.266 -11.705 794 HG3 GLN 28 HG3 GLN 28 -14.771 -0.407 -11.613 795 HE21 GLN 28 HE22 GLN 28 -14.338 -1.005 -9.064 796 HE22 GLN 28 HE21 GLN 28 -15.719 -0.687 -8.036 797 H GLN 29 H GLN 29 -12.254 4.231 -10.652 798 HA GLN 29 HA GLN 29 -9.538 3.400 -10.141 799 HB2 GLN 29 HB2 GLN 29 -10.816 6.073 -10.856 800 HB3 GLN 29 HB3 GLN 29 -9.085 5.867 -10.624 801 HG2 GLN 29 HG2 GLN 29 -10.760 4.290 -12.618 802 HG3 GLN 29 HG3 GLN 29 -9.748 5.683 -13.018 803 HE21 GLN 29 HE22 GLN 29 -9.535 2.966 -14.056 804 HE22 GLN 29 HE21 GLN 29 -7.928 2.395 -13.624 805 H VAL 30 H VAL 30 -8.116 4.146 -8.595 806 HA VAL 30 HA VAL 30 -9.269 5.494 -6.217 807 HB VAL 30 HB VAL 30 -7.670 2.887 -6.169 808 HG11 VAL 30 HG11 VAL 30 -7.313 4.456 -4.238 809 HG12 VAL 30 HG12 VAL 30 -9.063 4.404 -3.941 810 HG13 VAL 30 HG13 VAL 30 -8.085 2.917 -3.791 811 HG21 VAL 30 HG21 VAL 30 -9.948 2.427 -6.900 812 HG22 VAL 30 HG22 VAL 30 -9.747 1.908 -5.216 813 HG23 VAL 30 HG23 VAL 30 -10.611 3.421 -5.575 814 H ARG 31 H ARG 31 -8.029 7.242 -5.942 815 HA ARG 31 HA ARG 31 -5.276 7.364 -6.940 816 HB2 ARG 31 HB2 ARG 31 -7.323 9.200 -5.784 817 HB3 ARG 31 HB3 ARG 31 -5.642 9.583 -5.370 818 HG2 ARG 31 HG2 ARG 31 -6.467 9.081 -8.247 819 HG3 ARG 31 HG3 ARG 31 -6.602 10.674 -7.484 820 HD2 ARG 31 HD2 ARG 31 -4.191 10.536 -6.831 821 HD3 ARG 31 HD3 ARG 31 -4.049 9.046 -7.779 822 HE ARG 31 HE ARG 31 -4.889 10.530 -9.729 823 HH11 ARG 31 HH11 ARG 31 -2.874 11.734 -7.070 824 HH12 ARG 31 HH12 ARG 31 -2.145 12.982 -8.036 825 HH21 ARG 31 HH21 ARG 31 -3.981 12.194 -10.935 826 HH22 ARG 31 HH22 ARG 31 -2.769 13.252 -10.234 827 H ILE 32 H ILE 32 -3.669 6.483 -5.831 828 HA ILE 32 HA ILE 32 -3.898 6.301 -2.854 829 HB ILE 32 HB ILE 32 -2.434 4.292 -4.594 830 HG12 ILE 32 HG12 ILE 32 -5.351 4.282 -3.766 831 HG13 ILE 32 HG13 ILE 32 -4.663 4.179 -5.403 832 HG21 ILE 32 HG21 ILE 32 -3.593 4.120 -1.780 833 HG22 ILE 32 HG22 ILE 32 -2.619 2.879 -2.600 834 HG23 ILE 32 HG23 ILE 32 -1.876 4.414 -2.169 835 HD11 ILE 32 HD11 ILE 32 -4.495 2.055 -3.230 836 HD12 ILE 32 HD12 ILE 32 -5.436 1.989 -4.729 837 HD13 ILE 32 HD13 ILE 32 -3.656 1.977 -4.801 838 H GLY 33 H GLY 33 -1.933 6.502 -1.701 839 HA2 GLY 33 HA2 GLY 33 0.366 7.597 -3.253 840 HA3 GLY 33 HA3 GLY 33 -0.206 8.351 -1.757 841 H ILE 34 H ILE 34 2.395 7.327 -2.245 842 HA ILE 34 HA ILE 34 2.629 5.215 -0.169 843 HB ILE 34 HB ILE 34 4.006 5.205 -2.898 844 HG12 ILE 34 HG12 ILE 34 1.938 3.238 -1.832 845 HG13 ILE 34 HG13 ILE 34 1.581 4.543 -2.979 846 HG21 ILE 34 HG21 ILE 34 4.123 3.215 -0.589 847 HG22 ILE 34 HG22 ILE 34 4.935 3.020 -2.155 848 HG23 ILE 34 HG23 ILE 34 5.427 4.326 -1.079 849 HD11 ILE 34 HD11 ILE 34 3.474 2.217 -3.456 850 HD12 ILE 34 HD12 ILE 34 1.902 2.511 -4.229 851 HD13 ILE 34 HD13 ILE 34 3.261 3.609 -4.549 852 H ASN 35 H ASN 35 4.419 5.537 1.125 853 HA ASN 35 HA ASN 35 6.184 7.810 0.361 854 HB2 ASN 35 HB2 ASN 35 4.279 8.558 1.787 855 HB3 ASN 35 HB3 ASN 35 4.802 7.437 3.043 856 HD21 ASN 35 HD22 ASN 35 4.621 9.950 3.852 857 HD22 ASN 35 HD21 ASN 35 6.180 10.744 3.949 858 H ALA 36 H ALA 36 7.938 6.597 -0.028 859 HA ALA 36 HA ALA 36 9.257 5.403 2.338 860 HB1 ALA 36 HB1 ALA 36 10.067 3.526 0.921 861 HB2 ALA 36 HB2 ALA 36 8.292 3.481 1.103 862 HB3 ALA 36 HB3 ALA 36 9.034 4.081 -0.403 863 HA PRO 37 HA PRO 37 12.653 7.716 0.738 864 HB2 PRO 37 HB2 PRO 37 14.759 6.030 1.397 865 HB3 PRO 37 HB3 PRO 37 13.940 7.149 2.539 866 HG2 PRO 37 HG2 PRO 37 13.534 4.175 2.182 867 HG3 PRO 37 HG3 PRO 37 13.570 5.122 3.694 868 HD2 PRO 37 HD2 PRO 37 11.251 4.327 2.503 869 HD3 PRO 37 HD3 PRO 37 11.373 5.889 3.371 870 H LYS 38 H LYS 38 14.053 7.760 -1.100 871 HA LYS 38 HA LYS 38 13.397 6.000 -3.259 872 HB2 LYS 38 HB2 LYS 38 15.467 8.139 -2.740 873 HB3 LYS 38 HB3 LYS 38 15.601 7.115 -4.175 874 HG2 LYS 38 HG2 LYS 38 14.438 9.125 -4.706 875 HG3 LYS 38 HG3 LYS 38 13.382 7.716 -4.922 876 HD2 LYS 38 HD2 LYS 38 12.076 9.536 -3.980 877 HD3 LYS 38 HD3 LYS 38 12.219 8.312 -2.761 878 HE2 LYS 38 HE2 LYS 38 14.171 9.652 -1.804 879 HE3 LYS 38 HE3 LYS 38 13.875 10.850 -3.084 880 HZ1 LYS 38 HZ1 LYS 38 11.941 10.085 -0.997 881 HZ2 LYS 38 HZ2 LYS 38 12.823 11.472 -1.022 882 HZ3 LYS 38 HZ3 LYS 38 11.687 11.210 -2.173 883 H ASP 39 H ASP 39 15.294 5.599 -0.613 884 HA ASP 39 HA ASP 39 17.411 3.869 -1.473 885 HB2 ASP 39 HB2 ASP 39 15.891 4.190 1.138 886 HB3 ASP 39 HB3 ASP 39 17.224 3.058 0.963 887 H VAL 40 H VAL 40 14.031 3.348 -1.554 888 HA VAL 40 HA VAL 40 14.490 0.431 -1.918 889 HB VAL 40 HB VAL 40 12.389 -0.070 -0.778 890 HG11 VAL 40 HG11 VAL 40 14.096 1.791 0.942 891 HG12 VAL 40 HG12 VAL 40 13.003 0.520 1.536 892 HG13 VAL 40 HG13 VAL 40 14.459 0.076 0.620 893 HG21 VAL 40 HG21 VAL 40 11.244 2.076 -1.353 894 HG22 VAL 40 HG22 VAL 40 11.061 1.563 0.342 895 HG23 VAL 40 HG23 VAL 40 12.215 2.854 -0.056 896 H ALA 41 H ALA 41 12.486 -0.510 -3.161 897 HA ALA 41 HA ALA 41 12.029 1.454 -5.342 898 HB1 ALA 41 HB1 ALA 41 13.301 -0.604 -5.895 899 HB2 ALA 41 HB2 ALA 41 11.934 -1.595 -5.342 900 HB3 ALA 41 HB3 ALA 41 11.751 -0.552 -6.766 901 H VAL 42 H VAL 42 10.015 1.588 -6.411 902 HA VAL 42 HA VAL 42 7.749 0.014 -5.519 903 HB VAL 42 HB VAL 42 7.442 1.473 -3.740 904 HG11 VAL 42 HG11 VAL 42 8.445 3.704 -5.535 905 HG12 VAL 42 HG12 VAL 42 7.701 3.971 -3.933 906 HG13 VAL 42 HG13 VAL 42 9.202 3.040 -4.068 907 HG21 VAL 42 HG21 VAL 42 5.991 2.900 -6.008 908 HG22 VAL 42 HG22 VAL 42 5.419 1.434 -5.169 909 HG23 VAL 42 HG23 VAL 42 5.595 2.967 -4.284 910 H HIS 43 H HIS 43 6.416 -0.268 -7.176 911 HA HIS 43 HA HIS 43 6.014 1.746 -9.270 912 HB2 HIS 43 HB2 HIS 43 6.905 -0.996 -10.165 913 HB3 HIS 43 HB3 HIS 43 6.856 0.510 -11.074 914 HD2 HIS 43 HD2 HIS 43 9.010 -1.447 -8.548 915 HE1 HIS 43 HE1 HIS 43 11.478 1.633 -10.123 916 HE2 HIS 43 HE2 HIS 43 11.431 -0.451 -8.672 917 H ARG 44 H ARG 44 4.323 0.771 -10.934 918 HA ARG 44 HA ARG 44 2.474 -0.939 -9.422 919 HB2 ARG 44 HB2 ARG 44 0.932 -0.642 -11.215 920 HB3 ARG 44 HB3 ARG 44 1.619 0.932 -10.811 921 HG2 ARG 44 HG2 ARG 44 3.076 0.823 -12.804 922 HG3 ARG 44 HG3 ARG 44 2.450 -0.814 -13.168 923 HD2 ARG 44 HD2 ARG 44 0.134 0.154 -13.210 924 HD3 ARG 44 HD3 ARG 44 0.837 1.770 -13.022 925 HE ARG 44 HE ARG 44 2.097 0.622 -15.254 926 HH11 ARG 44 HH11 ARG 44 -1.200 1.487 -14.273 927 HH12 ARG 44 HH12 ARG 44 -1.703 1.863 -15.907 928 HH21 ARG 44 HH21 ARG 44 1.374 1.054 -17.367 929 HH22 ARG 44 HH22 ARG 44 -0.261 1.614 -17.648 930 H GLU 45 H GLU 45 1.566 -2.958 -10.584 931 HA GLU 45 HA GLU 45 3.765 -4.716 -10.743 932 HB2 GLU 45 HB2 GLU 45 2.046 -6.385 -11.608 933 HB3 GLU 45 HB3 GLU 45 1.787 -5.663 -10.018 934 HG2 GLU 45 HG2 GLU 45 -0.299 -5.802 -11.244 935 HG3 GLU 45 HG3 GLU 45 0.126 -4.130 -10.908 936 H GLU 46 H GLU 46 2.400 -2.774 -13.328 937 HA GLU 46 HA GLU 46 3.199 -4.465 -15.489 938 HB2 GLU 46 HB2 GLU 46 1.637 -2.554 -15.697 939 HB3 GLU 46 HB3 GLU 46 2.964 -1.431 -15.300 940 HG2 GLU 46 HG2 GLU 46 4.186 -2.187 -17.323 941 HG3 GLU 46 HG3 GLU 46 2.864 -3.309 -17.702 942 H ILE 47 H ILE 47 4.870 -1.863 -13.663 943 HA ILE 47 HA ILE 47 7.278 -2.103 -15.324 944 HB ILE 47 HB ILE 47 6.459 -0.485 -12.893 945 HG12 ILE 47 HG12 ILE 47 6.884 1.435 -14.372 946 HG13 ILE 47 HG13 ILE 47 7.411 0.351 -15.666 947 HG21 ILE 47 HG21 ILE 47 8.672 0.658 -13.057 948 HG22 ILE 47 HG22 ILE 47 8.816 -1.026 -12.533 949 HG23 ILE 47 HG23 ILE 47 9.206 -0.582 -14.211 950 HD11 ILE 47 HD11 ILE 47 5.182 -0.539 -15.934 951 HD12 ILE 47 HD12 ILE 47 4.604 0.349 -14.499 952 HD13 ILE 47 HD13 ILE 47 5.096 1.228 -15.965 953 H TYR 48 H TYR 48 6.020 -3.381 -12.257 954 HA TYR 48 HA TYR 48 8.529 -4.178 -11.163 955 HB2 TYR 48 HB2 TYR 48 6.327 -4.075 -9.966 956 HB3 TYR 48 HB3 TYR 48 5.826 -5.524 -10.854 957 HD1 TYR 48 HD1 TYR 48 8.164 -4.176 -8.314 958 HD2 TYR 48 HD2 TYR 48 6.713 -7.707 -10.299 959 HE1 TYR 48 HE1 TYR 48 9.277 -5.579 -6.607 960 HE2 TYR 48 HE2 TYR 48 7.788 -9.124 -8.578 961 HH TYR 48 HH TYR 48 9.078 -9.162 -6.663 962 H GLN 49 H GLN 49 6.362 -5.685 -13.550 963 HA GLN 49 HA GLN 49 7.578 -8.272 -13.526 964 HB2 GLN 49 HB2 GLN 49 5.803 -6.773 -15.468 965 HB3 GLN 49 HB3 GLN 49 6.363 -8.437 -15.780 966 HG2 GLN 49 HG2 GLN 49 5.334 -9.253 -13.755 967 HG3 GLN 49 HG3 GLN 49 4.983 -7.618 -13.198 968 HE21 GLN 49 HE22 GLN 49 3.005 -6.808 -13.608 969 HE22 GLN 49 HE21 GLN 49 1.839 -7.463 -14.733 970 H ARG 50 H ARG 50 8.731 -5.272 -14.824 971 HA ARG 50 HA ARG 50 10.483 -6.592 -16.802 972 HB2 ARG 50 HB2 ARG 50 9.993 -3.756 -15.843 973 HB3 ARG 50 HB3 ARG 50 11.490 -4.149 -16.685 974 HG2 ARG 50 HG2 ARG 50 9.926 -3.342 -18.311 975 HG3 ARG 50 HG3 ARG 50 10.167 -5.072 -18.585 976 HD2 ARG 50 HD2 ARG 50 8.038 -5.534 -17.382 977 HD3 ARG 50 HD3 ARG 50 7.817 -3.777 -17.147 978 HE ARG 50 HE ARG 50 8.244 -4.234 -19.902 979 HH11 ARG 50 HH11 ARG 50 5.768 -4.921 -17.470 980 HH12 ARG 50 HH12 ARG 50 4.497 -5.111 -18.660 981 HH21 ARG 50 HH21 ARG 50 6.552 -4.387 -21.403 982 HH22 ARG 50 HH22 ARG 50 4.924 -4.737 -20.867 983 H ILE 51 H ILE 51 10.568 -5.830 -13.409 984 HA ILE 51 HA ILE 51 13.454 -5.298 -13.354 985 HB ILE 51 HB ILE 51 11.142 -5.164 -11.438 986 HG12 ILE 51 HG12 ILE 51 13.104 -3.034 -12.388 987 HG13 ILE 51 HG13 ILE 51 11.651 -3.456 -13.313 988 HG21 ILE 51 HG21 ILE 51 14.098 -4.729 -10.841 989 HG22 ILE 51 HG22 ILE 51 12.749 -4.211 -9.790 990 HG23 ILE 51 HG23 ILE 51 13.004 -5.934 -10.106 991 HD11 ILE 51 HD11 ILE 51 11.663 -2.479 -10.443 992 HD12 ILE 51 HD12 ILE 51 11.156 -1.562 -11.891 993 HD13 ILE 51 HD13 ILE 51 10.230 -2.990 -11.382 994 H GLN 52 H GLN 52 11.336 -7.553 -11.450 995 HA GLN 52 HA GLN 52 13.506 -9.040 -10.407 996 HB2 GLN 52 HB2 GLN 52 11.650 -10.832 -10.101 997 HB3 GLN 52 HB3 GLN 52 11.507 -9.297 -9.245 998 HG2 GLN 52 HG2 GLN 52 9.394 -10.213 -10.382 999 HG3 GLN 52 HG3 GLN 52 9.798 -8.509 -10.633 1000 HE21 GLN 52 HE22 GLN 52 10.235 -7.732 -12.659 1001 HE22 GLN 52 HE21 GLN 52 10.226 -8.685 -14.107 1002 H ALA 53 H ALA 53 12.652 -8.853 -13.634 1003 HA ALA 53 HA ALA 53 12.967 -11.557 -14.449 1004 HB1 ALA 53 HB1 ALA 53 11.950 -9.768 -15.821 1005 HB2 ALA 53 HB2 ALA 53 13.523 -8.950 -15.922 1006 HB3 ALA 53 HB3 ALA 53 13.301 -10.546 -16.676 1007 H GLY 54 H GLY 54 15.220 -9.285 -13.164 1008 HA2 GLY 54 HA2 GLY 54 17.338 -10.850 -12.732 1009 HA3 GLY 54 HA3 GLY 54 17.565 -10.510 -14.461 1010 H LEU 55 H LEU 55 16.142 -8.107 -12.225 1011 HA LEU 55 HA LEU 55 18.600 -6.455 -12.618 1012 HB2 LEU 55 HB2 LEU 55 15.736 -5.489 -12.801 1013 HB3 LEU 55 HB3 LEU 55 17.200 -4.568 -13.163 1014 HG LEU 55 HG LEU 55 16.339 -7.048 -14.727 1015 HD11 LEU 55 HD11 LEU 55 15.929 -4.094 -15.342 1016 HD12 LEU 55 HD12 LEU 55 15.549 -5.458 -16.423 1017 HD13 LEU 55 HD13 LEU 55 14.668 -5.269 -14.891 1018 HD21 LEU 55 HD21 LEU 55 18.335 -4.815 -15.324 1019 HD22 LEU 55 HD22 LEU 55 18.761 -6.479 -14.866 1020 HD23 LEU 55 HD23 LEU 55 17.920 -6.171 -16.402 1021 H THR 56 H THR 56 16.578 -7.834 -10.298 1022 HA THR 56 HA THR 56 16.332 -5.611 -8.482 1023 HB THR 56 HB THR 56 15.913 -7.476 -6.799 1024 HG1 THR 56 HG1 THR 56 15.701 -9.534 -7.706 1025 HG21 THR 56 HG21 THR 56 14.349 -7.469 -9.405 1026 HG22 THR 56 HG22 THR 56 13.762 -8.131 -7.863 1027 HG23 THR 56 HG23 THR 56 14.081 -6.392 -8.007 1028 H ALA 57 H ALA 57 19.035 -7.410 -9.503 1029 HA ALA 57 HA ALA 57 20.676 -6.386 -7.304 1030 HB1 ALA 57 HB1 ALA 57 19.909 -8.542 -6.410 1031 HB2 ALA 57 HB2 ALA 57 20.443 -9.365 -7.895 1032 HB3 ALA 57 HB3 ALA 57 21.638 -8.611 -6.815 1033 HA PRO 58 HA PRO 58 22.465 -6.007 -11.582 1034 HB2 PRO 58 HB2 PRO 58 23.735 -3.783 -9.982 1035 HB3 PRO 58 HB3 PRO 58 23.213 -3.783 -11.697 1036 HG2 PRO 58 HG2 PRO 58 21.665 -2.635 -9.804 1037 HG3 PRO 58 HG3 PRO 58 20.902 -3.693 -11.043 1038 HD2 PRO 58 HD2 PRO 58 21.652 -4.388 -8.192 1039 HD3 PRO 58 HD3 PRO 58 20.155 -4.769 -9.095 1040 H ASP 59 H ASP 59 24.850 -5.639 -12.179 1041 HA ASP 59 HA ASP 59 26.359 -7.823 -11.260 1042 HB2 ASP 59 HB2 ASP 59 26.482 -6.551 -13.457 1043 HB3 ASP 59 HB3 ASP 59 27.366 -5.289 -12.611 1044 H5' U 36 H5' U 36 -17.084 -5.318 8.274 1045 H5'' U 36 H5'' U 36 -18.090 -6.726 8.659 1046 H4' U 36 H4' U 36 -16.103 -7.998 9.346 1047 H3' U 36 H3' U 36 -14.782 -5.651 9.826 1048 H2' U 36 H2' U 36 -14.941 -4.827 7.638 1049 HO2' U 36 HO2' U 36 -12.706 -4.863 8.226 1050 H1' U 36 H1' U 36 -14.046 -7.524 6.596 1051 H3 U 36 H3 U 36 -15.438 -7.321 2.299 1052 H5 U 36 H5 U 36 -16.172 -3.472 3.818 1053 H6 U 36 H6 U 36 -15.635 -4.281 6.008 1054 HO5' U 36 HO5' U 36 -18.049 -5.243 10.388 1055 H5' C 37 H5' C 37 -14.293 -6.471 13.308 1056 H5'' C 37 H5'' C 37 -14.672 -5.493 11.873 1057 H4' C 37 H4' C 37 -12.155 -5.048 13.517 1058 H3' C 37 H3' C 37 -14.615 -4.725 14.688 1059 H2' C 37 H2' C 37 -15.577 -3.452 12.996 1060 HO2' C 37 HO2' C 37 -14.330 -1.614 14.771 1061 H1' C 37 H1' C 37 -13.104 -1.753 12.709 1062 H41 C 37 H41 C 37 -16.030 -0.131 7.305 1063 H42 C 37 H42 C 37 -17.021 -1.580 7.321 1064 H5 C 37 H5 C 37 -16.810 -3.296 9.051 1065 H6 C 37 H6 C 37 -15.616 -3.929 11.074 1066 H5' A 38 H5' A 38 -11.562 -6.517 14.910 1067 H5'' A 38 H5'' A 38 -10.711 -6.562 16.466 1068 H4' A 38 H4' A 38 -9.214 -7.358 14.751 1069 H3' A 38 H3' A 38 -8.383 -5.427 16.483 1070 H2' A 38 H2' A 38 -9.143 -3.574 15.141 1071 HO2' A 38 HO2' A 38 -6.433 -4.107 14.481 1072 H1' A 38 H1' A 38 -7.846 -4.908 12.761 1073 H8 A 38 H8 A 38 -10.274 -2.294 14.053 1074 H61 A 38 H61 A 38 -11.237 -0.906 8.082 1075 H62 A 38 H62 A 38 -11.518 -0.419 9.745 1076 H2 A 38 H2 A 38 -8.976 -4.750 8.281 1077 H5' G 39 H5' G 39 -8.083 -8.244 13.319 1078 H5'' G 39 H5'' G 39 -7.913 -9.688 14.337 1079 H4' G 39 H4' G 39 -7.705 -10.557 12.204 1080 H3' G 39 H3' G 39 -5.490 -10.849 13.706 1081 H2' G 39 H2' G 39 -4.381 -8.845 13.147 1082 HO2' G 39 HO2' G 39 -3.606 -10.722 11.176 1083 H1' G 39 H1' G 39 -4.994 -8.836 10.244 1084 H8 G 39 H8 G 39 -7.228 -6.422 11.266 1085 H1 G 39 H1 G 39 -1.369 -4.170 12.606 1086 H21 G 39 H21 G 39 0.084 -5.801 12.598 1087 H22 G 39 H22 G 39 -0.359 -7.460 12.265 1088 H5' G 40 H5' G 40 -4.365 -11.856 9.282 1089 H5'' G 40 H5'' G 40 -4.009 -13.588 9.293 1090 H4' G 40 H4' G 40 -2.613 -12.379 7.699 1091 H3' G 40 H3' G 40 -1.658 -14.278 9.576 1092 H2' G 40 H2' G 40 -0.509 -12.542 10.806 1093 HO2' G 40 HO2' G 40 1.206 -13.436 8.714 1094 H1' G 40 H1' G 40 0.024 -11.335 8.067 1095 H8 G 40 H8 G 40 -0.902 -9.939 11.588 1096 H1 G 40 H1 G 40 4.687 -7.888 9.192 1097 H21 G 40 H21 G 40 5.100 -8.903 7.257 1098 H22 G 40 H22 G 40 3.972 -10.039 6.557 1099 H5' A 41 H5' A 41 -2.811 -15.134 5.028 1100 H5'' A 41 H5'' A 41 -3.024 -13.711 6.071 1101 H4' A 41 H4' A 41 -4.851 -16.130 6.279 1102 H3' A 41 H3' A 41 -4.835 -13.887 4.275 1103 H2' A 41 H2' A 41 -7.113 -13.442 4.599 1104 HO2' A 41 HO2' A 41 -7.753 -15.636 4.265 1105 H1' A 41 H1' A 41 -7.315 -14.355 7.278 1106 H8 A 41 H8 A 41 -5.182 -11.599 5.512 1107 H61 A 41 H61 A 41 -8.626 -7.716 8.954 1108 H62 A 41 H62 A 41 -7.381 -7.793 7.716 1109 H2 A 41 H2 A 41 -9.829 -11.855 9.918 1110 H5' C 42 H5' C 42 -6.150 -13.724 0.269 1111 H5'' C 42 H5'' C 42 -5.502 -12.977 1.736 1112 H4' C 42 H4' C 42 -7.630 -12.181 2.440 1113 H3' C 42 H3' C 42 -8.918 -14.147 1.268 1114 H2' C 42 H2' C 42 -7.764 -13.800 -0.868 1115 HO2' C 42 HO2' C 42 -9.461 -13.136 -2.285 1116 H1' C 42 H1' C 42 -8.766 -10.953 -0.745 1117 H41 C 42 H41 C 42 -5.032 -10.870 -5.945 1118 H42 C 42 H42 C 42 -3.661 -11.442 -5.011 1119 H5 C 42 H5 C 42 -3.839 -12.082 -2.658 1120 H6 C 42 H6 C 42 -5.384 -12.233 -0.760 1121 H5' A 43 H5' A 43 -11.012 -15.328 2.200 1122 H5'' A 43 H5'' A 43 -10.765 -14.374 0.740 1123 H4' A 43 H4' A 43 -12.925 -16.149 1.187 1124 H3' A 43 H3' A 43 -11.715 -14.491 -0.915 1125 H2' A 43 H2' A 43 -13.605 -13.565 -1.916 1126 HO2' A 43 HO2' A 43 -14.721 -15.591 -2.159 1127 H1' A 43 H1' A 43 -15.238 -13.244 0.185 1128 H8 A 43 H8 A 43 -11.338 -12.504 -0.257 1129 H61 A 43 H61 A 43 -13.282 -6.656 0.116 1130 H62 A 43 H62 A 43 -11.940 -7.701 -0.326 1131 H2 A 43 H2 A 43 -16.635 -9.263 1.364 1132 H5' U 44 H5' U 44 -13.409 -15.186 -5.674 1133 H5'' U 44 H5'' U 44 -11.724 -15.530 -5.256 1134 H4' U 44 H4' U 44 -11.719 -13.240 -5.872 1135 H3' U 44 H3' U 44 -11.852 -13.486 -2.865 1136 HO3' U 44 HO3' U 44 -9.976 -14.215 -3.897 1137 H2' U 44 H2' U 44 -11.853 -11.138 -2.722 1138 HO2' U 44 HO2' U 44 -10.041 -10.851 -4.097 1139 H1' U 44 H1' U 44 -13.060 -10.658 -5.210 1140 H3 U 44 H3 U 44 -15.609 -8.355 -2.194 1141 H5 U 44 H5 U 44 -16.972 -12.330 -2.046 1142 H6 U 44 H6 U 44 -15.061 -12.980 -3.355 Start of MODEL 18 1 H1 MET 1 H1 MET 1 8.569 8.960 -2.228 2 H2 MET 1 H2 MET 1 8.421 10.014 -0.971 3 H3 MET 1 H3 MET 1 8.574 10.584 -2.503 4 HA MET 1 HA MET 1 6.308 9.029 -1.475 5 HB2 MET 1 HB2 MET 1 6.342 11.353 -0.630 6 HB3 MET 1 HB3 MET 1 6.561 11.955 -2.283 7 HG2 MET 1 HG2 MET 1 4.282 12.277 -1.725 8 HG3 MET 1 HG3 MET 1 4.335 10.965 -2.894 9 HE1 MET 1 HE1 MET 1 1.891 11.885 -1.104 10 HE2 MET 1 HE2 MET 1 1.802 10.579 -2.297 11 HE3 MET 1 HE3 MET 1 1.205 10.304 -0.639 12 H LEU 2 H LEU 2 4.795 8.326 -2.954 13 HA LEU 2 HA LEU 2 5.070 9.250 -5.754 14 HB2 LEU 2 HB2 LEU 2 5.572 6.531 -4.686 15 HB3 LEU 2 HB3 LEU 2 4.386 6.570 -5.998 16 HG LEU 2 HG LEU 2 7.193 7.704 -6.127 17 HD11 LEU 2 HD11 LEU 2 7.090 5.244 -6.071 18 HD12 LEU 2 HD12 LEU 2 5.919 5.250 -7.412 19 HD13 LEU 2 HD13 LEU 2 7.594 5.828 -7.667 20 HD21 LEU 2 HD21 LEU 2 4.970 7.478 -8.224 21 HD22 LEU 2 HD22 LEU 2 5.710 8.983 -7.626 22 HD23 LEU 2 HD23 LEU 2 6.670 7.864 -8.595 23 H ILE 3 H ILE 3 3.110 8.971 -6.959 24 HA ILE 3 HA ILE 3 0.691 8.273 -5.362 25 HB ILE 3 HB ILE 3 1.099 10.722 -7.130 26 HG12 ILE 3 HG12 ILE 3 0.014 11.700 -4.930 27 HG13 ILE 3 HG13 ILE 3 0.673 10.243 -4.170 28 HG21 ILE 3 HG21 ILE 3 -1.269 11.204 -6.597 29 HG22 ILE 3 HG22 ILE 3 -1.101 9.747 -7.597 30 HG23 ILE 3 HG23 ILE 3 -1.421 9.595 -5.854 31 HD11 ILE 3 HD11 ILE 3 2.148 12.438 -5.678 32 HD12 ILE 3 HD12 ILE 3 2.244 12.109 -3.933 33 HD13 ILE 3 HD13 ILE 3 2.949 10.952 -5.058 34 H LEU 4 H LEU 4 -0.991 7.369 -6.572 35 HA LEU 4 HA LEU 4 -0.519 6.673 -9.412 36 HB2 LEU 4 HB2 LEU 4 -0.861 4.675 -7.136 37 HB3 LEU 4 HB3 LEU 4 -0.914 4.255 -8.847 38 HG LEU 4 HG LEU 4 1.525 5.409 -7.428 39 HD11 LEU 4 HD11 LEU 4 0.877 3.183 -6.619 40 HD12 LEU 4 HD12 LEU 4 0.707 2.622 -8.294 41 HD13 LEU 4 HD13 LEU 4 2.322 3.048 -7.659 42 HD21 LEU 4 HD21 LEU 4 1.130 4.179 -10.195 43 HD22 LEU 4 HD22 LEU 4 1.504 5.890 -9.860 44 HD23 LEU 4 HD23 LEU 4 2.694 4.633 -9.483 45 H THR 5 H THR 5 -2.441 5.531 -10.331 46 HA THR 5 HA THR 5 -4.840 5.623 -8.595 47 HB THR 5 HB THR 5 -5.123 6.462 -11.481 48 HG1 THR 5 HG1 THR 5 -3.656 7.922 -10.430 49 HG21 THR 5 HG21 THR 5 -6.664 7.019 -8.923 50 HG22 THR 5 HG22 THR 5 -7.148 7.456 -10.585 51 HG23 THR 5 HG23 THR 5 -7.057 5.744 -10.104 52 H ARG 6 H ARG 6 -5.090 3.525 -8.327 53 HA ARG 6 HA ARG 6 -5.175 1.683 -10.693 54 HB2 ARG 6 HB2 ARG 6 -4.891 1.312 -7.671 55 HB3 ARG 6 HB3 ARG 6 -5.130 -0.047 -8.771 56 HG2 ARG 6 HG2 ARG 6 -2.846 1.853 -9.300 57 HG3 ARG 6 HG3 ARG 6 -2.701 0.662 -7.995 58 HD2 ARG 6 HD2 ARG 6 -1.800 -0.226 -10.146 59 HD3 ARG 6 HD3 ARG 6 -3.135 -1.176 -9.498 60 HE ARG 6 HE ARG 6 -4.504 -0.509 -11.256 61 HH11 ARG 6 HH11 ARG 6 -1.446 1.266 -11.390 62 HH12 ARG 6 HH12 ARG 6 -1.745 1.864 -13.009 63 HH21 ARG 6 HH21 ARG 6 -4.841 0.245 -13.330 64 HH22 ARG 6 HH22 ARG 6 -3.680 1.301 -14.112 65 H LYS 7 H LYS 7 -6.804 0.036 -10.687 66 HA LYS 7 HA LYS 7 -9.337 0.978 -9.422 67 HB2 LYS 7 HB2 LYS 7 -8.961 -0.448 -12.076 68 HB3 LYS 7 HB3 LYS 7 -10.521 -0.071 -11.285 69 HG2 LYS 7 HG2 LYS 7 -10.210 2.270 -11.497 70 HG3 LYS 7 HG3 LYS 7 -8.551 2.050 -12.103 71 HD2 LYS 7 HD2 LYS 7 -9.903 2.432 -14.038 72 HD3 LYS 7 HD3 LYS 7 -9.580 0.677 -13.990 73 HE2 LYS 7 HE2 LYS 7 -11.793 0.311 -12.943 74 HE3 LYS 7 HE3 LYS 7 -12.114 2.054 -13.049 75 HZ1 LYS 7 HZ1 LYS 7 -13.077 0.855 -14.895 76 HZ2 LYS 7 HZ2 LYS 7 -11.924 1.888 -15.433 77 HZ3 LYS 7 HZ3 LYS 7 -11.607 0.277 -15.344 78 H VAL 8 H VAL 8 -10.938 -0.877 -9.252 79 HA VAL 8 HA VAL 8 -9.708 -2.617 -7.360 80 HB VAL 8 HB VAL 8 -11.837 -3.603 -7.001 81 HG11 VAL 8 HG11 VAL 8 -12.145 -0.628 -7.648 82 HG12 VAL 8 HG12 VAL 8 -13.119 -1.565 -6.501 83 HG13 VAL 8 HG13 VAL 8 -11.395 -1.292 -6.178 84 HG21 VAL 8 HG21 VAL 8 -12.834 -2.179 -9.492 85 HG22 VAL 8 HG22 VAL 8 -12.678 -3.944 -9.270 86 HG23 VAL 8 HG23 VAL 8 -13.824 -3.037 -8.272 87 H GLY 9 H GLY 9 -8.821 -4.521 -7.439 88 HA2 GLY 9 HA2 GLY 9 -8.665 -6.774 -8.220 89 HA3 GLY 9 HA3 GLY 9 -9.271 -6.275 -9.805 90 H GLU 10 H GLU 10 -7.025 -3.931 -8.874 91 HA GLU 10 HA GLU 10 -4.905 -5.302 -10.458 92 HB2 GLU 10 HB2 GLU 10 -5.411 -2.352 -9.934 93 HB3 GLU 10 HB3 GLU 10 -4.092 -3.017 -10.914 94 HG2 GLU 10 HG2 GLU 10 -5.780 -4.123 -12.389 95 HG3 GLU 10 HG3 GLU 10 -7.071 -3.319 -11.483 96 H SER 11 H SER 11 -2.617 -4.166 -9.853 97 HA SER 11 HA SER 11 -2.295 -4.235 -6.903 98 HB2 SER 11 HB2 SER 11 -0.918 -6.117 -8.857 99 HB3 SER 11 HB3 SER 11 -0.515 -5.955 -7.136 100 HG SER 11 HG SER 11 -1.978 -7.688 -7.593 101 H ILE 12 H ILE 12 -0.056 -3.859 -6.261 102 HA ILE 12 HA ILE 12 1.680 -2.273 -8.056 103 HB ILE 12 HB ILE 12 0.487 -1.339 -5.407 104 HG12 ILE 12 HG12 ILE 12 -1.039 -0.999 -7.308 105 HG13 ILE 12 HG13 ILE 12 -0.464 0.527 -6.660 106 HG21 ILE 12 HG21 ILE 12 2.675 -0.058 -7.094 107 HG22 ILE 12 HG22 ILE 12 1.775 0.784 -5.825 108 HG23 ILE 12 HG23 ILE 12 2.780 -0.602 -5.404 109 HD11 ILE 12 HD11 ILE 12 -0.411 0.701 -9.042 110 HD12 ILE 12 HD12 ILE 12 1.274 0.607 -8.494 111 HD13 ILE 12 HD13 ILE 12 0.490 -0.821 -9.213 112 H ASN 13 H ASN 13 3.856 -1.896 -6.768 113 HA ASN 13 HA ASN 13 4.289 -4.133 -4.850 114 HB2 ASN 13 HB2 ASN 13 5.801 -3.660 -7.440 115 HB3 ASN 13 HB3 ASN 13 6.367 -4.720 -6.144 116 HD21 ASN 13 HD22 ASN 13 5.506 -6.763 -5.897 117 HD22 ASN 13 HD21 ASN 13 4.292 -7.423 -6.976 118 H ILE 14 H ILE 14 6.221 -4.031 -3.643 119 HA ILE 14 HA ILE 14 7.737 -1.493 -3.671 120 HB ILE 14 HB ILE 14 6.464 -2.681 -1.171 121 HG12 ILE 14 HG12 ILE 14 5.789 -0.134 -2.700 122 HG13 ILE 14 HG13 ILE 14 4.775 -1.586 -2.591 123 HG21 ILE 14 HG21 ILE 14 7.366 -0.703 -0.033 124 HG22 ILE 14 HG22 ILE 14 8.678 -1.595 -0.794 125 HG23 ILE 14 HG23 ILE 14 8.060 -0.118 -1.561 126 HD11 ILE 14 HD11 ILE 14 5.514 0.269 -0.297 127 HD12 ILE 14 HD12 ILE 14 3.929 0.065 -1.054 128 HD13 ILE 14 HD13 ILE 14 4.627 -1.273 -0.121 129 H GLY 15 H GLY 15 9.846 -1.725 -2.836 130 HA2 GLY 15 HA2 GLY 15 11.837 -2.846 -2.549 131 HA3 GLY 15 HA3 GLY 15 10.917 -3.886 -1.446 132 H ASP 16 H ASP 16 11.801 -5.842 -1.979 133 HA ASP 16 HA ASP 16 11.207 -6.861 -4.711 134 HB2 ASP 16 HB2 ASP 16 13.667 -7.411 -3.007 135 HB3 ASP 16 HB3 ASP 16 13.261 -8.248 -4.517 136 H ASP 17 H ASP 17 10.106 -6.906 -1.722 137 HA ASP 17 HA ASP 17 9.397 -9.775 -1.801 138 HB2 ASP 17 HB2 ASP 17 10.431 -8.371 0.699 139 HB3 ASP 17 HB3 ASP 17 9.838 -10.026 0.595 140 H ILE 18 H ILE 18 8.146 -6.773 -2.016 141 HA ILE 18 HA ILE 18 5.812 -7.531 -0.328 142 HB ILE 18 HB ILE 18 6.915 -4.713 -0.663 143 HG12 ILE 18 HG12 ILE 18 6.954 -5.131 1.993 144 HG13 ILE 18 HG13 ILE 18 7.270 -6.790 1.473 145 HG21 ILE 18 HG21 ILE 18 4.569 -5.829 0.922 146 HG22 ILE 18 HG22 ILE 18 5.196 -4.163 1.036 147 HG23 ILE 18 HG23 ILE 18 4.482 -4.727 -0.478 148 HD11 ILE 18 HD11 ILE 18 8.818 -4.307 0.611 149 HD12 ILE 18 HD12 ILE 18 9.358 -5.492 1.820 150 HD13 ILE 18 HD13 ILE 18 9.202 -5.973 0.115 151 H THR 19 H THR 19 3.821 -7.068 -1.127 152 HA THR 19 HA THR 19 3.557 -5.749 -3.767 153 HB THR 19 HB THR 19 2.368 -8.468 -3.053 154 HG1 THR 19 HG1 THR 19 3.799 -9.240 -4.604 155 HG21 THR 19 HG21 THR 19 2.265 -6.802 -5.602 156 HG22 THR 19 HG22 THR 19 1.754 -8.505 -5.480 157 HG23 THR 19 HG23 THR 19 0.893 -7.257 -4.573 158 H ILE 20 H ILE 20 1.340 -5.069 -4.147 159 HA ILE 20 HA ILE 20 -0.383 -4.881 -1.723 160 HB ILE 20 HB ILE 20 0.441 -2.620 -3.584 161 HG12 ILE 20 HG12 ILE 20 2.212 -3.218 -1.944 162 HG13 ILE 20 HG13 ILE 20 1.567 -1.589 -1.730 163 HG21 ILE 20 HG21 ILE 20 -1.473 -2.661 -1.221 164 HG22 ILE 20 HG22 ILE 20 -0.869 -1.183 -2.002 165 HG23 ILE 20 HG23 ILE 20 -1.863 -2.324 -2.922 166 HD11 ILE 20 HD11 ILE 20 0.708 -4.006 -0.076 167 HD12 ILE 20 HD12 ILE 20 1.895 -2.788 0.427 168 HD13 ILE 20 HD13 ILE 20 0.206 -2.316 0.166 169 H THR 21 H THR 21 -2.608 -4.770 -2.231 170 HA THR 21 HA THR 21 -3.359 -4.852 -5.105 171 HB THR 21 HB THR 21 -4.204 -6.960 -3.078 172 HG1 THR 21 HG1 THR 21 -2.417 -7.113 -5.270 173 HG21 THR 21 HG21 THR 21 -5.119 -8.115 -5.053 174 HG22 THR 21 HG22 THR 21 -5.881 -6.525 -4.852 175 HG23 THR 21 HG23 THR 21 -4.628 -6.761 -6.094 176 H ILE 22 H ILE 22 -5.445 -4.148 -5.510 177 HA ILE 22 HA ILE 22 -6.890 -2.937 -3.206 178 HB ILE 22 HB ILE 22 -6.260 -1.226 -4.654 179 HG12 ILE 22 HG12 ILE 22 -8.278 -0.357 -5.660 180 HG13 ILE 22 HG13 ILE 22 -9.029 -1.961 -5.670 181 HG21 ILE 22 HG21 ILE 22 -6.608 -1.248 -7.105 182 HG22 ILE 22 HG22 ILE 22 -5.438 -2.455 -6.558 183 HG23 ILE 22 HG23 ILE 22 -7.086 -2.962 -7.005 184 HD11 ILE 22 HD11 ILE 22 -9.023 -2.049 -3.245 185 HD12 ILE 22 HD12 ILE 22 -8.215 -0.458 -3.164 186 HD13 ILE 22 HD13 ILE 22 -9.869 -0.598 -3.817 187 H LEU 23 H LEU 23 -8.132 -4.583 -2.478 188 HA LEU 23 HA LEU 23 -9.193 -6.615 -4.187 189 HB2 LEU 23 HB2 LEU 23 -10.153 -5.897 -1.401 190 HB3 LEU 23 HB3 LEU 23 -10.289 -7.455 -2.230 191 HG LEU 23 HG LEU 23 -7.756 -6.153 -1.156 192 HD11 LEU 23 HD11 LEU 23 -9.195 -8.766 -0.537 193 HD12 LEU 23 HD12 LEU 23 -7.679 -8.219 0.210 194 HD13 LEU 23 HD13 LEU 23 -9.191 -7.325 0.498 195 HD21 LEU 23 HD21 LEU 23 -8.035 -8.747 -2.709 196 HD22 LEU 23 HD22 LEU 23 -7.185 -7.282 -3.270 197 HD23 LEU 23 HD23 LEU 23 -6.573 -8.185 -1.864 198 H GLY 24 H GLY 24 -10.488 -3.481 -3.138 199 HA2 GLY 24 HA2 GLY 24 -12.256 -3.103 -5.138 200 HA3 GLY 24 HA3 GLY 24 -13.209 -4.138 -4.089 201 H VAL 25 H VAL 25 -14.568 -2.031 -4.219 202 HA VAL 25 HA VAL 25 -13.844 -0.363 -1.868 203 HB VAL 25 HB VAL 25 -14.492 1.655 -2.940 204 HG11 VAL 25 HG11 VAL 25 -12.178 0.876 -3.422 205 HG12 VAL 25 HG12 VAL 25 -12.766 0.149 -4.940 206 HG13 VAL 25 HG13 VAL 25 -12.848 1.909 -4.710 207 HG21 VAL 25 HG21 VAL 25 -15.219 1.770 -5.301 208 HG22 VAL 25 HG22 VAL 25 -15.284 -0.009 -5.355 209 HG23 VAL 25 HG23 VAL 25 -16.367 0.900 -4.271 210 H SER 26 H SER 26 -15.667 0.799 -0.946 211 HA SER 26 HA SER 26 -18.387 -0.092 -1.628 212 HB2 SER 26 HB2 SER 26 -17.116 -0.579 1.101 213 HB3 SER 26 HB3 SER 26 -18.842 -0.759 0.715 214 HG SER 26 HG SER 26 -18.232 -2.356 -0.811 215 H GLY 27 H GLY 27 -18.721 2.118 -2.181 216 HA2 GLY 27 HA2 GLY 27 -19.455 4.256 -1.660 217 HA3 GLY 27 HA3 GLY 27 -19.334 3.848 0.064 218 H GLN 28 H GLN 28 -17.584 4.612 1.242 219 HA GLN 28 HA GLN 28 -15.403 5.931 -0.321 220 HB2 GLN 28 HB2 GLN 28 -16.210 6.288 2.599 221 HB3 GLN 28 HB3 GLN 28 -14.880 7.113 1.771 222 HG2 GLN 28 HG2 GLN 28 -17.846 7.452 1.341 223 HG3 GLN 28 HG3 GLN 28 -16.641 8.645 1.871 224 HE21 GLN 28 HE22 GLN 28 -14.673 8.748 0.123 225 HE22 GLN 28 HE21 GLN 28 -15.218 8.941 -1.532 226 H GLN 29 H GLN 29 -16.231 3.272 1.780 227 HA GLN 29 HA GLN 29 -13.576 2.808 2.783 228 HB2 GLN 29 HB2 GLN 29 -16.001 1.015 2.383 229 HB3 GLN 29 HB3 GLN 29 -14.473 0.426 3.037 230 HG2 GLN 29 HG2 GLN 29 -16.050 2.750 4.225 231 HG3 GLN 29 HG3 GLN 29 -16.138 1.081 4.801 232 HE21 GLN 29 HE22 GLN 29 -15.266 3.416 6.315 233 HE22 GLN 29 HE21 GLN 29 -13.603 3.109 6.794 234 H VAL 30 H VAL 30 -12.021 1.419 2.040 235 HA VAL 30 HA VAL 30 -12.214 0.418 -0.748 236 HB VAL 30 HB VAL 30 -9.969 2.097 0.474 237 HG11 VAL 30 HG11 VAL 30 -10.231 0.929 -2.321 238 HG12 VAL 30 HG12 VAL 30 -8.883 1.903 -1.692 239 HG13 VAL 30 HG13 VAL 30 -9.177 0.272 -1.042 240 HG21 VAL 30 HG21 VAL 30 -10.515 3.682 -1.374 241 HG22 VAL 30 HG22 VAL 30 -11.907 2.670 -1.816 242 HG23 VAL 30 HG23 VAL 30 -11.860 3.494 -0.236 243 H ARG 31 H ARG 31 -11.895 -1.714 -0.561 244 HA ARG 31 HA ARG 31 -10.571 -2.801 1.821 245 HB2 ARG 31 HB2 ARG 31 -12.703 -3.727 0.805 246 HB3 ARG 31 HB3 ARG 31 -11.746 -4.237 -0.598 247 HG2 ARG 31 HG2 ARG 31 -10.278 -5.561 0.950 248 HG3 ARG 31 HG3 ARG 31 -11.312 -5.068 2.310 249 HD2 ARG 31 HD2 ARG 31 -13.258 -6.119 1.219 250 HD3 ARG 31 HD3 ARG 31 -12.232 -6.621 -0.139 251 HE ARG 31 HE ARG 31 -11.734 -7.519 2.681 252 HH11 ARG 31 HH11 ARG 31 -12.216 -8.291 -0.747 253 HH12 ARG 31 HH12 ARG 31 -11.702 -9.951 -0.552 254 HH21 ARG 31 HH21 ARG 31 -11.133 -9.709 2.890 255 HH22 ARG 31 HH22 ARG 31 -11.162 -10.759 1.491 256 H ILE 32 H ILE 32 -8.485 -3.488 1.848 257 HA ILE 32 HA ILE 32 -6.994 -3.471 -0.734 258 HB ILE 32 HB ILE 32 -5.949 -2.197 1.812 259 HG12 ILE 32 HG12 ILE 32 -7.573 -0.900 -0.405 260 HG13 ILE 32 HG13 ILE 32 -7.918 -0.948 1.332 261 HG21 ILE 32 HG21 ILE 32 -5.200 -1.849 -1.124 262 HG22 ILE 32 HG22 ILE 32 -4.375 -1.102 0.269 263 HG23 ILE 32 HG23 ILE 32 -4.305 -2.846 0.048 264 HD11 ILE 32 HD11 ILE 32 -5.664 0.581 -0.017 265 HD12 ILE 32 HD12 ILE 32 -7.099 1.252 0.768 266 HD13 ILE 32 HD13 ILE 32 -5.865 0.415 1.749 267 H GLY 33 H GLY 33 -5.002 -4.670 -0.674 268 HA2 GLY 33 HA2 GLY 33 -4.710 -6.501 1.662 269 HA3 GLY 33 HA3 GLY 33 -4.673 -7.111 -0.004 270 H ILE 34 H ILE 34 -2.588 -7.307 1.955 271 HA ILE 34 HA ILE 34 -0.382 -5.868 0.574 272 HB ILE 34 HB ILE 34 -0.793 -6.038 3.591 273 HG12 ILE 34 HG12 ILE 34 -0.852 -3.569 1.809 274 HG13 ILE 34 HG13 ILE 34 -2.288 -4.373 2.475 275 HG21 ILE 34 HG21 ILE 34 1.406 -4.735 1.918 276 HG22 ILE 34 HG22 ILE 34 1.276 -4.643 3.688 277 HG23 ILE 34 HG23 ILE 34 1.578 -6.199 2.907 278 HD11 ILE 34 HD11 ILE 34 -0.065 -3.083 4.104 279 HD12 ILE 34 HD12 ILE 34 -1.732 -2.504 3.891 280 HD13 ILE 34 HD13 ILE 34 -1.423 -4.021 4.768 281 H ASN 35 H ASN 35 1.391 -7.160 0.324 282 HA ASN 35 HA ASN 35 1.250 -9.829 1.624 283 HB2 ASN 35 HB2 ASN 35 0.214 -9.780 -0.662 284 HB3 ASN 35 HB3 ASN 35 1.782 -9.315 -1.323 285 HD21 ASN 35 HD22 ASN 35 0.439 -11.648 -2.140 286 HD22 ASN 35 HD21 ASN 35 1.302 -13.056 -1.560 287 H ALA 36 H ALA 36 2.878 -9.515 2.976 288 HA ALA 36 HA ALA 36 5.606 -9.443 1.824 289 HB1 ALA 36 HB1 ALA 36 5.161 -7.117 2.552 290 HB2 ALA 36 HB2 ALA 36 4.639 -7.713 4.143 291 HB3 ALA 36 HB3 ALA 36 6.326 -7.919 3.641 292 HA PRO 37 HA PRO 37 6.091 -12.725 4.740 293 HB2 PRO 37 HB2 PRO 37 8.720 -12.297 5.537 294 HB3 PRO 37 HB3 PRO 37 8.242 -13.100 3.996 295 HG2 PRO 37 HG2 PRO 37 9.084 -10.229 4.466 296 HG3 PRO 37 HG3 PRO 37 9.547 -11.327 3.129 297 HD2 PRO 37 HD2 PRO 37 7.605 -9.451 2.844 298 HD3 PRO 37 HD3 PRO 37 7.465 -11.073 2.077 299 H LYS 38 H LYS 38 6.102 -13.056 7.031 300 HA LYS 38 HA LYS 38 5.413 -10.795 8.654 301 HB2 LYS 38 HB2 LYS 38 6.038 -13.717 9.130 302 HB3 LYS 38 HB3 LYS 38 5.939 -12.610 10.504 303 HG2 LYS 38 HG2 LYS 38 3.843 -13.614 10.177 304 HG3 LYS 38 HG3 LYS 38 3.697 -11.887 9.812 305 HD2 LYS 38 HD2 LYS 38 2.359 -13.006 8.155 306 HD3 LYS 38 HD3 LYS 38 3.773 -12.506 7.327 307 HE2 LYS 38 HE2 LYS 38 3.250 -14.782 6.711 308 HE3 LYS 38 HE3 LYS 38 4.732 -14.849 7.691 309 HZ1 LYS 38 HZ1 LYS 38 1.987 -15.423 8.597 310 HZ2 LYS 38 HZ2 LYS 38 3.178 -16.523 8.357 311 HZ3 LYS 38 HZ3 LYS 38 3.307 -15.417 9.577 312 H ASP 39 H ASP 39 8.225 -11.728 7.410 313 HA ASP 39 HA ASP 39 10.241 -11.093 9.321 314 HB2 ASP 39 HB2 ASP 39 10.372 -12.153 6.946 315 HB3 ASP 39 HB3 ASP 39 10.367 -10.502 6.347 316 H VAL 40 H VAL 40 7.888 -9.065 7.831 317 HA VAL 40 HA VAL 40 9.347 -6.635 8.724 318 HB VAL 40 HB VAL 40 8.609 -5.409 6.785 319 HG11 VAL 40 HG11 VAL 40 9.718 -8.099 5.865 320 HG12 VAL 40 HG12 VAL 40 9.826 -6.561 4.983 321 HG13 VAL 40 HG13 VAL 40 10.694 -6.767 6.523 322 HG21 VAL 40 HG21 VAL 40 6.421 -6.557 6.487 323 HG22 VAL 40 HG22 VAL 40 7.336 -6.353 4.979 324 HG23 VAL 40 HG23 VAL 40 7.300 -7.940 5.772 325 H ALA 41 H ALA 41 7.715 -4.760 8.984 326 HA ALA 41 HA ALA 41 5.376 -5.939 10.382 327 HB1 ALA 41 HB1 ALA 41 5.348 -3.813 11.617 328 HB2 ALA 41 HB2 ALA 41 6.960 -4.555 11.702 329 HB3 ALA 41 HB3 ALA 41 6.662 -3.185 10.604 330 H VAL 42 H VAL 42 3.280 -5.084 10.133 331 HA VAL 42 HA VAL 42 2.788 -2.819 8.393 332 HB VAL 42 HB VAL 42 2.890 -4.242 6.558 333 HG11 VAL 42 HG11 VAL 42 1.617 -6.401 8.269 334 HG12 VAL 42 HG12 VAL 42 1.851 -6.528 6.504 335 HG13 VAL 42 HG13 VAL 42 3.257 -6.360 7.568 336 HG21 VAL 42 HG21 VAL 42 -0.001 -4.511 7.463 337 HG22 VAL 42 HG22 VAL 42 0.699 -3.095 6.640 338 HG23 VAL 42 HG23 VAL 42 0.611 -4.668 5.806 339 H HIS 43 H HIS 43 1.074 -1.750 9.110 340 HA HIS 43 HA HIS 43 -1.191 -3.098 10.382 341 HB2 HIS 43 HB2 HIS 43 0.148 -0.905 11.969 342 HB3 HIS 43 HB3 HIS 43 -0.994 -2.135 12.508 343 HD2 HIS 43 HD2 HIS 43 2.747 -1.566 11.802 344 HE1 HIS 43 HE1 HIS 43 2.452 -5.221 13.955 345 HE2 HIS 43 HE2 HIS 43 4.058 -3.467 13.039 346 H ARG 44 H ARG 44 -2.896 -1.300 11.017 347 HA ARG 44 HA ARG 44 -2.845 0.828 9.004 348 HB2 ARG 44 HB2 ARG 44 -4.954 1.534 10.020 349 HB3 ARG 44 HB3 ARG 44 -4.989 -0.185 9.594 350 HG2 ARG 44 HG2 ARG 44 -4.684 -0.851 11.888 351 HG3 ARG 44 HG3 ARG 44 -4.357 0.821 12.400 352 HD2 ARG 44 HD2 ARG 44 -6.985 -0.127 11.190 353 HD3 ARG 44 HD3 ARG 44 -6.686 0.048 12.927 354 HE ARG 44 HE ARG 44 -5.995 2.494 11.648 355 HH11 ARG 44 HH11 ARG 44 -8.895 0.587 12.328 356 HH12 ARG 44 HH12 ARG 44 -9.925 1.992 12.421 357 HH21 ARG 44 HH21 ARG 44 -7.309 4.264 11.780 358 HH22 ARG 44 HH22 ARG 44 -9.026 4.105 12.091 359 H GLU 45 H GLU 45 -3.198 3.170 9.821 360 HA GLU 45 HA GLU 45 -0.848 3.823 11.262 361 HB2 GLU 45 HB2 GLU 45 -1.844 6.160 11.331 362 HB3 GLU 45 HB3 GLU 45 -1.630 5.434 9.745 363 HG2 GLU 45 HG2 GLU 45 -3.738 6.590 9.834 364 HG3 GLU 45 HG3 GLU 45 -4.006 4.857 9.625 365 H GLU 46 H GLU 46 -3.974 2.926 12.523 366 HA GLU 46 HA GLU 46 -3.763 4.402 14.977 367 HB2 GLU 46 HB2 GLU 46 -5.867 3.434 14.092 368 HB3 GLU 46 HB3 GLU 46 -5.209 1.799 14.312 369 HG2 GLU 46 HG2 GLU 46 -5.068 2.184 16.751 370 HG3 GLU 46 HG3 GLU 46 -5.623 3.854 16.528 371 H ILE 47 H ILE 47 -2.888 1.030 14.041 372 HA ILE 47 HA ILE 47 -1.887 0.400 16.694 373 HB ILE 47 HB ILE 47 -1.880 -0.936 13.971 374 HG12 ILE 47 HG12 ILE 47 -3.167 -2.679 15.144 375 HG13 ILE 47 HG13 ILE 47 -2.992 -1.789 16.668 376 HG21 ILE 47 HG21 ILE 47 -0.515 -1.931 16.508 377 HG22 ILE 47 HG22 ILE 47 -0.839 -2.929 15.072 378 HG23 ILE 47 HG23 ILE 47 0.270 -1.552 14.959 379 HD11 ILE 47 HD11 ILE 47 -4.452 -0.740 14.210 380 HD12 ILE 47 HD12 ILE 47 -5.234 -1.512 15.607 381 HD13 ILE 47 HD13 ILE 47 -4.389 0.021 15.826 382 H TYR 48 H TYR 48 -0.565 1.747 13.706 383 HA TYR 48 HA TYR 48 2.180 1.176 14.202 384 HB2 TYR 48 HB2 TYR 48 1.160 1.882 12.048 385 HB3 TYR 48 HB3 TYR 48 0.889 3.491 12.716 386 HD1 TYR 48 HD2 TYR 48 3.589 1.011 11.930 387 HD2 TYR 48 HD1 TYR 48 2.568 5.142 12.615 388 HE1 TYR 48 HE2 TYR 48 5.843 1.694 11.160 389 HE2 TYR 48 HE1 TYR 48 4.795 5.831 11.836 390 HH TYR 48 HH TYR 48 6.838 5.129 10.988 391 H GLN 49 H GLN 49 0.054 3.858 15.243 392 HA GLN 49 HA GLN 49 2.171 5.491 16.288 393 HB2 GLN 49 HB2 GLN 49 -0.832 5.389 16.775 394 HB3 GLN 49 HB3 GLN 49 0.223 6.645 17.458 395 HG2 GLN 49 HG2 GLN 49 0.879 7.418 15.270 396 HG3 GLN 49 HG3 GLN 49 0.110 6.042 14.483 397 HE21 GLN 49 HE22 GLN 49 -1.880 6.373 13.657 398 HE22 GLN 49 HE21 GLN 49 -2.970 7.668 14.077 399 H ARG 50 H ARG 50 0.621 2.626 17.544 400 HA ARG 50 HA ARG 50 1.247 3.188 20.344 401 HB2 ARG 50 HB2 ARG 50 0.352 0.752 18.766 402 HB3 ARG 50 HB3 ARG 50 1.014 0.563 20.382 403 HG2 ARG 50 HG2 ARG 50 -1.387 0.691 20.547 404 HG3 ARG 50 HG3 ARG 50 -0.685 2.147 21.278 405 HD2 ARG 50 HD2 ARG 50 -1.144 3.422 19.238 406 HD3 ARG 50 HD3 ARG 50 -1.779 1.953 18.456 407 HE ARG 50 HE ARG 50 -3.278 2.203 20.777 408 HH11 ARG 50 HH11 ARG 50 -2.689 4.252 17.968 409 HH12 ARG 50 HH12 ARG 50 -4.161 5.177 18.188 410 HH21 ARG 50 HH21 ARG 50 -5.205 3.371 21.011 411 HH22 ARG 50 HH22 ARG 50 -5.612 4.629 19.870 412 H ILE 51 H ILE 51 2.949 2.138 17.532 413 HA ILE 51 HA ILE 51 5.026 0.701 19.085 414 HB ILE 51 HB ILE 51 4.428 0.965 16.122 415 HG12 ILE 51 HG12 ILE 51 4.080 -1.427 17.979 416 HG13 ILE 51 HG13 ILE 51 2.766 -0.313 17.582 417 HG21 ILE 51 HG21 ILE 51 6.370 -0.917 17.528 418 HG22 ILE 51 HG22 ILE 51 6.087 -0.768 15.770 419 HG23 ILE 51 HG23 ILE 51 6.859 0.552 16.659 420 HD11 ILE 51 HD11 ILE 51 4.345 -1.982 15.597 421 HD12 ILE 51 HD12 ILE 51 2.638 -2.214 16.099 422 HD13 ILE 51 HD13 ILE 51 3.104 -0.770 15.174 423 H GLN 52 H GLN 52 4.505 3.581 17.021 424 HA GLN 52 HA GLN 52 7.365 4.158 16.926 425 HB2 GLN 52 HB2 GLN 52 4.958 5.864 16.111 426 HB3 GLN 52 HB3 GLN 52 6.654 6.228 15.754 427 HG2 GLN 52 HG2 GLN 52 4.935 4.022 14.635 428 HG3 GLN 52 HG3 GLN 52 5.962 5.195 13.789 429 HE21 GLN 52 HE22 GLN 52 5.747 2.075 15.241 430 HE22 GLN 52 HE21 GLN 52 7.424 1.603 15.122 431 H ALA 53 H ALA 53 5.291 4.278 19.430 432 HA ALA 53 HA ALA 53 5.946 6.793 20.623 433 HB1 ALA 53 HB1 ALA 53 5.124 4.122 21.832 434 HB2 ALA 53 HB2 ALA 53 5.031 5.708 22.644 435 HB3 ALA 53 HB3 ALA 53 4.020 5.367 21.217 436 H GLY 54 H GLY 54 7.898 4.057 19.927 437 HA2 GLY 54 HA2 GLY 54 10.319 4.719 20.346 438 HA3 GLY 54 HA3 GLY 54 9.860 4.813 22.055 439 H LEU 55 H LEU 55 9.092 2.362 19.462 440 HA LEU 55 HA LEU 55 10.125 0.289 21.353 441 HB2 LEU 55 HB2 LEU 55 7.483 0.247 19.873 442 HB3 LEU 55 HB3 LEU 55 8.051 -0.981 21.002 443 HG LEU 55 HG LEU 55 7.762 1.878 21.970 444 HD11 LEU 55 HD11 LEU 55 5.789 1.473 20.706 445 HD12 LEU 55 HD12 LEU 55 5.536 -0.116 21.470 446 HD13 LEU 55 HD13 LEU 55 5.379 1.377 22.438 447 HD21 LEU 55 HD21 LEU 55 7.272 -0.853 23.244 448 HD22 LEU 55 HD22 LEU 55 8.737 0.134 23.460 449 HD23 LEU 55 HD23 LEU 55 7.168 0.725 24.063 450 H THR 56 H THR 56 10.429 1.453 18.216 451 HA THR 56 HA THR 56 10.123 -1.000 16.740 452 HB THR 56 HB THR 56 11.385 0.234 14.967 453 HG1 THR 56 HG1 THR 56 11.921 2.392 15.445 454 HG21 THR 56 HG21 THR 56 8.917 0.465 15.305 455 HG22 THR 56 HG22 THR 56 9.214 1.882 16.341 456 HG23 THR 56 HG23 THR 56 9.662 1.919 14.618 457 H ALA 57 H ALA 57 12.520 0.039 18.958 458 HA ALA 57 HA ALA 57 14.236 -2.234 18.302 459 HB1 ALA 57 HB1 ALA 57 15.276 0.627 18.159 460 HB2 ALA 57 HB2 ALA 57 16.273 -0.846 18.095 461 HB3 ALA 57 HB3 ALA 57 15.116 -0.501 16.795 462 HA PRO 58 HA PRO 58 13.267 -1.137 22.769 463 HB2 PRO 58 HB2 PRO 58 13.739 -4.126 22.703 464 HB3 PRO 58 HB3 PRO 58 12.622 -3.213 23.754 465 HG2 PRO 58 HG2 PRO 58 11.661 -4.452 21.549 466 HG3 PRO 58 HG3 PRO 58 11.182 -2.740 21.840 467 HD2 PRO 58 HD2 PRO 58 13.335 -3.800 19.992 468 HD3 PRO 58 HD3 PRO 58 12.102 -2.539 19.682 469 H ASP 59 H ASP 59 15.814 -3.228 21.406 470 HA ASP 59 HA ASP 59 17.876 -2.046 23.078 471 HB2 ASP 59 HB2 ASP 59 16.686 -3.531 24.689 472 HB3 ASP 59 HB3 ASP 59 16.918 -4.893 23.606 473 H5' U 36 H5' U 36 -6.485 8.158 -16.892 474 H5'' U 36 H5'' U 36 -7.339 8.359 -15.350 475 H4' U 36 H4' U 36 -5.664 10.536 -16.676 476 H3' U 36 H3' U 36 -4.488 8.295 -15.682 477 H2' U 36 H2' U 36 -5.908 8.260 -13.715 478 HO2' U 36 HO2' U 36 -4.450 8.730 -11.995 479 H1' U 36 H1' U 36 -5.070 11.156 -13.381 480 H3 U 36 H3 U 36 -7.475 12.135 -9.719 481 H5 U 36 H5 U 36 -9.445 8.742 -11.226 482 H6 U 36 H6 U 36 -7.902 8.740 -13.090 483 HO5' U 36 HO5' U 36 -8.462 10.114 -16.327 484 H5' C 37 H5' C 37 -2.018 8.415 -18.652 485 H5'' C 37 H5'' C 37 -3.271 7.746 -17.586 486 H4' C 37 H4' C 37 -0.345 7.038 -17.218 487 H3' C 37 H3' C 37 -1.627 6.483 -19.607 488 H2' C 37 H2' C 37 -3.428 5.309 -18.781 489 HO2' C 37 HO2' C 37 -2.197 3.765 -20.024 490 H1' C 37 H1' C 37 -1.815 3.938 -16.663 491 H41 C 37 H41 C 37 -7.741 2.690 -14.829 492 H42 C 37 H42 C 37 -8.371 4.153 -15.567 493 H5 C 37 H5 C 37 -6.906 5.844 -16.591 494 H6 C 37 H6 C 37 -4.615 6.319 -17.239 495 H5' A 38 H5' A 38 1.408 8.220 -17.446 496 H5'' A 38 H5'' A 38 2.692 8.177 -18.662 497 H4' A 38 H4' A 38 3.793 8.721 -16.660 498 H3' A 38 H3' A 38 4.605 6.510 -18.017 499 H2' A 38 H2' A 38 3.231 4.908 -16.971 500 HO2' A 38 HO2' A 38 5.554 5.106 -15.354 501 H1' A 38 H1' A 38 3.623 5.963 -14.214 502 H8 A 38 H8 A 38 1.537 3.993 -16.568 503 H61 A 38 H61 A 38 -3.062 4.341 -12.426 504 H62 A 38 H62 A 38 -2.499 3.566 -13.893 505 H2 A 38 H2 A 38 0.103 7.244 -11.231 506 H5' G 39 H5' G 39 8.171 9.145 -14.549 507 H5'' G 39 H5'' G 39 7.004 7.934 -13.977 508 H4' G 39 H4' G 39 6.518 10.862 -13.389 509 H3' G 39 H3' G 39 8.911 9.907 -12.730 510 H2' G 39 H2' G 39 8.214 7.770 -12.055 511 HO2' G 39 HO2' G 39 8.331 7.653 -9.801 512 H1' G 39 H1' G 39 5.937 8.768 -10.358 513 H8 G 39 H8 G 39 3.899 7.328 -12.446 514 H1 G 39 H1 G 39 7.724 2.478 -10.699 515 H21 G 39 H21 G 39 9.556 3.243 -9.804 516 H22 G 39 H22 G 39 9.862 4.954 -9.602 517 H5' G 40 H5' G 40 7.372 11.176 -8.534 518 H5'' G 40 H5'' G 40 8.420 12.495 -8.009 519 H4' G 40 H4' G 40 7.878 10.965 -6.177 520 H3' G 40 H3' G 40 10.489 11.912 -6.657 521 H2' G 40 H2' G 40 10.949 9.787 -7.792 522 HO2' G 40 HO2' G 40 12.640 10.287 -6.415 523 H1' G 40 H1' G 40 9.484 8.728 -5.331 524 H8 G 40 H8 G 40 10.290 7.557 -8.983 525 H1 G 40 H1 G 40 11.577 3.395 -4.272 526 H21 G 40 H21 G 40 11.123 4.326 -2.305 527 H22 G 40 H22 G 40 10.446 5.928 -2.178 528 H5' A 41 H5' A 41 7.631 13.539 -3.439 529 H5'' A 41 H5'' A 41 7.430 12.386 -4.774 530 H4' A 41 H4' A 41 7.617 15.385 -5.229 531 H3' A 41 H3' A 41 5.287 13.715 -4.337 532 H2' A 41 H2' A 41 3.865 14.629 -5.963 533 HO2' A 41 HO2' A 41 4.495 16.826 -5.542 534 H1' A 41 H1' A 41 5.701 14.941 -8.021 535 H8 A 41 H8 A 41 4.592 12.076 -5.643 536 H61 A 41 H61 A 41 3.015 9.188 -10.920 537 H62 A 41 H62 A 41 2.893 9.102 -9.174 538 H2 A 41 H2 A 41 5.209 12.848 -11.977 539 H5' C 42 H5' C 42 1.653 15.320 -1.943 540 H5'' C 42 H5'' C 42 2.575 13.865 -2.358 541 H4' C 42 H4' C 42 1.748 14.192 -4.751 542 H3' C 42 H3' C 42 0.299 16.368 -3.366 543 H2' C 42 H2' C 42 -1.857 15.599 -4.079 544 HO2' C 42 HO2' C 42 -0.771 15.025 -6.272 545 H1' C 42 H1' C 42 -1.608 13.010 -3.783 546 H41 C 42 H41 C 42 -3.350 15.572 1.899 547 H42 C 42 H42 C 42 -1.738 15.209 2.493 548 H5 C 42 H5 C 42 0.042 14.328 1.034 549 H6 C 42 H6 C 42 0.586 13.674 -1.202 550 H5' A 43 H5' A 43 -1.806 16.604 -5.698 551 H5'' A 43 H5'' A 43 -1.345 17.326 -7.200 552 H4' A 43 H4' A 43 -3.712 17.637 -6.867 553 H3' A 43 H3' A 43 -2.612 19.977 -7.342 554 H2' A 43 H2' A 43 -1.676 20.305 -5.155 555 HO2' A 43 HO2' A 43 -2.968 22.163 -5.658 556 H1' A 43 H1' A 43 -4.186 19.660 -3.672 557 H8 A 43 H8 A 43 -2.584 16.772 -2.934 558 H61 A 43 H61 A 43 1.659 19.502 0.685 559 H62 A 43 H62 A 43 0.912 17.975 0.253 560 H2 A 43 H2 A 43 -0.224 22.638 -1.828 561 H5' U 44 H5' U 44 -8.002 17.621 -7.223 562 H5'' U 44 H5'' U 44 -7.396 18.585 -5.863 563 H4' U 44 H4' U 44 -8.244 16.581 -4.925 564 H3' U 44 H3' U 44 -5.464 17.207 -4.791 565 HO3' U 44 HO3' U 44 -5.841 16.550 -2.616 566 H2' U 44 H2' U 44 -4.460 15.101 -4.797 567 HO2' U 44 HO2' U 44 -5.475 14.357 -2.939 568 H1' U 44 H1' U 44 -6.304 13.488 -5.937 569 H3 U 44 H3 U 44 -5.671 14.216 -10.509 570 H5 U 44 H5 U 44 -2.609 16.221 -8.448 571 H6 U 44 H6 U 44 -3.751 15.783 -6.395 572 H1 MET 1 H1 MET 1 1.177 -12.535 3.682 573 H2 MET 1 H2 MET 1 0.213 -12.904 4.960 574 H3 MET 1 H3 MET 1 1.073 -11.501 4.966 575 HA MET 1 HA MET 1 -0.147 -10.657 3.112 576 HB2 MET 1 HB2 MET 1 -0.709 -12.876 2.123 577 HB3 MET 1 HB3 MET 1 -1.749 -13.222 3.506 578 HG2 MET 1 HG2 MET 1 -3.159 -12.565 1.713 579 HG3 MET 1 HG3 MET 1 -3.188 -11.268 2.890 580 HE1 MET 1 HE1 MET 1 -4.369 -9.767 1.076 581 HE2 MET 1 HE2 MET 1 -3.742 -9.531 -0.574 582 HE3 MET 1 HE3 MET 1 -4.304 -11.141 -0.048 583 H LEU 2 H LEU 2 -1.684 -9.121 3.657 584 HA LEU 2 HA LEU 2 -3.414 -9.670 5.998 585 HB2 LEU 2 HB2 LEU 2 -1.203 -7.719 5.802 586 HB3 LEU 2 HB3 LEU 2 -2.757 -6.968 6.220 587 HG LEU 2 HG LEU 2 -1.397 -9.234 7.699 588 HD11 LEU 2 HD11 LEU 2 -0.395 -6.980 7.980 589 HD12 LEU 2 HD12 LEU 2 -1.983 -6.333 8.452 590 HD13 LEU 2 HD13 LEU 2 -1.175 -7.544 9.479 591 HD21 LEU 2 HD21 LEU 2 -3.193 -8.821 9.406 592 HD22 LEU 2 HD22 LEU 2 -4.026 -7.769 8.236 593 HD23 LEU 2 HD23 LEU 2 -3.837 -9.510 7.916 594 H ILE 3 H ILE 3 -5.348 -8.437 5.973 595 HA ILE 3 HA ILE 3 -5.849 -6.867 3.490 596 HB ILE 3 HB ILE 3 -7.651 -8.961 4.764 597 HG12 ILE 3 HG12 ILE 3 -7.670 -9.616 2.228 598 HG13 ILE 3 HG13 ILE 3 -6.164 -8.682 2.128 599 HG21 ILE 3 HG21 ILE 3 -8.238 -6.941 2.564 600 HG22 ILE 3 HG22 ILE 3 -9.285 -8.299 3.029 601 HG23 ILE 3 HG23 ILE 3 -8.985 -6.982 4.178 602 HD11 ILE 3 HD11 ILE 3 -5.703 -11.062 2.482 603 HD12 ILE 3 HD12 ILE 3 -5.216 -10.185 3.927 604 HD13 ILE 3 HD13 ILE 3 -6.779 -11.060 3.909 605 H LEU 4 H LEU 4 -7.045 -5.067 3.749 606 HA LEU 4 HA LEU 4 -7.745 -4.170 6.513 607 HB2 LEU 4 HB2 LEU 4 -5.881 -3.014 4.429 608 HB3 LEU 4 HB3 LEU 4 -6.851 -1.905 5.378 609 HG LEU 4 HG LEU 4 -4.599 -2.156 6.268 610 HD11 LEU 4 HD11 LEU 4 -6.547 -1.555 7.675 611 HD12 LEU 4 HD12 LEU 4 -6.684 -3.270 8.157 612 HD13 LEU 4 HD13 LEU 4 -5.226 -2.345 8.579 613 HD21 LEU 4 HD21 LEU 4 -4.288 -4.609 5.734 614 HD22 LEU 4 HD22 LEU 4 -3.810 -4.127 7.376 615 HD23 LEU 4 HD23 LEU 4 -5.341 -4.971 7.131 616 H THR 5 H THR 5 -9.249 -2.331 6.485 617 HA THR 5 HA THR 5 -10.379 -1.673 3.829 618 HB THR 5 HB THR 5 -12.369 -1.771 6.053 619 HG1 THR 5 HG1 THR 5 -11.470 -3.804 6.277 620 HG21 THR 5 HG21 THR 5 -13.833 -2.286 4.211 621 HG22 THR 5 HG22 THR 5 -12.759 -0.965 3.692 622 HG23 THR 5 HG23 THR 5 -12.459 -2.644 3.146 623 H ARG 6 H ARG 6 -9.917 0.356 3.558 624 HA ARG 6 HA ARG 6 -9.867 2.233 5.886 625 HB2 ARG 6 HB2 ARG 6 -7.634 1.338 4.908 626 HB3 ARG 6 HB3 ARG 6 -8.069 2.166 3.425 627 HG2 ARG 6 HG2 ARG 6 -6.585 3.602 4.483 628 HG3 ARG 6 HG3 ARG 6 -8.171 4.321 4.834 629 HD2 ARG 6 HD2 ARG 6 -6.668 2.428 6.703 630 HD3 ARG 6 HD3 ARG 6 -6.529 4.194 6.779 631 HE ARG 6 HE ARG 6 -8.981 4.269 7.210 632 HH11 ARG 6 HH11 ARG 6 -7.201 1.332 8.004 633 HH12 ARG 6 HH12 ARG 6 -8.369 0.816 9.205 634 HH21 ARG 6 HH21 ARG 6 -10.443 3.623 8.753 635 HH22 ARG 6 HH22 ARG 6 -10.215 2.133 9.639 636 H LYS 7 H LYS 7 -10.559 4.460 5.352 637 HA LYS 7 HA LYS 7 -11.783 4.612 2.627 638 HB2 LYS 7 HB2 LYS 7 -13.373 6.209 3.413 639 HB3 LYS 7 HB3 LYS 7 -13.576 4.688 4.264 640 HG2 LYS 7 HG2 LYS 7 -12.662 5.606 6.287 641 HG3 LYS 7 HG3 LYS 7 -11.974 7.009 5.417 642 HD2 LYS 7 HD2 LYS 7 -14.208 7.788 4.807 643 HD3 LYS 7 HD3 LYS 7 -14.953 6.384 5.588 644 HE2 LYS 7 HE2 LYS 7 -15.090 8.432 6.938 645 HE3 LYS 7 HE3 LYS 7 -14.203 7.127 7.770 646 HZ1 LYS 7 HZ1 LYS 7 -12.917 9.349 6.328 647 HZ2 LYS 7 HZ2 LYS 7 -13.153 9.293 7.959 648 HZ3 LYS 7 HZ3 LYS 7 -12.177 8.187 7.250 649 H VAL 8 H VAL 8 -12.137 6.936 1.909 650 HA VAL 8 HA VAL 8 -9.543 7.777 1.268 651 HB VAL 8 HB VAL 8 -10.554 9.570 0.061 652 HG11 VAL 8 HG11 VAL 8 -10.828 7.218 -0.768 653 HG12 VAL 8 HG12 VAL 8 -12.402 7.132 0.047 654 HG13 VAL 8 HG13 VAL 8 -12.163 8.277 -1.285 655 HG21 VAL 8 HG21 VAL 8 -12.947 10.047 0.127 656 HG22 VAL 8 HG22 VAL 8 -13.154 8.965 1.534 657 HG23 VAL 8 HG23 VAL 8 -12.187 10.455 1.674 658 H GLY 9 H GLY 9 -8.126 9.150 2.005 659 HA2 GLY 9 HA2 GLY 9 -7.405 11.130 3.073 660 HA3 GLY 9 HA3 GLY 9 -8.922 11.188 4.001 661 H GLU 10 H GLU 10 -7.864 8.009 4.117 662 HA GLU 10 HA GLU 10 -6.483 8.480 6.724 663 HB2 GLU 10 HB2 GLU 10 -8.144 6.134 5.762 664 HB3 GLU 10 HB3 GLU 10 -7.360 6.267 7.358 665 HG2 GLU 10 HG2 GLU 10 -8.690 8.251 7.878 666 HG3 GLU 10 HG3 GLU 10 -9.427 8.231 6.269 667 H SER 11 H SER 11 -5.219 6.132 7.218 668 HA SER 11 HA SER 11 -3.420 5.715 4.890 669 HB2 SER 11 HB2 SER 11 -2.511 6.752 7.598 670 HB3 SER 11 HB3 SER 11 -1.464 6.326 6.230 671 HG SER 11 HG SER 11 -1.893 8.558 6.320 672 H ILE 12 H ILE 12 -1.663 4.207 5.373 673 HA ILE 12 HA ILE 12 -2.111 2.209 7.500 674 HB ILE 12 HB ILE 12 -1.864 1.510 4.536 675 HG12 ILE 12 HG12 ILE 12 -4.250 1.255 6.416 676 HG13 ILE 12 HG13 ILE 12 -4.096 2.417 5.089 677 HG21 ILE 12 HG21 ILE 12 -2.265 -0.282 6.978 678 HG22 ILE 12 HG22 ILE 12 -2.254 -0.823 5.289 679 HG23 ILE 12 HG23 ILE 12 -0.786 -0.177 5.994 680 HD11 ILE 12 HD11 ILE 12 -3.913 0.521 3.474 681 HD12 ILE 12 HD12 ILE 12 -4.247 -0.603 4.812 682 HD13 ILE 12 HD13 ILE 12 -5.466 0.594 4.332 683 H ASN 13 H ASN 13 -0.015 0.729 7.542 684 HA ASN 13 HA ASN 13 2.332 2.291 6.588 685 HB2 ASN 13 HB2 ASN 13 1.871 1.451 9.471 686 HB3 ASN 13 HB3 ASN 13 3.282 2.309 8.842 687 HD21 ASN 13 HD22 ASN 13 3.124 4.589 8.443 688 HD22 ASN 13 HD21 ASN 13 1.698 5.496 8.910 689 H ILE 14 H ILE 14 4.313 1.188 6.601 690 HA ILE 14 HA ILE 14 4.271 -1.725 7.137 691 HB ILE 14 HB ILE 14 5.227 -0.528 4.502 692 HG12 ILE 14 HG12 ILE 14 2.744 -2.189 5.108 693 HG13 ILE 14 HG13 ILE 14 2.765 -0.481 4.630 694 HG21 ILE 14 HG21 ILE 14 6.495 -2.537 5.230 695 HG22 ILE 14 HG22 ILE 14 4.967 -3.422 5.436 696 HG23 ILE 14 HG23 ILE 14 5.499 -2.888 3.822 697 HD11 ILE 14 HD11 ILE 14 3.850 -1.130 2.475 698 HD12 ILE 14 HD12 ILE 14 3.613 -2.846 2.922 699 HD13 ILE 14 HD13 ILE 14 2.214 -1.785 2.700 700 H GLY 15 H GLY 15 6.370 -2.595 7.509 701 HA2 GLY 15 HA2 GLY 15 8.468 -2.525 8.461 702 HA3 GLY 15 HA3 GLY 15 8.822 -1.306 7.222 703 H ASP 16 H ASP 16 10.028 0.106 8.428 704 HA ASP 16 HA ASP 16 8.571 1.568 10.573 705 HB2 ASP 16 HB2 ASP 16 11.524 0.848 10.526 706 HB3 ASP 16 HB3 ASP 16 10.713 1.812 11.767 707 H ASP 17 H ASP 17 9.375 1.773 7.508 708 HA ASP 17 HA ASP 17 10.056 4.643 7.633 709 HB2 ASP 17 HB2 ASP 17 11.555 2.619 5.913 710 HB3 ASP 17 HB3 ASP 17 11.780 4.367 5.897 711 H ILE 18 H ILE 18 7.764 2.535 6.697 712 HA ILE 18 HA ILE 18 7.326 4.002 4.141 713 HB ILE 18 HB ILE 18 6.704 1.065 4.613 714 HG12 ILE 18 HG12 ILE 18 8.378 1.048 2.506 715 HG13 ILE 18 HG13 ILE 18 9.051 2.456 3.339 716 HG21 ILE 18 HG21 ILE 18 5.077 2.118 3.143 717 HG22 ILE 18 HG22 ILE 18 6.376 2.889 2.201 718 HG23 ILE 18 HG23 ILE 18 6.172 1.123 2.175 719 HD11 ILE 18 HD11 ILE 18 10.151 0.336 4.030 720 HD12 ILE 18 HD12 ILE 18 9.311 1.081 5.406 721 HD13 ILE 18 HD13 ILE 18 8.580 -0.304 4.563 722 H THR 19 H THR 19 5.283 4.630 3.688 723 HA THR 19 HA THR 19 3.064 3.870 5.497 724 HB THR 19 HB THR 19 3.932 6.720 4.845 725 HG1 THR 19 HG1 THR 19 4.189 6.821 7.076 726 HG21 THR 19 HG21 THR 19 1.495 5.679 6.349 727 HG22 THR 19 HG22 THR 19 2.055 7.370 6.376 728 HG23 THR 19 HG23 THR 19 1.495 6.653 4.859 729 H ILE 20 H ILE 20 0.988 4.344 4.526 730 HA ILE 20 HA ILE 20 0.995 4.743 1.569 731 HB ILE 20 HB ILE 20 -0.522 2.628 3.161 732 HG12 ILE 20 HG12 ILE 20 1.880 2.063 2.863 733 HG13 ILE 20 HG13 ILE 20 0.778 0.940 2.069 734 HG21 ILE 20 HG21 ILE 20 -0.531 3.270 0.185 735 HG22 ILE 20 HG22 ILE 20 -1.257 1.816 0.915 736 HG23 ILE 20 HG23 ILE 20 -1.889 3.411 1.322 737 HD11 ILE 20 HD11 ILE 20 1.230 1.949 -0.113 738 HD12 ILE 20 HD12 ILE 20 2.236 3.208 0.646 739 HD13 ILE 20 HD13 ILE 20 2.760 1.510 0.665 740 H THR 21 H THR 21 -0.881 5.806 0.816 741 HA THR 21 HA THR 21 -2.857 6.642 2.884 742 HB THR 21 HB THR 21 -1.530 8.566 0.933 743 HG1 THR 21 HG1 THR 21 -0.469 9.331 2.794 744 HG21 THR 21 HG21 THR 21 -2.589 10.269 2.389 745 HG22 THR 21 HG22 THR 21 -3.818 9.193 1.690 746 HG23 THR 21 HG23 THR 21 -3.304 8.977 3.378 747 H ILE 22 H ILE 22 -4.919 6.954 2.094 748 HA ILE 22 HA ILE 22 -5.364 6.223 -0.751 749 HB ILE 22 HB ILE 22 -6.341 4.617 0.637 750 HG12 ILE 22 HG12 ILE 22 -8.694 4.739 0.263 751 HG13 ILE 22 HG13 ILE 22 -8.659 6.509 0.145 752 HG21 ILE 22 HG21 ILE 22 -6.228 5.655 2.792 753 HG22 ILE 22 HG22 ILE 22 -7.469 6.857 2.345 754 HG23 ILE 22 HG23 ILE 22 -7.900 5.144 2.492 755 HD11 ILE 22 HD11 ILE 22 -7.295 4.624 -1.798 756 HD12 ILE 22 HD12 ILE 22 -8.848 5.483 -2.063 757 HD13 ILE 22 HD13 ILE 22 -7.347 6.405 -1.898 758 H LEU 23 H LEU 23 -5.109 8.204 -1.734 759 HA LEU 23 HA LEU 23 -5.884 10.665 -0.544 760 HB2 LEU 23 HB2 LEU 23 -5.610 10.121 -3.514 761 HB3 LEU 23 HB3 LEU 23 -5.445 11.661 -2.673 762 HG LEU 23 HG LEU 23 -3.539 9.292 -2.639 763 HD11 LEU 23 HD11 LEU 23 -3.379 12.214 -3.470 764 HD12 LEU 23 HD12 LEU 23 -1.987 11.105 -3.440 765 HD13 LEU 23 HD13 LEU 23 -3.353 10.798 -4.544 766 HD21 LEU 23 HD21 LEU 23 -3.609 10.193 -0.336 767 HD22 LEU 23 HD22 LEU 23 -2.082 10.587 -1.159 768 HD23 LEU 23 HD23 LEU 23 -3.343 11.833 -0.979 769 H GLY 24 H GLY 24 -7.683 8.392 -2.623 770 HA2 GLY 24 HA2 GLY 24 -10.201 9.069 -1.806 771 HA3 GLY 24 HA3 GLY 24 -9.906 10.267 -3.047 772 H VAL 25 H VAL 25 -11.894 8.987 -3.872 773 HA VAL 25 HA VAL 25 -10.893 6.888 -5.731 774 HB VAL 25 HB VAL 25 -12.818 5.515 -5.410 775 HG11 VAL 25 HG11 VAL 25 -12.589 4.801 -3.096 776 HG12 VAL 25 HG12 VAL 25 -10.994 5.225 -3.753 777 HG13 VAL 25 HG13 VAL 25 -11.839 6.346 -2.654 778 HG21 VAL 25 HG21 VAL 25 -13.857 7.653 -3.516 779 HG22 VAL 25 HG22 VAL 25 -14.544 7.196 -5.100 780 HG23 VAL 25 HG23 VAL 25 -14.582 6.047 -3.760 781 H SER 26 H SER 26 -12.300 6.551 -7.600 782 HA SER 26 HA SER 26 -14.279 8.622 -8.225 783 HB2 SER 26 HB2 SER 26 -12.103 9.620 -8.914 784 HB3 SER 26 HB3 SER 26 -11.791 8.202 -9.937 785 HG SER 26 HG SER 26 -12.740 9.932 -11.104 786 H GLY 27 H GLY 27 -15.759 6.873 -8.217 787 HA2 GLY 27 HA2 GLY 27 -16.987 5.236 -9.293 788 HA3 GLY 27 HA3 GLY 27 -15.874 5.353 -10.675 789 H GLN 28 H GLN 28 -14.310 3.784 -10.939 790 HA GLN 28 HA GLN 28 -14.047 1.746 -8.765 791 HB2 GLN 28 HB2 GLN 28 -13.426 1.635 -11.747 792 HB3 GLN 28 HB3 GLN 28 -13.000 0.371 -10.613 793 HG2 GLN 28 HG2 GLN 28 -15.764 1.292 -11.484 794 HG3 GLN 28 HG3 GLN 28 -15.052 -0.333 -11.581 795 HE21 GLN 28 HE22 GLN 28 -14.310 -1.106 -9.163 796 HE22 GLN 28 HE21 GLN 28 -15.547 -0.878 -7.945 797 H GLN 29 H GLN 29 -12.411 4.300 -10.467 798 HA GLN 29 HA GLN 29 -9.720 3.378 -9.901 799 HB2 GLN 29 HB2 GLN 29 -10.954 6.056 -10.608 800 HB3 GLN 29 HB3 GLN 29 -9.222 5.858 -10.276 801 HG2 GLN 29 HG2 GLN 29 -9.015 4.226 -12.080 802 HG3 GLN 29 HG3 GLN 29 -10.760 4.299 -12.397 803 HE21 GLN 29 HE22 GLN 29 -8.056 5.095 -13.830 804 HE22 GLN 29 HE21 GLN 29 -8.488 6.633 -14.554 805 H VAL 30 H VAL 30 -8.380 3.960 -8.294 806 HA VAL 30 HA VAL 30 -9.472 5.295 -5.875 807 HB VAL 30 HB VAL 30 -7.960 2.644 -6.035 808 HG11 VAL 30 HG11 VAL 30 -9.053 4.091 -3.604 809 HG12 VAL 30 HG12 VAL 30 -8.130 2.576 -3.625 810 HG13 VAL 30 HG13 VAL 30 -7.335 4.097 -4.085 811 HG21 VAL 30 HG21 VAL 30 -10.339 2.364 -6.578 812 HG22 VAL 30 HG22 VAL 30 -10.003 1.716 -4.962 813 HG23 VAL 30 HG23 VAL 30 -10.797 3.302 -5.136 814 H ARG 31 H ARG 31 -8.158 7.043 -5.664 815 HA ARG 31 HA ARG 31 -5.483 6.960 -6.885 816 HB2 ARG 31 HB2 ARG 31 -7.184 8.895 -7.059 817 HB3 ARG 31 HB3 ARG 31 -6.712 9.293 -5.390 818 HG2 ARG 31 HG2 ARG 31 -4.335 9.467 -6.125 819 HG3 ARG 31 HG3 ARG 31 -4.805 8.943 -7.751 820 HD2 ARG 31 HD2 ARG 31 -6.363 10.948 -7.831 821 HD3 ARG 31 HD3 ARG 31 -5.572 11.531 -6.361 822 HE ARG 31 HE ARG 31 -4.369 11.209 -9.078 823 HH11 ARG 31 HH11 ARG 31 -4.006 12.341 -5.742 824 HH12 ARG 31 HH12 ARG 31 -2.553 13.249 -6.102 825 HH21 ARG 31 HH21 ARG 31 -2.479 12.393 -9.496 826 HH22 ARG 31 HH22 ARG 31 -1.704 13.283 -8.210 827 H ILE 32 H ILE 32 -3.656 6.675 -5.770 828 HA ILE 32 HA ILE 32 -3.885 6.433 -2.806 829 HB ILE 32 HB ILE 32 -2.372 4.461 -4.546 830 HG12 ILE 32 HG12 ILE 32 -5.285 4.321 -3.689 831 HG13 ILE 32 HG13 ILE 32 -4.625 4.310 -5.339 832 HG21 ILE 32 HG21 ILE 32 -1.819 4.586 -2.123 833 HG22 ILE 32 HG22 ILE 32 -3.531 4.264 -1.737 834 HG23 ILE 32 HG23 ILE 32 -2.534 3.036 -2.559 835 HD11 ILE 32 HD11 ILE 32 -4.317 2.117 -3.257 836 HD12 ILE 32 HD12 ILE 32 -5.255 2.057 -4.755 837 HD13 ILE 32 HD13 ILE 32 -3.481 2.149 -4.835 838 H GLY 33 H GLY 33 -1.877 6.627 -1.681 839 HA2 GLY 33 HA2 GLY 33 0.383 7.732 -3.275 840 HA3 GLY 33 HA3 GLY 33 -0.149 8.487 -1.753 841 H ILE 34 H ILE 34 2.445 7.439 -2.271 842 HA ILE 34 HA ILE 34 2.622 5.306 -0.205 843 HB ILE 34 HB ILE 34 4.021 5.266 -2.920 844 HG12 ILE 34 HG12 ILE 34 1.889 3.374 -1.836 845 HG13 ILE 34 HG13 ILE 34 1.611 4.648 -3.041 846 HG21 ILE 34 HG21 ILE 34 4.903 3.070 -2.134 847 HG22 ILE 34 HG22 ILE 34 5.422 4.390 -1.085 848 HG23 ILE 34 HG23 ILE 34 4.096 3.322 -0.572 849 HD11 ILE 34 HD11 ILE 34 1.897 2.564 -4.206 850 HD12 ILE 34 HD12 ILE 34 3.293 3.603 -4.536 851 HD13 ILE 34 HD13 ILE 34 3.438 2.244 -3.383 852 H ASN 35 H ASN 35 4.328 5.633 1.151 853 HA ASN 35 HA ASN 35 6.141 7.888 0.446 854 HB2 ASN 35 HB2 ASN 35 4.138 8.586 1.777 855 HB3 ASN 35 HB3 ASN 35 4.688 7.537 3.085 856 HD21 ASN 35 HD22 ASN 35 4.307 10.427 3.150 857 HD22 ASN 35 HD21 ASN 35 5.864 11.163 3.456 858 H ALA 36 H ALA 36 7.880 6.681 0.114 859 HA ALA 36 HA ALA 36 9.154 5.509 2.509 860 HB1 ALA 36 HB1 ALA 36 8.201 3.571 1.277 861 HB2 ALA 36 HB2 ALA 36 8.969 4.149 -0.220 862 HB3 ALA 36 HB3 ALA 36 9.977 3.610 1.124 863 HA PRO 37 HA PRO 37 12.558 7.806 0.853 864 HB2 PRO 37 HB2 PRO 37 14.665 6.146 1.556 865 HB3 PRO 37 HB3 PRO 37 13.831 7.256 2.702 866 HG2 PRO 37 HG2 PRO 37 13.403 4.284 2.276 867 HG3 PRO 37 HG3 PRO 37 13.511 5.192 3.827 868 HD2 PRO 37 HD2 PRO 37 11.124 4.486 2.746 869 HD3 PRO 37 HD3 PRO 37 11.357 6.069 3.558 870 H LYS 38 H LYS 38 13.937 7.779 -0.998 871 HA LYS 38 HA LYS 38 13.328 5.871 -3.053 872 HB2 LYS 38 HB2 LYS 38 15.332 8.105 -2.662 873 HB3 LYS 38 HB3 LYS 38 15.503 6.997 -4.031 874 HG2 LYS 38 HG2 LYS 38 14.275 8.899 -4.707 875 HG3 LYS 38 HG3 LYS 38 13.230 7.470 -4.780 876 HD2 LYS 38 HD2 LYS 38 11.862 9.272 -3.931 877 HD3 LYS 38 HD3 LYS 38 12.161 8.232 -2.602 878 HE2 LYS 38 HE2 LYS 38 12.442 10.539 -1.928 879 HE3 LYS 38 HE3 LYS 38 14.054 9.781 -1.893 880 HZ1 LYS 38 HZ1 LYS 38 14.123 11.919 -2.942 881 HZ2 LYS 38 HZ2 LYS 38 14.438 10.768 -4.073 882 HZ3 LYS 38 HZ3 LYS 38 12.963 11.503 -4.017 883 H ASP 39 H ASP 39 15.076 5.608 -0.363 884 HA ASP 39 HA ASP 39 17.267 3.888 -0.972 885 HB2 ASP 39 HB2 ASP 39 16.548 5.105 1.223 886 HB3 ASP 39 HB3 ASP 39 15.515 3.709 1.497 887 H VAL 40 H VAL 40 13.889 3.337 -1.279 888 HA VAL 40 HA VAL 40 14.358 0.409 -1.568 889 HB VAL 40 HB VAL 40 12.246 -0.089 -0.511 890 HG11 VAL 40 HG11 VAL 40 13.729 1.942 1.220 891 HG12 VAL 40 HG12 VAL 40 12.651 0.651 1.796 892 HG13 VAL 40 HG13 VAL 40 14.189 0.234 1.010 893 HG21 VAL 40 HG21 VAL 40 11.003 1.915 -1.284 894 HG22 VAL 40 HG22 VAL 40 10.767 1.555 0.437 895 HG23 VAL 40 HG23 VAL 40 11.857 2.875 -0.047 896 H ALA 41 H ALA 41 12.469 -0.573 -2.911 897 HA ALA 41 HA ALA 41 12.083 1.306 -5.174 898 HB1 ALA 41 HB1 ALA 41 11.908 -1.738 -5.050 899 HB2 ALA 41 HB2 ALA 41 11.793 -0.735 -6.513 900 HB3 ALA 41 HB3 ALA 41 13.311 -0.789 -5.605 901 H VAL 42 H VAL 42 10.070 1.508 -6.237 902 HA VAL 42 HA VAL 42 7.774 -0.041 -5.388 903 HB VAL 42 HB VAL 42 7.456 1.437 -3.624 904 HG11 VAL 42 HG11 VAL 42 9.226 3.007 -3.977 905 HG12 VAL 42 HG12 VAL 42 8.425 3.679 -5.430 906 HG13 VAL 42 HG13 VAL 42 7.714 3.918 -3.816 907 HG21 VAL 42 HG21 VAL 42 5.445 1.382 -5.071 908 HG22 VAL 42 HG22 VAL 42 5.617 2.919 -4.184 909 HG23 VAL 42 HG23 VAL 42 6.023 2.854 -5.903 910 H HIS 43 H HIS 43 6.556 -0.396 -7.139 911 HA HIS 43 HA HIS 43 6.257 1.667 -9.206 912 HB2 HIS 43 HB2 HIS 43 7.223 -1.060 -10.097 913 HB3 HIS 43 HB3 HIS 43 7.187 0.459 -10.984 914 HD2 HIS 43 HD2 HIS 43 9.277 -1.464 -8.381 915 HE1 HIS 43 HE1 HIS 43 11.687 1.759 -9.746 916 HE2 HIS 43 HE2 HIS 43 11.656 -0.359 -8.344 917 H ARG 44 H ARG 44 4.776 0.788 -11.014 918 HA ARG 44 HA ARG 44 2.471 -0.525 -9.911 919 HB2 ARG 44 HB2 ARG 44 2.421 1.138 -11.766 920 HB3 ARG 44 HB3 ARG 44 3.333 0.023 -12.790 921 HG2 ARG 44 HG2 ARG 44 1.456 -1.611 -12.664 922 HG3 ARG 44 HG3 ARG 44 0.543 -0.462 -11.656 923 HD2 ARG 44 HD2 ARG 44 0.586 1.190 -13.469 924 HD3 ARG 44 HD3 ARG 44 1.591 0.116 -14.456 925 HE ARG 44 HE ARG 44 -0.736 -1.329 -13.761 926 HH11 ARG 44 HH11 ARG 44 0.144 1.521 -15.669 927 HH12 ARG 44 HH12 ARG 44 -1.177 1.320 -16.790 928 HH21 ARG 44 HH21 ARG 44 -2.449 -1.560 -15.247 929 HH22 ARG 44 HH22 ARG 44 -2.651 -0.401 -16.542 930 H GLU 45 H GLU 45 1.660 -2.683 -10.558 931 HA GLU 45 HA GLU 45 3.662 -4.647 -10.327 932 HB2 GLU 45 HB2 GLU 45 1.224 -4.769 -9.730 933 HB3 GLU 45 HB3 GLU 45 0.835 -4.984 -11.436 934 HG2 GLU 45 HG2 GLU 45 2.682 -6.816 -9.836 935 HG3 GLU 45 HG3 GLU 45 0.938 -7.077 -10.002 936 H GLU 46 H GLU 46 2.519 -2.901 -13.096 937 HA GLU 46 HA GLU 46 3.248 -4.744 -15.165 938 HB2 GLU 46 HB2 GLU 46 1.736 -2.715 -15.362 939 HB3 GLU 46 HB3 GLU 46 3.159 -1.694 -15.132 940 HG2 GLU 46 HG2 GLU 46 2.661 -1.846 -17.500 941 HG3 GLU 46 HG3 GLU 46 4.177 -2.688 -17.189 942 H ILE 47 H ILE 47 4.947 -1.986 -13.582 943 HA ILE 47 HA ILE 47 7.262 -2.239 -15.314 944 HB ILE 47 HB ILE 47 7.044 -0.753 -12.683 945 HG12 ILE 47 HG12 ILE 47 5.088 -0.057 -13.854 946 HG13 ILE 47 HG13 ILE 47 6.284 1.232 -13.980 947 HG21 ILE 47 HG21 ILE 47 8.615 0.824 -13.812 948 HG22 ILE 47 HG22 ILE 47 9.288 -0.808 -13.669 949 HG23 ILE 47 HG23 ILE 47 8.641 -0.248 -15.227 950 HD11 ILE 47 HD11 ILE 47 5.596 -0.799 -16.145 951 HD12 ILE 47 HD12 ILE 47 5.123 0.910 -16.108 952 HD13 ILE 47 HD13 ILE 47 6.841 0.474 -16.287 953 H TYR 48 H TYR 48 6.230 -3.526 -12.234 954 HA TYR 48 HA TYR 48 8.726 -4.075 -11.020 955 HB2 TYR 48 HB2 TYR 48 6.495 -4.081 -9.953 956 HB3 TYR 48 HB3 TYR 48 6.047 -5.504 -10.879 957 HD1 TYR 48 HD1 TYR 48 8.432 -4.272 -8.275 958 HD2 TYR 48 HD2 TYR 48 6.600 -7.693 -10.145 959 HE1 TYR 48 HE1 TYR 48 9.254 -5.711 -6.438 960 HE2 TYR 48 HE2 TYR 48 7.375 -9.125 -8.306 961 HH TYR 48 HH TYR 48 9.264 -7.824 -5.536 962 H GLN 49 H GLN 49 6.987 -5.744 -13.608 963 HA GLN 49 HA GLN 49 8.353 -8.259 -13.298 964 HB2 GLN 49 HB2 GLN 49 6.785 -7.006 -15.581 965 HB3 GLN 49 HB3 GLN 49 7.378 -8.687 -15.582 966 HG2 GLN 49 HG2 GLN 49 6.048 -9.231 -13.632 967 HG3 GLN 49 HG3 GLN 49 5.600 -7.542 -13.392 968 HE21 GLN 49 HE22 GLN 49 3.371 -8.158 -13.451 969 HE22 GLN 49 HE21 GLN 49 2.553 -8.472 -14.954 970 H ARG 50 H ARG 50 9.213 -5.224 -14.821 971 HA ARG 50 HA ARG 50 11.210 -6.343 -16.645 972 HB2 ARG 50 HB2 ARG 50 10.491 -3.568 -15.635 973 HB3 ARG 50 HB3 ARG 50 12.009 -3.850 -16.479 974 HG2 ARG 50 HG2 ARG 50 10.388 -3.101 -18.086 975 HG3 ARG 50 HG3 ARG 50 10.761 -4.801 -18.417 976 HD2 ARG 50 HD2 ARG 50 8.685 -5.490 -17.287 977 HD3 ARG 50 HD3 ARG 50 8.336 -3.791 -16.889 978 HE ARG 50 HE ARG 50 8.753 -4.060 -19.711 979 HH11 ARG 50 HH11 ARG 50 6.345 -4.837 -17.232 980 HH12 ARG 50 HH12 ARG 50 5.023 -4.835 -18.370 981 HH21 ARG 50 HH21 ARG 50 6.994 -4.064 -21.154 982 HH22 ARG 50 HH22 ARG 50 5.383 -4.397 -20.561 983 H ILE 51 H ILE 51 10.987 -5.718 -13.277 984 HA ILE 51 HA ILE 51 13.898 -5.267 -12.982 985 HB ILE 51 HB ILE 51 11.523 -4.973 -11.103 986 HG12 ILE 51 HG12 ILE 51 13.275 -2.877 -12.465 987 HG13 ILE 51 HG13 ILE 51 11.685 -3.377 -13.063 988 HG21 ILE 51 HG21 ILE 51 13.087 -3.862 -9.576 989 HG22 ILE 51 HG22 ILE 51 13.649 -5.509 -9.903 990 HG23 ILE 51 HG23 ILE 51 14.424 -4.131 -10.725 991 HD11 ILE 51 HD11 ILE 51 12.239 -2.074 -10.378 992 HD12 ILE 51 HD12 ILE 51 11.448 -1.348 -11.798 993 HD13 ILE 51 HD13 ILE 51 10.650 -2.680 -10.935 994 H GLN 52 H GLN 52 11.233 -7.387 -11.751 995 HA GLN 52 HA GLN 52 13.068 -9.018 -10.245 996 HB2 GLN 52 HB2 GLN 52 10.200 -9.523 -11.148 997 HB3 GLN 52 HB3 GLN 52 11.082 -10.530 -9.996 998 HG2 GLN 52 HG2 GLN 52 10.237 -7.643 -9.663 999 HG3 GLN 52 HG3 GLN 52 9.820 -9.058 -8.671 1000 HE21 GLN 52 HE22 GLN 52 11.822 -6.343 -8.905 1001 HE22 GLN 52 HE21 GLN 52 13.045 -6.806 -7.742 1002 H ALA 53 H ALA 53 12.907 -8.695 -13.506 1003 HA ALA 53 HA ALA 53 13.087 -11.389 -14.409 1004 HB1 ALA 53 HB1 ALA 53 14.153 -10.357 -16.392 1005 HB2 ALA 53 HB2 ALA 53 12.712 -9.444 -15.886 1006 HB3 ALA 53 HB3 ALA 53 14.337 -8.834 -15.497 1007 H GLY 54 H GLY 54 15.266 -9.469 -12.477 1008 HA2 GLY 54 HA2 GLY 54 16.858 -11.370 -11.537 1009 HA3 GLY 54 HA3 GLY 54 17.574 -11.192 -13.150 1010 H LEU 55 H LEU 55 16.271 -8.283 -11.529 1011 HA LEU 55 HA LEU 55 18.950 -7.435 -10.702 1012 HB2 LEU 55 HB2 LEU 55 19.037 -5.648 -12.475 1013 HB3 LEU 55 HB3 LEU 55 19.223 -7.301 -13.055 1014 HG LEU 55 HG LEU 55 16.736 -7.291 -13.647 1015 HD11 LEU 55 HD11 LEU 55 15.943 -5.372 -12.360 1016 HD12 LEU 55 HD12 LEU 55 17.102 -4.300 -13.193 1017 HD13 LEU 55 HD13 LEU 55 15.760 -5.050 -14.089 1018 HD21 LEU 55 HD21 LEU 55 18.606 -5.334 -15.022 1019 HD22 LEU 55 HD22 LEU 55 18.544 -7.100 -15.265 1020 HD23 LEU 55 HD23 LEU 55 17.163 -6.088 -15.741 1021 H THR 56 H THR 56 18.927 -4.921 -10.500 1022 HA THR 56 HA THR 56 16.300 -3.767 -9.832 1023 HB THR 56 HB THR 56 17.337 -2.764 -7.730 1024 HG1 THR 56 HG1 THR 56 19.056 -3.991 -6.860 1025 HG21 THR 56 HG21 THR 56 16.966 -5.782 -7.705 1026 HG22 THR 56 HG22 THR 56 16.756 -4.660 -6.344 1027 HG23 THR 56 HG23 THR 56 15.645 -4.584 -7.730 1028 H ALA 57 H ALA 57 18.889 -3.647 -11.680 1029 HA ALA 57 HA ALA 57 18.679 -0.743 -12.047 1030 HB1 ALA 57 HB1 ALA 57 21.320 -2.193 -11.593 1031 HB2 ALA 57 HB2 ALA 57 21.152 -0.508 -12.142 1032 HB3 ALA 57 HB3 ALA 57 20.596 -0.975 -10.521 1033 HA PRO 58 HA PRO 58 18.148 -2.474 -16.157 1034 HB2 PRO 58 HB2 PRO 58 19.138 0.335 -16.727 1035 HB3 PRO 58 HB3 PRO 58 17.865 -0.582 -17.588 1036 HG2 PRO 58 HG2 PRO 58 17.157 1.230 -15.718 1037 HG3 PRO 58 HG3 PRO 58 16.390 -0.396 -15.666 1038 HD2 PRO 58 HD2 PRO 58 18.674 0.658 -13.988 1039 HD3 PRO 58 HD3 PRO 58 17.276 -0.351 -13.490 1040 H ASP 59 H ASP 59 21.098 -0.647 -15.269 1041 HA ASP 59 HA ASP 59 22.825 -2.586 -16.557 1042 HB2 ASP 59 HB2 ASP 59 21.932 -1.394 -18.532 1043 HB3 ASP 59 HB3 ASP 59 22.398 0.146 -17.831 1044 H5' U 36 H5' U 36 -16.640 -4.677 10.196 1045 H5'' U 36 H5'' U 36 -16.504 -4.520 8.433 1046 H4' U 36 H4' U 36 -15.717 -7.026 9.979 1047 H3' U 36 H3' U 36 -14.305 -4.754 10.348 1048 H2' U 36 H2' U 36 -14.355 -4.078 8.051 1049 HO2' U 36 HO2' U 36 -11.931 -5.484 8.529 1050 H1' U 36 H1' U 36 -13.399 -6.828 7.267 1051 H3 U 36 H3 U 36 -14.260 -6.631 2.859 1052 H5 U 36 H5 U 36 -16.265 -3.256 4.352 1053 H6 U 36 H6 U 36 -15.658 -3.945 6.584 1054 HO5' U 36 HO5' U 36 -18.579 -5.247 9.107 1055 H5' C 37 H5' C 37 -13.762 -5.395 13.899 1056 H5'' C 37 H5'' C 37 -14.013 -4.484 12.396 1057 H4' C 37 H4' C 37 -11.431 -4.261 13.969 1058 H3' C 37 H3' C 37 -13.788 -3.574 15.197 1059 H2' C 37 H2' C 37 -14.644 -2.242 13.470 1060 HO2' C 37 HO2' C 37 -13.058 -0.529 15.099 1061 H1' C 37 H1' C 37 -11.965 -0.931 13.020 1062 H41 C 37 H41 C 37 -14.764 0.725 7.558 1063 H42 C 37 H42 C 37 -15.926 -0.585 7.663 1064 H5 C 37 H5 C 37 -15.915 -2.211 9.503 1065 H6 C 37 H6 C 37 -14.786 -2.841 11.564 1066 H5' A 38 H5' A 38 -11.222 -5.822 15.341 1067 H5'' A 38 H5'' A 38 -10.240 -6.015 16.798 1068 H4' A 38 H4' A 38 -9.128 -7.121 14.952 1069 H3' A 38 H3' A 38 -7.774 -5.342 16.550 1070 H2' A 38 H2' A 38 -8.217 -3.443 15.163 1071 HO2' A 38 HO2' A 38 -6.241 -3.012 14.042 1072 H1' A 38 H1' A 38 -7.473 -5.125 12.765 1073 H8 A 38 H8 A 38 -9.189 -1.996 14.125 1074 H61 A 38 H61 A 38 -10.334 -0.546 8.225 1075 H62 A 38 H62 A 38 -10.467 -0.033 9.898 1076 H2 A 38 H2 A 38 -8.635 -4.671 8.324 1077 H5' G 39 H5' G 39 -8.002 -8.584 13.653 1078 H5'' G 39 H5'' G 39 -7.756 -10.127 14.497 1079 H4' G 39 H4' G 39 -7.516 -10.724 12.259 1080 H3' G 39 H3' G 39 -5.271 -11.030 13.743 1081 H2' G 39 H2' G 39 -4.344 -8.883 13.303 1082 HO2' G 39 HO2' G 39 -2.696 -9.110 11.788 1083 H1' G 39 H1' G 39 -4.995 -9.039 10.376 1084 H8 G 39 H8 G 39 -7.037 -6.458 11.061 1085 H1 G 39 H1 G 39 -1.198 -4.214 12.467 1086 H21 G 39 H21 G 39 0.207 -5.842 12.734 1087 H22 G 39 H22 G 39 -0.243 -7.524 12.543 1088 H5' G 40 H5' G 40 -4.216 -12.127 9.162 1089 H5'' G 40 H5'' G 40 -3.709 -13.815 9.268 1090 H4' G 40 H4' G 40 -2.463 -12.475 7.578 1091 H3' G 40 H3' G 40 -1.278 -14.396 9.258 1092 H2' G 40 H2' G 40 -0.644 -12.558 10.759 1093 HO2' G 40 HO2' G 40 1.600 -12.579 10.617 1094 H1' G 40 H1' G 40 0.154 -11.323 8.078 1095 H8 G 40 H8 G 40 -0.815 -10.060 11.660 1096 H1 G 40 H1 G 40 4.566 -7.670 9.119 1097 H21 G 40 H21 G 40 4.923 -8.583 7.114 1098 H22 G 40 H22 G 40 3.800 -9.720 6.411 1099 H5' A 41 H5' A 41 -2.243 -14.938 4.715 1100 H5'' A 41 H5'' A 41 -2.658 -13.647 5.860 1101 H4' A 41 H4' A 41 -4.095 -16.328 5.827 1102 H3' A 41 H3' A 41 -4.492 -13.927 4.060 1103 H2' A 41 H2' A 41 -6.803 -13.889 4.452 1104 HO2' A 41 HO2' A 41 -7.936 -15.672 4.954 1105 H1' A 41 H1' A 41 -6.837 -14.768 7.075 1106 H8 A 41 H8 A 41 -4.956 -11.959 5.136 1107 H61 A 41 H61 A 41 -7.897 -8.191 9.120 1108 H62 A 41 H62 A 41 -6.839 -8.225 7.725 1109 H2 A 41 H2 A 41 -8.892 -12.373 10.176 1110 H5' C 42 H5' C 42 -6.970 -14.025 0.099 1111 H5'' C 42 H5'' C 42 -5.593 -13.284 0.925 1112 H4' C 42 H4' C 42 -7.066 -12.603 2.772 1113 H3' C 42 H3' C 42 -8.943 -14.332 2.059 1114 H2' C 42 H2' C 42 -9.354 -13.589 -0.162 1115 HO2' C 42 HO2' C 42 -11.346 -13.233 1.074 1116 H1' C 42 H1' C 42 -9.274 -10.690 0.461 1117 H41 C 42 H41 C 42 -8.290 -11.281 -5.821 1118 H42 C 42 H42 C 42 -6.617 -11.728 -5.518 1119 H5 C 42 H5 C 42 -5.734 -12.078 -3.254 1120 H6 C 42 H6 C 42 -6.308 -12.080 -0.906 1121 H5' A 43 H5' A 43 -11.904 -12.002 2.756 1122 H5'' A 43 H5'' A 43 -12.691 -12.148 4.316 1123 H4' A 43 H4' A 43 -14.172 -12.368 2.290 1124 H3' A 43 H3' A 43 -14.607 -13.714 4.579 1125 H2' A 43 H2' A 43 -13.066 -15.476 4.205 1126 HO2' A 43 HO2' A 43 -15.107 -16.452 4.588 1127 H1' A 43 H1' A 43 -14.005 -15.987 1.413 1128 H8 A 43 H8 A 43 -11.134 -14.931 0.282 1129 H61 A 43 H61 A 43 -7.658 -19.341 2.931 1130 H62 A 43 H62 A 43 -7.709 -18.100 1.692 1131 H2 A 43 H2 A 43 -11.563 -19.209 5.046 1132 H5' U 44 H5' U 44 -17.427 -12.412 -0.052 1133 H5'' U 44 H5'' U 44 -16.254 -13.687 0.290 1134 H4' U 44 H4' U 44 -15.503 -10.892 -0.689 1135 H3' U 44 H3' U 44 -15.927 -13.523 -2.139 1136 HO3' U 44 HO3' U 44 -16.427 -10.822 -2.886 1137 H2' U 44 H2' U 44 -14.220 -12.830 -3.696 1138 HO2' U 44 HO2' U 44 -13.290 -10.731 -3.492 1139 H1' U 44 H1' U 44 -12.469 -12.114 -1.741 1140 H3 U 44 H3 U 44 -11.194 -16.218 -3.304 1141 H5 U 44 H5 U 44 -14.229 -17.015 -0.503 1142 H6 U 44 H6 U 44 -14.654 -14.651 -0.368 Start of MODEL 19 1 H1 MET 1 H1 MET 1 8.376 9.222 -2.202 2 H2 MET 1 H2 MET 1 8.263 10.354 -1.006 3 H3 MET 1 H3 MET 1 8.441 10.821 -2.575 4 HA MET 1 HA MET 1 6.113 9.411 -1.457 5 HB2 MET 1 HB2 MET 1 6.251 11.770 -0.724 6 HB3 MET 1 HB3 MET 1 6.415 12.278 -2.424 7 HG2 MET 1 HG2 MET 1 4.138 12.598 -1.714 8 HG3 MET 1 HG3 MET 1 4.205 11.322 -2.923 9 HE1 MET 1 HE1 MET 1 1.702 10.867 -2.249 10 HE2 MET 1 HE2 MET 1 1.154 10.542 -0.583 11 HE3 MET 1 HE3 MET 1 1.813 12.141 -1.018 12 H LEU 2 H LEU 2 4.850 8.388 -2.989 13 HA LEU 2 HA LEU 2 5.012 9.432 -5.754 14 HB2 LEU 2 HB2 LEU 2 5.895 6.852 -4.833 15 HB3 LEU 2 HB3 LEU 2 4.394 6.604 -5.726 16 HG LEU 2 HG LEU 2 7.032 7.725 -6.678 17 HD11 LEU 2 HD11 LEU 2 6.675 5.307 -6.739 18 HD12 LEU 2 HD12 LEU 2 5.231 5.542 -7.757 19 HD13 LEU 2 HD13 LEU 2 6.849 6.008 -8.357 20 HD21 LEU 2 HD21 LEU 2 4.432 7.926 -8.249 21 HD22 LEU 2 HD22 LEU 2 5.408 9.291 -7.617 22 HD23 LEU 2 HD23 LEU 2 6.087 8.246 -8.844 23 H ILE 3 H ILE 3 3.030 9.064 -6.980 24 HA ILE 3 HA ILE 3 0.671 8.259 -5.351 25 HB ILE 3 HB ILE 3 0.907 10.717 -7.138 26 HG12 ILE 3 HG12 ILE 3 -0.148 11.689 -4.927 27 HG13 ILE 3 HG13 ILE 3 0.560 10.255 -4.162 28 HG21 ILE 3 HG21 ILE 3 -1.508 9.488 -5.743 29 HG22 ILE 3 HG22 ILE 3 -1.482 11.062 -6.560 30 HG23 ILE 3 HG23 ILE 3 -1.253 9.577 -7.502 31 HD11 ILE 3 HD11 ILE 3 2.803 11.030 -5.086 32 HD12 ILE 3 HD12 ILE 3 1.956 12.503 -5.658 33 HD13 ILE 3 HD13 ILE 3 2.058 12.125 -3.923 34 H LEU 4 H LEU 4 -0.981 7.283 -6.557 35 HA LEU 4 HA LEU 4 -0.413 6.585 -9.387 36 HB2 LEU 4 HB2 LEU 4 -0.953 4.615 -7.123 37 HB3 LEU 4 HB3 LEU 4 -0.861 4.194 -8.835 38 HG LEU 4 HG LEU 4 1.458 5.315 -7.193 39 HD11 LEU 4 HD11 LEU 4 0.777 3.100 -6.449 40 HD12 LEU 4 HD12 LEU 4 0.740 2.513 -8.129 41 HD13 LEU 4 HD13 LEU 4 2.287 2.968 -7.376 42 HD21 LEU 4 HD21 LEU 4 1.669 5.822 -9.614 43 HD22 LEU 4 HD22 LEU 4 2.809 4.553 -9.137 44 HD23 LEU 4 HD23 LEU 4 1.313 4.121 -10.002 45 H THR 5 H THR 5 -2.331 5.507 -10.408 46 HA THR 5 HA THR 5 -4.809 5.718 -8.808 47 HB THR 5 HB THR 5 -5.024 6.680 -11.635 48 HG1 THR 5 HG1 THR 5 -3.336 7.934 -10.819 49 HG21 THR 5 HG21 THR 5 -6.813 7.976 -10.694 50 HG22 THR 5 HG22 THR 5 -6.971 6.294 -10.120 51 HG23 THR 5 HG23 THR 5 -6.316 7.558 -9.036 52 H ARG 6 H ARG 6 -5.009 3.576 -8.649 53 HA ARG 6 HA ARG 6 -5.109 1.911 -11.122 54 HB2 ARG 6 HB2 ARG 6 -4.857 1.282 -8.148 55 HB3 ARG 6 HB3 ARG 6 -5.005 0.031 -9.388 56 HG2 ARG 6 HG2 ARG 6 -2.817 2.095 -9.668 57 HG3 ARG 6 HG3 ARG 6 -2.629 0.780 -8.494 58 HD2 ARG 6 HD2 ARG 6 -1.628 0.247 -10.684 59 HD3 ARG 6 HD3 ARG 6 -2.866 -0.909 -10.169 60 HE ARG 6 HE ARG 6 -4.432 0.058 -11.731 61 HH11 ARG 6 HH11 ARG 6 -1.069 1.034 -12.240 62 HH12 ARG 6 HH12 ARG 6 -1.349 1.496 -13.907 63 HH21 ARG 6 HH21 ARG 6 -4.754 0.642 -13.859 64 HH22 ARG 6 HH22 ARG 6 -3.464 1.356 -14.799 65 H LYS 7 H LYS 7 -6.847 0.032 -10.788 66 HA LYS 7 HA LYS 7 -9.177 1.056 -9.274 67 HB2 LYS 7 HB2 LYS 7 -10.746 0.284 -10.967 68 HB3 LYS 7 HB3 LYS 7 -9.738 1.582 -11.596 69 HG2 LYS 7 HG2 LYS 7 -8.472 0.067 -12.950 70 HG3 LYS 7 HG3 LYS 7 -9.071 -1.354 -12.057 71 HD2 LYS 7 HD2 LYS 7 -10.255 -1.215 -14.185 72 HD3 LYS 7 HD3 LYS 7 -11.378 -0.879 -12.858 73 HE2 LYS 7 HE2 LYS 7 -11.171 1.529 -13.250 74 HE3 LYS 7 HE3 LYS 7 -9.960 1.248 -14.511 75 HZ1 LYS 7 HZ1 LYS 7 -11.641 0.079 -15.772 76 HZ2 LYS 7 HZ2 LYS 7 -12.762 0.337 -14.598 77 HZ3 LYS 7 HZ3 LYS 7 -12.133 1.608 -15.435 78 H VAL 8 H VAL 8 -10.932 -0.836 -9.225 79 HA VAL 8 HA VAL 8 -9.675 -2.625 -7.446 80 HB VAL 8 HB VAL 8 -11.792 -3.670 -7.156 81 HG11 VAL 8 HG11 VAL 8 -12.173 -0.689 -7.726 82 HG12 VAL 8 HG12 VAL 8 -13.131 -1.680 -6.613 83 HG13 VAL 8 HG13 VAL 8 -11.418 -1.359 -6.264 84 HG21 VAL 8 HG21 VAL 8 -13.769 -3.111 -8.448 85 HG22 VAL 8 HG22 VAL 8 -12.781 -2.181 -9.615 86 HG23 VAL 8 HG23 VAL 8 -12.573 -3.948 -9.458 87 H GLY 9 H GLY 9 -8.829 -4.549 -7.516 88 HA2 GLY 9 HA2 GLY 9 -8.649 -6.789 -8.339 89 HA3 GLY 9 HA3 GLY 9 -9.186 -6.234 -9.934 90 H GLU 10 H GLU 10 -7.086 -3.853 -9.204 91 HA GLU 10 HA GLU 10 -4.880 -5.207 -10.622 92 HB2 GLU 10 HB2 GLU 10 -5.364 -2.276 -9.967 93 HB3 GLU 10 HB3 GLU 10 -4.027 -2.919 -10.944 94 HG2 GLU 10 HG2 GLU 10 -5.705 -3.964 -12.487 95 HG3 GLU 10 HG3 GLU 10 -6.999 -3.160 -11.591 96 H SER 11 H SER 11 -2.600 -4.082 -9.896 97 HA SER 11 HA SER 11 -2.348 -4.356 -6.957 98 HB2 SER 11 HB2 SER 11 -0.884 -6.074 -8.991 99 HB3 SER 11 HB3 SER 11 -0.537 -6.027 -7.251 100 HG SER 11 HG SER 11 -2.606 -6.812 -6.860 101 H ILE 12 H ILE 12 -0.072 -4.027 -6.270 102 HA ILE 12 HA ILE 12 1.562 -2.209 -7.925 103 HB ILE 12 HB ILE 12 0.543 -1.457 -5.153 104 HG12 ILE 12 HG12 ILE 12 -0.358 -0.337 -7.836 105 HG13 ILE 12 HG13 ILE 12 -1.312 -1.427 -6.797 106 HG21 ILE 12 HG21 ILE 12 2.054 0.167 -7.255 107 HG22 ILE 12 HG22 ILE 12 1.484 0.773 -5.686 108 HG23 ILE 12 HG23 ILE 12 2.742 -0.454 -5.738 109 HD11 ILE 12 HD11 ILE 12 -2.085 0.797 -6.427 110 HD12 ILE 12 HD12 ILE 12 -1.226 0.251 -4.971 111 HD13 ILE 12 HD13 ILE 12 -0.447 1.390 -6.095 112 H ASN 13 H ASN 13 3.720 -1.791 -6.606 113 HA ASN 13 HA ASN 13 4.280 -4.051 -4.762 114 HB2 ASN 13 HB2 ASN 13 5.620 -3.495 -7.429 115 HB3 ASN 13 HB3 ASN 13 6.444 -4.363 -6.129 116 HD21 ASN 13 HD22 ASN 13 5.503 -6.367 -5.318 117 HD22 ASN 13 HD21 ASN 13 4.491 -7.330 -6.370 118 H ILE 14 H ILE 14 6.138 -3.866 -3.526 119 HA ILE 14 HA ILE 14 7.581 -1.287 -3.532 120 HB ILE 14 HB ILE 14 6.309 -2.519 -1.053 121 HG12 ILE 14 HG12 ILE 14 5.576 0.004 -2.599 122 HG13 ILE 14 HG13 ILE 14 4.610 -1.477 -2.514 123 HG21 ILE 14 HG21 ILE 14 8.459 -1.377 -0.606 124 HG22 ILE 14 HG22 ILE 14 7.863 0.072 -1.452 125 HG23 ILE 14 HG23 ILE 14 7.115 -0.465 0.074 126 HD11 ILE 14 HD11 ILE 14 3.673 0.135 -0.989 127 HD12 ILE 14 HD12 ILE 14 4.418 -1.171 -0.039 128 HD13 ILE 14 HD13 ILE 14 5.233 0.407 -0.204 129 H GLY 15 H GLY 15 9.675 -1.450 -2.580 130 HA2 GLY 15 HA2 GLY 15 11.696 -2.512 -2.230 131 HA3 GLY 15 HA3 GLY 15 10.769 -3.659 -1.246 132 H ASP 16 H ASP 16 11.759 -5.528 -1.846 133 HA ASP 16 HA ASP 16 11.307 -6.411 -4.656 134 HB2 ASP 16 HB2 ASP 16 13.730 -6.968 -2.902 135 HB3 ASP 16 HB3 ASP 16 13.413 -7.706 -4.484 136 H ASP 17 H ASP 17 10.092 -6.654 -1.735 137 HA ASP 17 HA ASP 17 9.511 -9.538 -1.944 138 HB2 ASP 17 HB2 ASP 17 10.542 -8.173 0.580 139 HB3 ASP 17 HB3 ASP 17 9.921 -9.825 0.486 140 H ILE 18 H ILE 18 8.139 -6.593 -2.043 141 HA ILE 18 HA ILE 18 5.854 -7.489 -0.353 142 HB ILE 18 HB ILE 18 6.807 -4.621 -0.664 143 HG12 ILE 18 HG12 ILE 18 6.950 -5.007 1.965 144 HG13 ILE 18 HG13 ILE 18 7.284 -6.678 1.480 145 HG21 ILE 18 HG21 ILE 18 4.392 -4.757 -0.433 146 HG22 ILE 18 HG22 ILE 18 4.545 -5.876 0.941 147 HG23 ILE 18 HG23 ILE 18 5.090 -4.193 1.089 148 HD11 ILE 18 HD11 ILE 18 8.760 -4.182 0.516 149 HD12 ILE 18 HD12 ILE 18 9.351 -5.309 1.753 150 HD13 ILE 18 HD13 ILE 18 9.172 -5.856 0.070 151 H THR 19 H THR 19 3.828 -7.108 -1.108 152 HA THR 19 HA THR 19 3.487 -5.832 -3.768 153 HB THR 19 HB THR 19 2.348 -8.542 -2.965 154 HG1 THR 19 HG1 THR 19 3.771 -9.325 -4.529 155 HG21 THR 19 HG21 THR 19 2.218 -6.948 -5.560 156 HG22 THR 19 HG22 THR 19 1.711 -8.644 -5.383 157 HG23 THR 19 HG23 THR 19 0.857 -7.372 -4.496 158 H ILE 20 H ILE 20 1.310 -5.108 -4.109 159 HA ILE 20 HA ILE 20 -0.435 -4.986 -1.697 160 HB ILE 20 HB ILE 20 0.381 -2.686 -3.517 161 HG12 ILE 20 HG12 ILE 20 2.135 -3.291 -1.868 162 HG13 ILE 20 HG13 ILE 20 1.476 -1.666 -1.651 163 HG21 ILE 20 HG21 ILE 20 -1.539 -2.769 -1.161 164 HG22 ILE 20 HG22 ILE 20 -0.959 -1.277 -1.944 165 HG23 ILE 20 HG23 ILE 20 -1.937 -2.430 -2.863 166 HD11 ILE 20 HD11 ILE 20 1.806 -2.876 0.496 167 HD12 ILE 20 HD12 ILE 20 0.115 -2.407 0.228 168 HD13 ILE 20 HD13 ILE 20 0.618 -4.096 -0.027 169 H THR 21 H THR 21 -2.668 -4.859 -2.234 170 HA THR 21 HA THR 21 -3.354 -4.916 -5.125 171 HB THR 21 HB THR 21 -4.283 -6.999 -3.111 172 HG1 THR 21 HG1 THR 21 -2.988 -8.383 -4.342 173 HG21 THR 21 HG21 THR 21 -5.202 -8.136 -5.103 174 HG22 THR 21 HG22 THR 21 -5.926 -6.530 -4.915 175 HG23 THR 21 HG23 THR 21 -4.652 -6.800 -6.131 176 H ILE 22 H ILE 22 -5.410 -4.178 -5.582 177 HA ILE 22 HA ILE 22 -6.887 -2.940 -3.314 178 HB ILE 22 HB ILE 22 -6.209 -1.263 -4.785 179 HG12 ILE 22 HG12 ILE 22 -8.240 -0.366 -5.766 180 HG13 ILE 22 HG13 ILE 22 -9.001 -1.965 -5.769 181 HG21 ILE 22 HG21 ILE 22 -6.577 -1.301 -7.239 182 HG22 ILE 22 HG22 ILE 22 -5.450 -2.550 -6.693 183 HG23 ILE 22 HG23 ILE 22 -7.123 -2.987 -7.120 184 HD11 ILE 22 HD11 ILE 22 -8.137 -0.458 -3.270 185 HD12 ILE 22 HD12 ILE 22 -9.804 -0.586 -3.898 186 HD13 ILE 22 HD13 ILE 22 -8.965 -2.042 -3.338 187 H LEU 23 H LEU 23 -8.153 -4.574 -2.578 188 HA LEU 23 HA LEU 23 -9.155 -6.644 -4.272 189 HB2 LEU 23 HB2 LEU 23 -10.165 -5.857 -1.513 190 HB3 LEU 23 HB3 LEU 23 -10.295 -7.439 -2.289 191 HG LEU 23 HG LEU 23 -7.764 -6.083 -1.272 192 HD11 LEU 23 HD11 LEU 23 -9.221 -7.164 0.418 193 HD12 LEU 23 HD12 LEU 23 -9.167 -8.678 -0.516 194 HD13 LEU 23 HD13 LEU 23 -7.681 -8.039 0.217 195 HD21 LEU 23 HD21 LEU 23 -8.054 -8.755 -2.711 196 HD22 LEU 23 HD22 LEU 23 -7.225 -7.310 -3.349 197 HD23 LEU 23 HD23 LEU 23 -6.587 -8.143 -1.914 198 H GLY 24 H GLY 24 -10.499 -3.522 -3.278 199 HA2 GLY 24 HA2 GLY 24 -12.249 -3.183 -5.310 200 HA3 GLY 24 HA3 GLY 24 -13.213 -4.179 -4.232 201 H VAL 25 H VAL 25 -14.539 -2.092 -4.392 202 HA VAL 25 HA VAL 25 -13.726 -0.302 -2.152 203 HB VAL 25 HB VAL 25 -14.731 1.593 -3.269 204 HG11 VAL 25 HG11 VAL 25 -12.807 0.174 -5.151 205 HG12 VAL 25 HG12 VAL 25 -13.155 1.915 -5.104 206 HG13 VAL 25 HG13 VAL 25 -12.353 1.138 -3.726 207 HG21 VAL 25 HG21 VAL 25 -15.510 1.465 -5.607 208 HG22 VAL 25 HG22 VAL 25 -15.301 -0.307 -5.583 209 HG23 VAL 25 HG23 VAL 25 -16.502 0.478 -4.528 210 H SER 26 H SER 26 -15.523 0.780 -1.100 211 HA SER 26 HA SER 26 -18.215 -0.336 -1.443 212 HB2 SER 26 HB2 SER 26 -17.151 -1.942 0.096 213 HB3 SER 26 HB3 SER 26 -16.634 -0.611 1.154 214 HG SER 26 HG SER 26 -18.808 -0.122 1.505 215 H GLY 27 H GLY 27 -18.347 1.928 -2.211 216 HA2 GLY 27 HA2 GLY 27 -18.889 4.153 -1.864 217 HA3 GLY 27 HA3 GLY 27 -19.077 3.780 -0.140 218 H GLN 28 H GLN 28 -17.898 5.475 0.770 219 HA GLN 28 HA GLN 28 -15.320 6.289 -0.207 220 HB2 GLN 28 HB2 GLN 28 -17.030 6.823 2.196 221 HB3 GLN 28 HB3 GLN 28 -15.308 7.214 2.311 222 HG2 GLN 28 HG2 GLN 28 -16.834 9.093 1.458 223 HG3 GLN 28 HG3 GLN 28 -15.350 8.748 0.557 224 HE21 GLN 28 HE22 GLN 28 -15.452 8.359 -1.592 225 HE22 GLN 28 HE21 GLN 28 -16.913 7.993 -2.477 226 H GLN 29 H GLN 29 -16.258 3.466 1.608 227 HA GLN 29 HA GLN 29 -13.590 3.181 2.797 228 HB2 GLN 29 HB2 GLN 29 -15.971 2.119 3.542 229 HB3 GLN 29 HB3 GLN 29 -15.455 0.862 2.412 230 HG2 GLN 29 HG2 GLN 29 -14.584 0.119 4.426 231 HG3 GLN 29 HG3 GLN 29 -13.188 1.025 3.757 232 HE21 GLN 29 HE22 GLN 29 -16.169 1.769 5.687 233 HE22 GLN 29 HE21 GLN 29 -15.323 2.736 6.875 234 H VAL 30 H VAL 30 -12.038 1.570 2.075 235 HA VAL 30 HA VAL 30 -12.499 0.460 -0.645 236 HB VAL 30 HB VAL 30 -10.036 1.991 0.288 237 HG11 VAL 30 HG11 VAL 30 -9.261 1.641 -2.029 238 HG12 VAL 30 HG12 VAL 30 -9.523 0.081 -1.214 239 HG13 VAL 30 HG13 VAL 30 -10.721 0.686 -2.379 240 HG21 VAL 30 HG21 VAL 30 -11.878 3.527 -0.285 241 HG22 VAL 30 HG22 VAL 30 -10.630 3.564 -1.543 242 HG23 VAL 30 HG23 VAL 30 -12.142 2.665 -1.817 243 H ARG 31 H ARG 31 -11.925 -1.659 -0.727 244 HA ARG 31 HA ARG 31 -10.679 -2.775 1.712 245 HB2 ARG 31 HB2 ARG 31 -12.829 -3.663 0.574 246 HB3 ARG 31 HB3 ARG 31 -11.739 -4.357 -0.644 247 HG2 ARG 31 HG2 ARG 31 -10.488 -5.505 1.235 248 HG3 ARG 31 HG3 ARG 31 -11.650 -4.805 2.378 249 HD2 ARG 31 HD2 ARG 31 -13.474 -5.916 0.949 250 HD3 ARG 31 HD3 ARG 31 -12.174 -6.861 0.215 251 HE ARG 31 HE ARG 31 -12.566 -6.798 3.181 252 HH11 ARG 31 HH11 ARG 31 -12.309 -8.690 0.183 253 HH12 ARG 31 HH12 ARG 31 -12.317 -10.211 1.045 254 HH21 ARG 31 HH21 ARG 31 -12.603 -8.773 4.224 255 HH22 ARG 31 HH22 ARG 31 -12.446 -10.262 3.314 256 H ILE 32 H ILE 32 -8.623 -3.474 1.745 257 HA ILE 32 HA ILE 32 -7.106 -3.467 -0.822 258 HB ILE 32 HB ILE 32 -6.085 -2.106 1.686 259 HG12 ILE 32 HG12 ILE 32 -7.734 -0.872 -0.556 260 HG13 ILE 32 HG13 ILE 32 -8.116 -0.917 1.174 261 HG21 ILE 32 HG21 ILE 32 -5.379 -1.813 -1.262 262 HG22 ILE 32 HG22 ILE 32 -4.553 -1.016 0.101 263 HG23 ILE 32 HG23 ILE 32 -4.453 -2.768 -0.079 264 HD11 ILE 32 HD11 ILE 32 -5.853 0.634 -0.125 265 HD12 ILE 32 HD12 ILE 32 -7.328 1.286 0.623 266 HD13 ILE 32 HD13 ILE 32 -6.113 0.482 1.636 267 H GLY 33 H GLY 33 -5.063 -4.620 -0.700 268 HA2 GLY 33 HA2 GLY 33 -4.817 -6.428 1.661 269 HA3 GLY 33 HA3 GLY 33 -4.765 -7.063 0.010 270 H ILE 34 H ILE 34 -2.710 -7.334 1.944 271 HA ILE 34 HA ILE 34 -0.462 -5.918 0.624 272 HB ILE 34 HB ILE 34 -0.882 -6.174 3.635 273 HG12 ILE 34 HG12 ILE 34 -0.931 -3.630 1.955 274 HG13 ILE 34 HG13 ILE 34 -2.375 -4.451 2.580 275 HG21 ILE 34 HG21 ILE 34 1.474 -6.319 2.993 276 HG22 ILE 34 HG22 ILE 34 1.327 -4.851 2.003 277 HG23 ILE 34 HG23 ILE 34 1.174 -4.762 3.773 278 HD11 ILE 34 HD11 ILE 34 -1.486 -4.219 4.894 279 HD12 ILE 34 HD12 ILE 34 -0.159 -3.219 4.245 280 HD13 ILE 34 HD13 ILE 34 -1.837 -2.670 4.095 281 H ASN 35 H ASN 35 1.405 -7.150 0.553 282 HA ASN 35 HA ASN 35 1.288 -9.838 1.796 283 HB2 ASN 35 HB2 ASN 35 0.237 -9.820 -0.503 284 HB3 ASN 35 HB3 ASN 35 1.797 -9.356 -1.163 285 HD21 ASN 35 HD22 ASN 35 0.083 -11.798 -1.521 286 HD22 ASN 35 HD21 ASN 35 1.102 -13.161 -1.100 287 H ALA 36 H ALA 36 3.010 -9.718 3.062 288 HA ALA 36 HA ALA 36 5.671 -9.327 1.832 289 HB1 ALA 36 HB1 ALA 36 5.042 -7.090 2.673 290 HB2 ALA 36 HB2 ALA 36 4.661 -7.794 4.268 291 HB3 ALA 36 HB3 ALA 36 6.334 -7.804 3.674 292 HA PRO 37 HA PRO 37 6.691 -12.617 4.608 293 HB2 PRO 37 HB2 PRO 37 9.266 -11.924 5.334 294 HB3 PRO 37 HB3 PRO 37 8.826 -12.638 3.734 295 HG2 PRO 37 HG2 PRO 37 9.256 -9.724 4.465 296 HG3 PRO 37 HG3 PRO 37 9.897 -10.626 3.054 297 HD2 PRO 37 HD2 PRO 37 7.691 -9.079 2.837 298 HD3 PRO 37 HD3 PRO 37 7.780 -10.675 2.017 299 H LYS 38 H LYS 38 7.015 -13.068 6.885 300 HA LYS 38 HA LYS 38 6.174 -10.976 8.692 301 HB2 LYS 38 HB2 LYS 38 7.333 -13.764 9.155 302 HB3 LYS 38 HB3 LYS 38 6.665 -12.747 10.442 303 HG2 LYS 38 HG2 LYS 38 5.085 -13.522 7.951 304 HG3 LYS 38 HG3 LYS 38 5.054 -14.472 9.443 305 HD2 LYS 38 HD2 LYS 38 4.472 -11.497 9.554 306 HD3 LYS 38 HD3 LYS 38 3.247 -12.625 8.956 307 HE2 LYS 38 HE2 LYS 38 3.464 -13.962 11.029 308 HE3 LYS 38 HE3 LYS 38 4.680 -12.823 11.645 309 HZ1 LYS 38 HZ1 LYS 38 2.495 -12.355 12.503 310 HZ2 LYS 38 HZ2 LYS 38 3.003 -11.101 11.563 311 HZ3 LYS 38 HZ3 LYS 38 1.894 -12.174 10.980 312 H ASP 39 H ASP 39 8.959 -11.426 7.111 313 HA ASP 39 HA ASP 39 10.983 -10.714 9.009 314 HB2 ASP 39 HB2 ASP 39 11.130 -11.674 6.603 315 HB3 ASP 39 HB3 ASP 39 10.896 -10.021 6.055 316 H VAL 40 H VAL 40 8.308 -8.952 7.799 317 HA VAL 40 HA VAL 40 9.523 -6.379 8.650 318 HB VAL 40 HB VAL 40 8.579 -5.213 6.756 319 HG11 VAL 40 HG11 VAL 40 10.055 -7.679 5.723 320 HG12 VAL 40 HG12 VAL 40 9.936 -6.102 4.921 321 HG13 VAL 40 HG13 VAL 40 10.839 -6.255 6.441 322 HG21 VAL 40 HG21 VAL 40 7.609 -7.882 5.688 323 HG22 VAL 40 HG22 VAL 40 6.570 -6.631 6.424 324 HG23 VAL 40 HG23 VAL 40 7.446 -6.284 4.921 325 H ALA 41 H ALA 41 7.729 -4.681 8.915 326 HA ALA 41 HA ALA 41 5.472 -6.042 10.290 327 HB1 ALA 41 HB1 ALA 41 6.985 -4.687 11.699 328 HB2 ALA 41 HB2 ALA 41 6.666 -3.265 10.671 329 HB3 ALA 41 HB3 ALA 41 5.358 -3.973 11.634 330 H VAL 42 H VAL 42 3.345 -5.150 10.133 331 HA VAL 42 HA VAL 42 2.846 -2.886 8.373 332 HB VAL 42 HB VAL 42 2.875 -4.373 6.588 333 HG11 VAL 42 HG11 VAL 42 1.810 -6.635 6.636 334 HG12 VAL 42 HG12 VAL 42 3.206 -6.460 7.709 335 HG13 VAL 42 HG13 VAL 42 1.560 -6.433 8.391 336 HG21 VAL 42 HG21 VAL 42 -0.003 -4.522 7.565 337 HG22 VAL 42 HG22 VAL 42 0.723 -3.158 6.669 338 HG23 VAL 42 HG23 VAL 42 0.560 -4.759 5.908 339 H HIS 43 H HIS 43 1.240 -1.734 9.258 340 HA HIS 43 HA HIS 43 -0.999 -3.075 10.600 341 HB2 HIS 43 HB2 HIS 43 0.497 -0.957 12.167 342 HB3 HIS 43 HB3 HIS 43 -0.719 -2.097 12.720 343 HD2 HIS 43 HD2 HIS 43 3.039 -1.863 11.884 344 HE1 HIS 43 HE1 HIS 43 2.473 -5.490 14.031 345 HE2 HIS 43 HE2 HIS 43 4.206 -3.905 13.042 346 H ARG 44 H ARG 44 -2.589 -1.323 11.442 347 HA ARG 44 HA ARG 44 -3.050 0.657 9.381 348 HB2 ARG 44 HB2 ARG 44 -4.271 0.101 12.117 349 HB3 ARG 44 HB3 ARG 44 -4.898 1.319 10.985 350 HG2 ARG 44 HG2 ARG 44 -5.418 -0.342 9.331 351 HG3 ARG 44 HG3 ARG 44 -4.525 -1.599 10.207 352 HD2 ARG 44 HD2 ARG 44 -6.956 -1.864 10.487 353 HD3 ARG 44 HD3 ARG 44 -6.115 -1.594 12.016 354 HE ARG 44 HE ARG 44 -7.683 0.496 10.543 355 HH11 ARG 44 HH11 ARG 44 -6.571 -0.957 13.584 356 HH12 ARG 44 HH12 ARG 44 -7.343 0.272 14.565 357 HH21 ARG 44 HH21 ARG 44 -8.775 1.988 11.888 358 HH22 ARG 44 HH22 ARG 44 -8.605 1.877 13.629 359 H GLU 45 H GLU 45 -3.197 3.021 9.876 360 HA GLU 45 HA GLU 45 -0.764 3.927 11.011 361 HB2 GLU 45 HB2 GLU 45 -2.251 5.000 9.254 362 HB3 GLU 45 HB3 GLU 45 -3.293 5.570 10.559 363 HG2 GLU 45 HG2 GLU 45 -0.311 6.188 10.321 364 HG3 GLU 45 HG3 GLU 45 -1.579 7.218 9.643 365 H GLU 46 H GLU 46 -3.805 3.087 12.458 366 HA GLU 46 HA GLU 46 -3.533 4.641 14.877 367 HB2 GLU 46 HB2 GLU 46 -5.677 3.767 13.982 368 HB3 GLU 46 HB3 GLU 46 -5.093 2.108 14.203 369 HG2 GLU 46 HG2 GLU 46 -4.968 2.458 16.638 370 HG3 GLU 46 HG3 GLU 46 -5.415 4.162 16.435 371 H ILE 47 H ILE 47 -2.851 1.203 13.985 372 HA ILE 47 HA ILE 47 -1.936 0.522 16.644 373 HB ILE 47 HB ILE 47 -1.945 -0.818 13.928 374 HG12 ILE 47 HG12 ILE 47 -3.323 -2.488 15.095 375 HG13 ILE 47 HG13 ILE 47 -3.080 -1.634 16.624 376 HG21 ILE 47 HG21 ILE 47 -0.677 -1.903 16.484 377 HG22 ILE 47 HG22 ILE 47 -1.013 -2.856 15.027 378 HG23 ILE 47 HG23 ILE 47 0.169 -1.539 14.959 379 HD11 ILE 47 HD11 ILE 47 -4.524 -0.482 14.202 380 HD12 ILE 47 HD12 ILE 47 -5.326 -1.213 15.606 381 HD13 ILE 47 HD13 ILE 47 -4.392 0.274 15.814 382 H TYR 48 H TYR 48 -0.474 1.910 13.763 383 HA TYR 48 HA TYR 48 2.212 1.127 14.216 384 HB2 TYR 48 HB2 TYR 48 1.252 2.113 12.149 385 HB3 TYR 48 HB3 TYR 48 1.102 3.669 12.964 386 HD1 TYR 48 HD2 TYR 48 3.570 1.075 11.890 387 HD2 TYR 48 HD1 TYR 48 2.927 5.160 13.079 388 HE1 TYR 48 HE2 TYR 48 5.891 1.625 11.224 389 HE2 TYR 48 HE1 TYR 48 5.215 5.736 12.378 390 HH TYR 48 HH TYR 48 7.193 4.963 11.478 391 H GLN 49 H GLN 49 0.267 3.829 15.552 392 HA GLN 49 HA GLN 49 2.485 5.220 16.737 393 HB2 GLN 49 HB2 GLN 49 -0.500 5.207 17.330 394 HB3 GLN 49 HB3 GLN 49 0.655 6.343 18.053 395 HG2 GLN 49 HG2 GLN 49 1.231 7.245 15.855 396 HG3 GLN 49 HG3 GLN 49 0.276 6.005 15.048 397 HE21 GLN 49 HE22 GLN 49 -1.034 7.541 13.981 398 HE22 GLN 49 HE21 GLN 49 -2.256 8.461 14.812 399 H ARG 50 H ARG 50 0.722 2.346 17.709 400 HA ARG 50 HA ARG 50 1.311 2.583 20.550 401 HB2 ARG 50 HB2 ARG 50 0.367 0.357 18.701 402 HB3 ARG 50 HB3 ARG 50 0.912 -0.013 20.330 403 HG2 ARG 50 HG2 ARG 50 -1.498 0.238 20.306 404 HG3 ARG 50 HG3 ARG 50 -0.763 1.523 21.282 405 HD2 ARG 50 HD2 ARG 50 -1.017 3.105 19.417 406 HD3 ARG 50 HD3 ARG 50 -1.674 1.805 18.396 407 HE ARG 50 HE ARG 50 -3.275 1.835 20.674 408 HH11 ARG 50 HH11 ARG 50 -2.488 4.133 18.104 409 HH12 ARG 50 HH12 ARG 50 -3.965 5.047 18.320 410 HH21 ARG 50 HH21 ARG 50 -5.198 3.016 20.898 411 HH22 ARG 50 HH22 ARG 50 -5.523 4.381 19.856 412 H ILE 51 H ILE 51 3.050 1.759 17.699 413 HA ILE 51 HA ILE 51 5.056 0.113 19.125 414 HB ILE 51 HB ILE 51 4.522 0.714 16.198 415 HG12 ILE 51 HG12 ILE 51 4.082 -1.864 17.764 416 HG13 ILE 51 HG13 ILE 51 2.799 -0.671 17.503 417 HG21 ILE 51 HG21 ILE 51 6.398 -1.333 17.445 418 HG22 ILE 51 HG22 ILE 51 6.141 -1.025 15.704 419 HG23 ILE 51 HG23 ILE 51 6.914 0.204 16.713 420 HD11 ILE 51 HD11 ILE 51 2.664 -2.404 15.816 421 HD12 ILE 51 HD12 ILE 51 3.073 -0.838 15.085 422 HD13 ILE 51 HD13 ILE 51 4.344 -2.085 15.308 423 H GLN 52 H GLN 52 4.628 3.220 17.392 424 HA GLN 52 HA GLN 52 7.501 3.728 17.366 425 HB2 GLN 52 HB2 GLN 52 5.160 5.585 16.756 426 HB3 GLN 52 HB3 GLN 52 6.869 5.927 16.436 427 HG2 GLN 52 HG2 GLN 52 5.065 3.942 15.072 428 HG3 GLN 52 HG3 GLN 52 6.140 5.161 14.365 429 HE21 GLN 52 HE22 GLN 52 5.795 1.913 15.457 430 HE22 GLN 52 HE21 GLN 52 7.453 1.383 15.263 431 H ALA 53 H ALA 53 5.409 3.647 19.859 432 HA ALA 53 HA ALA 53 6.110 6.010 21.305 433 HB1 ALA 53 HB1 ALA 53 5.217 3.259 22.263 434 HB2 ALA 53 HB2 ALA 53 5.129 4.781 23.184 435 HB3 ALA 53 HB3 ALA 53 4.144 4.559 21.712 436 H GLY 54 H GLY 54 8.002 3.304 20.361 437 HA2 GLY 54 HA2 GLY 54 10.434 3.884 20.891 438 HA3 GLY 54 HA3 GLY 54 9.941 3.779 22.588 439 H LEU 55 H LEU 55 9.155 1.649 19.732 440 HA LEU 55 HA LEU 55 10.134 -0.636 21.391 441 HB2 LEU 55 HB2 LEU 55 7.522 -0.468 19.864 442 HB3 LEU 55 HB3 LEU 55 8.048 -1.822 20.862 443 HG LEU 55 HG LEU 55 7.774 0.922 22.134 444 HD11 LEU 55 HD11 LEU 55 5.534 -0.964 21.375 445 HD12 LEU 55 HD12 LEU 55 5.385 0.408 22.519 446 HD13 LEU 55 HD13 LEU 55 5.814 0.700 20.817 447 HD21 LEU 55 HD21 LEU 55 8.713 -0.978 23.433 448 HD22 LEU 55 HD22 LEU 55 7.144 -0.443 24.076 449 HD23 LEU 55 HD23 LEU 55 7.248 -1.928 23.097 450 H THR 56 H THR 56 10.449 0.869 18.391 451 HA THR 56 HA THR 56 10.135 -1.380 16.638 452 HB THR 56 HB THR 56 11.455 0.041 15.052 453 HG1 THR 56 HG1 THR 56 11.975 2.133 15.801 454 HG21 THR 56 HG21 THR 56 8.980 0.239 15.353 455 HG22 THR 56 HG22 THR 56 9.253 1.521 16.560 456 HG23 THR 56 HG23 THR 56 9.756 1.761 14.863 457 H ALA 57 H ALA 57 12.440 -0.852 19.052 458 HA ALA 57 HA ALA 57 14.252 -2.869 17.900 459 HB1 ALA 57 HB1 ALA 57 15.199 -0.113 18.777 460 HB2 ALA 57 HB2 ALA 57 16.243 -1.479 18.337 461 HB3 ALA 57 HB3 ALA 57 15.189 -0.734 17.113 462 HA PRO 58 HA PRO 58 12.963 -3.410 22.384 463 HB2 PRO 58 HB2 PRO 58 13.552 -6.173 21.329 464 HB3 PRO 58 HB3 PRO 58 12.305 -5.669 22.509 465 HG2 PRO 58 HG2 PRO 58 11.591 -6.108 19.933 466 HG3 PRO 58 HG3 PRO 58 10.998 -4.633 20.766 467 HD2 PRO 58 HD2 PRO 58 13.320 -4.904 18.847 468 HD3 PRO 58 HD3 PRO 58 12.046 -3.648 18.904 469 H ASP 59 H ASP 59 14.159 -4.043 24.170 470 HA ASP 59 HA ASP 59 15.979 -4.356 25.464 471 HB2 ASP 59 HB2 ASP 59 15.610 -6.577 24.437 472 HB3 ASP 59 HB3 ASP 59 16.798 -6.205 23.197 473 H5' U 36 H5' U 36 -7.870 3.738 -15.190 474 H5'' U 36 H5'' U 36 -8.087 5.163 -14.155 475 H4' U 36 H4' U 36 -6.956 5.194 -16.985 476 H3' U 36 H3' U 36 -5.672 4.240 -14.760 477 H2' U 36 H2' U 36 -5.925 6.069 -13.363 478 HO2' U 36 HO2' U 36 -3.623 5.879 -13.805 479 H1' U 36 H1' U 36 -5.498 8.133 -15.464 480 H3 U 36 H3 U 36 -6.394 10.857 -11.953 481 H5 U 36 H5 U 36 -9.830 8.457 -12.281 482 H6 U 36 H6 U 36 -8.696 7.177 -14.002 483 HO5' U 36 HO5' U 36 -9.987 4.554 -15.345 484 H5' C 37 H5' C 37 -1.444 3.551 -17.421 485 H5'' C 37 H5'' C 37 -1.864 5.251 -17.198 486 H4' C 37 H4' C 37 -0.702 3.832 -19.587 487 H3' C 37 H3' C 37 0.421 5.536 -17.817 488 H2' C 37 H2' C 37 -1.278 7.169 -17.854 489 HO2' C 37 HO2' C 37 0.686 8.252 -18.305 490 H1' C 37 H1' C 37 -1.333 7.253 -20.843 491 H41 C 37 H41 C 37 -7.148 9.616 -19.810 492 H42 C 37 H42 C 37 -7.236 8.895 -18.213 493 H5 C 37 H5 C 37 -5.406 7.532 -17.271 494 H6 C 37 H6 C 37 -3.231 6.630 -17.703 495 H5' A 38 H5' A 38 2.934 7.129 -18.535 496 H5'' A 38 H5'' A 38 4.460 6.374 -19.041 497 H4' A 38 H4' A 38 4.748 7.495 -16.899 498 H3' A 38 H3' A 38 5.644 4.955 -17.353 499 H2' A 38 H2' A 38 3.660 3.855 -16.607 500 HO2' A 38 HO2' A 38 5.473 3.078 -15.380 501 H1' A 38 H1' A 38 3.576 5.646 -14.187 502 H8 A 38 H8 A 38 1.524 3.693 -16.839 503 H61 A 38 H61 A 38 -3.182 4.158 -12.818 504 H62 A 38 H62 A 38 -2.693 3.536 -14.381 505 H2 A 38 H2 A 38 0.276 6.405 -11.166 506 H5' G 39 H5' G 39 5.920 8.659 -14.733 507 H5'' G 39 H5'' G 39 7.246 9.596 -15.429 508 H4' G 39 H4' G 39 8.146 10.148 -13.327 509 H3' G 39 H3' G 39 8.134 7.671 -12.424 510 H2' G 39 H2' G 39 5.788 7.400 -13.048 511 HO2' G 39 HO2' G 39 6.009 7.686 -10.234 512 H1' G 39 H1' G 39 5.048 9.649 -11.217 513 H8 G 39 H8 G 39 3.571 7.238 -12.710 514 H1 G 39 H1 G 39 1.508 12.257 -16.141 515 H21 G 39 H21 G 39 2.988 13.915 -15.962 516 H22 G 39 H22 G 39 4.418 13.767 -14.964 517 H5' G 40 H5' G 40 7.290 11.011 -8.685 518 H5'' G 40 H5'' G 40 8.680 12.110 -8.687 519 H4' G 40 H4' G 40 7.761 11.476 -6.407 520 H3' G 40 H3' G 40 10.401 11.943 -7.000 521 H2' G 40 H2' G 40 10.751 9.597 -7.669 522 HO2' G 40 HO2' G 40 11.574 10.033 -4.982 523 H1' G 40 H1' G 40 9.385 8.900 -5.058 524 H8 G 40 H8 G 40 9.007 7.568 -8.696 525 H1 G 40 H1 G 40 11.778 3.556 -4.503 526 H21 G 40 H21 G 40 11.842 4.511 -2.488 527 H22 G 40 H22 G 40 11.194 6.108 -2.209 528 H5' A 41 H5' A 41 7.476 13.865 -3.763 529 H5'' A 41 H5'' A 41 7.259 12.629 -5.004 530 H4' A 41 H4' A 41 7.289 15.584 -5.684 531 H3' A 41 H3' A 41 5.046 13.916 -4.536 532 H2' A 41 H2' A 41 3.531 14.751 -6.125 533 HO2' A 41 HO2' A 41 4.170 16.981 -5.776 534 H1' A 41 H1' A 41 5.302 15.065 -8.265 535 H8 A 41 H8 A 41 4.407 12.125 -5.851 536 H61 A 41 H61 A 41 2.301 9.441 -11.054 537 H62 A 41 H62 A 41 2.363 9.285 -9.310 538 H2 A 41 H2 A 41 4.496 13.107 -12.178 539 H5' C 42 H5' C 42 2.109 14.527 -1.997 540 H5'' C 42 H5'' C 42 2.906 13.805 -3.411 541 H4' C 42 H4' C 42 1.255 14.705 -4.919 542 H3' C 42 H3' C 42 0.251 16.250 -2.513 543 H2' C 42 H2' C 42 -1.940 16.141 -3.519 544 HO2' C 42 HO2' C 42 -2.237 15.264 -5.578 545 H1' C 42 H1' C 42 -1.844 13.492 -4.034 546 H41 C 42 H41 C 42 -3.852 14.259 1.995 547 H42 C 42 H42 C 42 -2.206 14.053 2.563 548 H5 C 42 H5 C 42 -0.294 13.883 1.039 549 H6 C 42 H6 C 42 0.367 13.881 -1.318 550 H5' A 43 H5' A 43 -1.201 17.547 -7.098 551 H5'' A 43 H5'' A 43 0.236 16.641 -6.621 552 H4' A 43 H4' A 43 0.800 18.788 -8.565 553 H3' A 43 H3' A 43 -1.015 16.459 -9.186 554 H2' A 43 H2' A 43 0.140 16.174 -11.300 555 HO2' A 43 HO2' A 43 0.620 18.386 -11.744 556 H1' A 43 H1' A 43 2.519 15.980 -10.132 557 H8 A 43 H8 A 43 0.434 14.796 -7.223 558 H61 A 43 H61 A 43 -0.832 9.708 -10.524 559 H62 A 43 H62 A 43 -0.902 10.438 -8.930 560 H2 A 43 H2 A 43 1.066 12.639 -13.244 561 H5' U 44 H5' U 44 -5.182 17.390 -10.115 562 H5'' U 44 H5'' U 44 -4.043 17.964 -8.888 563 H4' U 44 H4' U 44 -5.427 16.234 -7.964 564 H3' U 44 H3' U 44 -2.650 16.247 -7.805 565 HO3' U 44 HO3' U 44 -4.190 16.179 -6.089 566 H2' U 44 H2' U 44 -2.032 14.342 -8.895 567 HO2' U 44 HO2' U 44 -2.094 13.467 -6.787 568 H1' U 44 H1' U 44 -4.531 12.870 -8.922 569 H3 U 44 H3 U 44 -4.222 11.478 -13.199 570 H5 U 44 H5 U 44 -1.356 14.554 -12.925 571 H6 U 44 H6 U 44 -2.074 14.971 -10.704 572 H1 MET 1 H1 MET 1 0.691 -11.750 4.888 573 H2 MET 1 H2 MET 1 0.730 -12.842 3.663 574 H3 MET 1 H3 MET 1 -0.245 -13.100 4.961 575 HA MET 1 HA MET 1 -0.517 -10.920 3.007 576 HB2 MET 1 HB2 MET 1 -1.154 -13.139 2.089 577 HB3 MET 1 HB3 MET 1 -2.203 -13.417 3.487 578 HG2 MET 1 HG2 MET 1 -3.569 -12.716 1.628 579 HG3 MET 1 HG3 MET 1 -3.573 -11.435 2.832 580 HE1 MET 1 HE1 MET 1 -4.630 -11.175 -0.090 581 HE2 MET 1 HE2 MET 1 -4.636 -9.841 1.081 582 HE3 MET 1 HE3 MET 1 -3.992 -9.572 -0.558 583 H LEU 2 H LEU 2 -1.879 -9.248 3.575 584 HA LEU 2 HA LEU 2 -3.643 -9.665 5.927 585 HB2 LEU 2 HB2 LEU 2 -1.388 -7.767 5.563 586 HB3 LEU 2 HB3 LEU 2 -2.900 -6.992 6.059 587 HG LEU 2 HG LEU 2 -1.549 -9.297 7.503 588 HD11 LEU 2 HD11 LEU 2 -1.040 -7.607 9.209 589 HD12 LEU 2 HD12 LEU 2 -0.328 -7.153 7.641 590 HD13 LEU 2 HD13 LEU 2 -1.812 -6.345 8.215 591 HD21 LEU 2 HD21 LEU 2 -3.988 -7.569 8.177 592 HD22 LEU 2 HD22 LEU 2 -3.996 -9.322 7.866 593 HD23 LEU 2 HD23 LEU 2 -3.185 -8.688 9.308 594 H ILE 3 H ILE 3 -5.528 -8.360 5.917 595 HA ILE 3 HA ILE 3 -6.022 -6.820 3.424 596 HB ILE 3 HB ILE 3 -7.876 -8.888 4.672 597 HG12 ILE 3 HG12 ILE 3 -7.836 -9.495 2.078 598 HG13 ILE 3 HG13 ILE 3 -6.283 -8.659 2.105 599 HG21 ILE 3 HG21 ILE 3 -8.382 -6.841 2.480 600 HG22 ILE 3 HG22 ILE 3 -9.464 -8.197 2.888 601 HG23 ILE 3 HG23 ILE 3 -9.180 -6.905 4.067 602 HD11 ILE 3 HD11 ILE 3 -7.125 -10.999 3.865 603 HD12 ILE 3 HD12 ILE 3 -6.065 -11.113 2.431 604 HD13 ILE 3 HD13 ILE 3 -5.501 -10.261 3.868 605 H LEU 4 H LEU 4 -7.191 -5.008 3.666 606 HA LEU 4 HA LEU 4 -7.993 -4.139 6.410 607 HB2 LEU 4 HB2 LEU 4 -6.110 -2.898 4.370 608 HB3 LEU 4 HB3 LEU 4 -7.033 -1.864 5.449 609 HG LEU 4 HG LEU 4 -4.789 -2.175 6.266 610 HD11 LEU 4 HD11 LEU 4 -5.349 -2.745 8.558 611 HD12 LEU 4 HD12 LEU 4 -6.667 -1.798 7.814 612 HD13 LEU 4 HD13 LEU 4 -6.826 -3.565 8.030 613 HD21 LEU 4 HD21 LEU 4 -4.441 -4.540 5.419 614 HD22 LEU 4 HD22 LEU 4 -3.878 -4.200 7.075 615 HD23 LEU 4 HD23 LEU 4 -5.386 -5.083 6.838 616 H THR 5 H THR 5 -9.464 -2.265 6.351 617 HA THR 5 HA THR 5 -10.576 -1.642 3.683 618 HB THR 5 HB THR 5 -12.523 -1.851 5.955 619 HG1 THR 5 HG1 THR 5 -11.547 -3.866 5.935 620 HG21 THR 5 HG21 THR 5 -12.818 -2.595 3.016 621 HG22 THR 5 HG22 THR 5 -14.081 -2.042 4.151 622 HG23 THR 5 HG23 THR 5 -12.886 -0.901 3.530 623 H ARG 6 H ARG 6 -9.730 0.315 3.537 624 HA ARG 6 HA ARG 6 -9.756 2.198 5.870 625 HB2 ARG 6 HB2 ARG 6 -7.580 1.284 4.821 626 HB3 ARG 6 HB3 ARG 6 -8.074 2.059 3.326 627 HG2 ARG 6 HG2 ARG 6 -6.581 3.559 4.182 628 HG3 ARG 6 HG3 ARG 6 -8.110 4.266 4.713 629 HD2 ARG 6 HD2 ARG 6 -6.464 2.371 6.453 630 HD3 ARG 6 HD3 ARG 6 -6.117 4.105 6.373 631 HE ARG 6 HE ARG 6 -8.885 3.764 6.968 632 HH11 ARG 6 HH11 ARG 6 -5.685 3.392 8.432 633 HH12 ARG 6 HH12 ARG 6 -6.283 3.638 10.058 634 HH21 ARG 6 HH21 ARG 6 -9.607 4.155 9.070 635 HH22 ARG 6 HH22 ARG 6 -8.496 4.081 10.420 636 H LYS 7 H LYS 7 -10.687 4.192 5.686 637 HA LYS 7 HA LYS 7 -12.268 4.713 3.264 638 HB2 LYS 7 HB2 LYS 7 -12.059 5.904 6.028 639 HB3 LYS 7 HB3 LYS 7 -12.549 6.942 4.686 640 HG2 LYS 7 HG2 LYS 7 -14.223 4.944 4.145 641 HG3 LYS 7 HG3 LYS 7 -14.015 4.624 5.884 642 HD2 LYS 7 HD2 LYS 7 -14.927 7.213 4.572 643 HD3 LYS 7 HD3 LYS 7 -15.924 6.105 5.519 644 HE2 LYS 7 HE2 LYS 7 -13.546 7.724 6.549 645 HE3 LYS 7 HE3 LYS 7 -15.251 8.103 6.819 646 HZ1 LYS 7 HZ1 LYS 7 -15.463 6.023 8.002 647 HZ2 LYS 7 HZ2 LYS 7 -13.867 5.685 7.764 648 HZ3 LYS 7 HZ3 LYS 7 -14.303 6.963 8.689 649 H VAL 8 H VAL 8 -12.175 6.761 2.148 650 HA VAL 8 HA VAL 8 -9.523 7.363 1.306 651 HB VAL 8 HB VAL 8 -10.488 9.171 0.030 652 HG11 VAL 8 HG11 VAL 8 -12.308 6.717 0.066 653 HG12 VAL 8 HG12 VAL 8 -12.087 7.838 -1.291 654 HG13 VAL 8 HG13 VAL 8 -10.731 6.819 -0.745 655 HG21 VAL 8 HG21 VAL 8 -12.872 9.675 0.074 656 HG22 VAL 8 HG22 VAL 8 -13.102 8.617 1.491 657 HG23 VAL 8 HG23 VAL 8 -12.121 10.096 1.623 658 H GLY 9 H GLY 9 -8.070 8.900 1.824 659 HA2 GLY 9 HA2 GLY 9 -7.278 10.866 2.814 660 HA3 GLY 9 HA3 GLY 9 -8.792 11.037 3.723 661 H GLU 10 H GLU 10 -7.839 7.830 4.096 662 HA GLU 10 HA GLU 10 -6.467 8.473 6.667 663 HB2 GLU 10 HB2 GLU 10 -7.972 5.986 5.819 664 HB3 GLU 10 HB3 GLU 10 -7.254 6.290 7.414 665 HG2 GLU 10 HG2 GLU 10 -8.731 8.257 7.693 666 HG3 GLU 10 HG3 GLU 10 -9.502 7.904 6.137 667 H SER 11 H SER 11 -5.110 6.268 7.320 668 HA SER 11 HA SER 11 -3.331 5.702 5.007 669 HB2 SER 11 HB2 SER 11 -2.465 6.971 7.626 670 HB3 SER 11 HB3 SER 11 -1.368 6.376 6.365 671 HG SER 11 HG SER 11 -3.295 8.441 6.117 672 H ILE 12 H ILE 12 -1.547 4.260 5.564 673 HA ILE 12 HA ILE 12 -1.963 2.316 7.747 674 HB ILE 12 HB ILE 12 -1.808 1.603 4.781 675 HG12 ILE 12 HG12 ILE 12 -4.098 1.301 6.763 676 HG13 ILE 12 HG13 ILE 12 -4.029 2.458 5.422 677 HG21 ILE 12 HG21 ILE 12 -2.098 -0.201 7.230 678 HG22 ILE 12 HG22 ILE 12 -2.105 -0.742 5.543 679 HG23 ILE 12 HG23 ILE 12 -0.636 -0.064 6.216 680 HD11 ILE 12 HD11 ILE 12 -3.915 0.589 3.801 681 HD12 ILE 12 HD12 ILE 12 -4.097 -0.567 5.144 682 HD13 ILE 12 HD13 ILE 12 -5.396 0.579 4.791 683 H ASN 13 H ASN 13 0.114 0.865 7.809 684 HA ASN 13 HA ASN 13 2.455 2.340 6.714 685 HB2 ASN 13 HB2 ASN 13 1.918 1.639 9.618 686 HB3 ASN 13 HB3 ASN 13 3.517 2.058 8.990 687 HD21 ASN 13 HD22 ASN 13 3.933 4.198 8.197 688 HD22 ASN 13 HD21 ASN 13 2.891 5.526 8.647 689 H ILE 14 H ILE 14 4.386 1.193 6.618 690 HA ILE 14 HA ILE 14 4.300 -1.731 7.105 691 HB ILE 14 HB ILE 14 5.168 -0.436 4.484 692 HG12 ILE 14 HG12 ILE 14 2.744 -2.175 5.110 693 HG13 ILE 14 HG13 ILE 14 2.710 -0.445 4.714 694 HG21 ILE 14 HG21 ILE 14 6.505 -2.420 5.083 695 HG22 ILE 14 HG22 ILE 14 5.013 -3.356 5.345 696 HG23 ILE 14 HG23 ILE 14 5.457 -2.778 3.716 697 HD11 ILE 14 HD11 ILE 14 2.109 -1.682 2.746 698 HD12 ILE 14 HD12 ILE 14 3.714 -0.963 2.491 699 HD13 ILE 14 HD13 ILE 14 3.550 -2.700 2.862 700 H GLY 15 H GLY 15 6.393 -2.637 7.422 701 HA2 GLY 15 HA2 GLY 15 8.505 -2.606 8.351 702 HA3 GLY 15 HA3 GLY 15 8.866 -1.340 7.163 703 H ASP 16 H ASP 16 10.062 0.017 8.420 704 HA ASP 16 HA ASP 16 8.604 1.422 10.600 705 HB2 ASP 16 HB2 ASP 16 11.558 0.685 10.535 706 HB3 ASP 16 HB3 ASP 16 10.754 1.643 11.790 707 H ASP 17 H ASP 17 9.377 1.697 7.557 708 HA ASP 17 HA ASP 17 10.136 4.548 7.710 709 HB2 ASP 17 HB2 ASP 17 11.634 2.460 6.076 710 HB3 ASP 17 HB3 ASP 17 11.871 4.203 5.958 711 H ILE 18 H ILE 18 7.799 2.523 6.719 712 HA ILE 18 HA ILE 18 7.456 3.998 4.154 713 HB ILE 18 HB ILE 18 6.676 1.103 4.637 714 HG12 ILE 18 HG12 ILE 18 8.380 0.896 2.599 715 HG13 ILE 18 HG13 ILE 18 9.103 2.332 3.337 716 HG21 ILE 18 HG21 ILE 18 6.518 2.901 2.189 717 HG22 ILE 18 HG22 ILE 18 6.218 1.151 2.187 718 HG23 ILE 18 HG23 ILE 18 5.155 2.217 3.108 719 HD11 ILE 18 HD11 ILE 18 8.514 -0.319 4.742 720 HD12 ILE 18 HD12 ILE 18 10.112 0.194 4.142 721 HD13 ILE 18 HD13 ILE 18 9.342 1.063 5.483 722 H THR 19 H THR 19 5.401 4.650 3.645 723 HA THR 19 HA THR 19 3.194 4.078 5.546 724 HB THR 19 HB THR 19 4.051 6.859 4.646 725 HG1 THR 19 HG1 THR 19 4.575 7.126 6.822 726 HG21 THR 19 HG21 THR 19 1.637 6.757 4.943 727 HG22 THR 19 HG22 THR 19 1.822 5.912 6.500 728 HG23 THR 19 HG23 THR 19 2.341 7.607 6.320 729 H ILE 20 H ILE 20 1.123 4.461 4.617 730 HA ILE 20 HA ILE 20 1.024 4.825 1.657 731 HB ILE 20 HB ILE 20 -0.416 2.729 3.333 732 HG12 ILE 20 HG12 ILE 20 1.984 2.180 2.944 733 HG13 ILE 20 HG13 ILE 20 0.863 1.029 2.213 734 HG21 ILE 20 HG21 ILE 20 -0.519 3.323 0.348 735 HG22 ILE 20 HG22 ILE 20 -1.218 1.883 1.123 736 HG23 ILE 20 HG23 ILE 20 -1.835 3.501 1.524 737 HD11 ILE 20 HD11 ILE 20 2.213 3.290 0.693 738 HD12 ILE 20 HD12 ILE 20 2.783 1.608 0.732 739 HD13 ILE 20 HD13 ILE 20 1.209 1.992 0.003 740 H THR 21 H THR 21 -0.764 6.006 0.987 741 HA THR 21 HA THR 21 -2.855 6.639 3.012 742 HB THR 21 HB THR 21 -1.390 8.730 1.357 743 HG1 THR 21 HG1 THR 21 -1.349 8.217 4.142 744 HG21 THR 21 HG21 THR 21 -2.696 10.328 2.698 745 HG22 THR 21 HG22 THR 21 -3.780 9.245 1.806 746 HG23 THR 21 HG23 THR 21 -3.506 8.988 3.543 747 H ILE 22 H ILE 22 -4.752 6.192 2.147 748 HA ILE 22 HA ILE 22 -5.138 5.911 -0.723 749 HB ILE 22 HB ILE 22 -6.283 4.366 0.599 750 HG12 ILE 22 HG12 ILE 22 -8.667 4.743 0.250 751 HG13 ILE 22 HG13 ILE 22 -8.385 6.478 0.002 752 HG21 ILE 22 HG21 ILE 22 -7.330 6.639 2.329 753 HG22 ILE 22 HG22 ILE 22 -7.813 4.930 2.447 754 HG23 ILE 22 HG23 ILE 22 -6.142 5.398 2.788 755 HD11 ILE 22 HD11 ILE 22 -7.253 4.267 -1.747 756 HD12 ILE 22 HD12 ILE 22 -8.664 5.302 -2.124 757 HD13 ILE 22 HD13 ILE 22 -7.048 6.019 -1.987 758 H LEU 23 H LEU 23 -5.050 7.796 -1.885 759 HA LEU 23 HA LEU 23 -5.741 10.314 -0.672 760 HB2 LEU 23 HB2 LEU 23 -5.331 9.717 -3.623 761 HB3 LEU 23 HB3 LEU 23 -5.244 11.288 -2.825 762 HG LEU 23 HG LEU 23 -3.325 8.943 -2.534 763 HD11 LEU 23 HD11 LEU 23 -3.036 10.396 -4.513 764 HD12 LEU 23 HD12 LEU 23 -2.998 11.829 -3.469 765 HD13 LEU 23 HD13 LEU 23 -1.694 10.630 -3.361 766 HD21 LEU 23 HD21 LEU 23 -2.017 10.408 -1.015 767 HD22 LEU 23 HD22 LEU 23 -3.370 11.568 -0.988 768 HD23 LEU 23 HD23 LEU 23 -3.574 9.938 -0.303 769 H GLY 24 H GLY 24 -7.567 7.987 -2.645 770 HA2 GLY 24 HA2 GLY 24 -10.046 8.644 -1.827 771 HA3 GLY 24 HA3 GLY 24 -9.788 9.895 -3.030 772 H VAL 25 H VAL 25 -11.771 8.709 -3.901 773 HA VAL 25 HA VAL 25 -10.863 6.614 -5.809 774 HB VAL 25 HB VAL 25 -12.845 5.318 -5.501 775 HG11 VAL 25 HG11 VAL 25 -11.817 6.041 -2.727 776 HG12 VAL 25 HG12 VAL 25 -12.636 4.540 -3.208 777 HG13 VAL 25 HG13 VAL 25 -11.026 4.917 -3.861 778 HG21 VAL 25 HG21 VAL 25 -14.498 7.045 -5.167 779 HG22 VAL 25 HG22 VAL 25 -14.583 5.884 -3.835 780 HG23 VAL 25 HG23 VAL 25 -13.804 7.460 -3.574 781 H SER 26 H SER 26 -12.213 6.387 -7.674 782 HA SER 26 HA SER 26 -14.149 8.520 -8.307 783 HB2 SER 26 HB2 SER 26 -11.594 8.070 -9.916 784 HB3 SER 26 HB3 SER 26 -12.965 9.069 -10.429 785 HG SER 26 HG SER 26 -11.306 10.294 -9.444 786 H GLY 27 H GLY 27 -15.659 6.766 -8.351 787 HA2 GLY 27 HA2 GLY 27 -16.893 5.201 -9.552 788 HA3 GLY 27 HA3 GLY 27 -15.690 5.299 -10.853 789 H GLN 28 H GLN 28 -14.188 3.657 -11.057 790 HA GLN 28 HA GLN 28 -14.051 1.679 -8.808 791 HB2 GLN 28 HB2 GLN 28 -13.130 1.310 -11.693 792 HB3 GLN 28 HB3 GLN 28 -13.132 0.114 -10.403 793 HG2 GLN 28 HG2 GLN 28 -15.530 1.347 -11.769 794 HG3 GLN 28 HG3 GLN 28 -14.996 -0.349 -11.771 795 HE21 GLN 28 HE22 GLN 28 -14.663 -1.153 -9.264 796 HE22 GLN 28 HE21 GLN 28 -16.045 -0.831 -8.244 797 H GLN 29 H GLN 29 -12.367 4.193 -10.509 798 HA GLN 29 HA GLN 29 -9.715 3.226 -9.977 799 HB2 GLN 29 HB2 GLN 29 -10.781 6.034 -10.509 800 HB3 GLN 29 HB3 GLN 29 -9.108 5.681 -10.134 801 HG2 GLN 29 HG2 GLN 29 -9.250 5.771 -12.489 802 HG3 GLN 29 HG3 GLN 29 -8.999 4.082 -12.045 803 HE21 GLN 29 HE22 GLN 29 -12.108 5.939 -11.938 804 HE22 GLN 29 HE21 GLN 29 -12.884 4.978 -13.179 805 H VAL 30 H VAL 30 -8.270 3.905 -8.401 806 HA VAL 30 HA VAL 30 -9.309 5.097 -5.906 807 HB VAL 30 HB VAL 30 -7.790 2.450 -6.141 808 HG11 VAL 30 HG11 VAL 30 -7.986 2.366 -3.710 809 HG12 VAL 30 HG12 VAL 30 -7.176 3.880 -4.169 810 HG13 VAL 30 HG13 VAL 30 -8.889 3.899 -3.699 811 HG21 VAL 30 HG21 VAL 30 -10.636 3.065 -5.238 812 HG22 VAL 30 HG22 VAL 30 -10.155 2.127 -6.672 813 HG23 VAL 30 HG23 VAL 30 -9.824 1.493 -5.050 814 H ARG 31 H ARG 31 -8.036 6.858 -5.827 815 HA ARG 31 HA ARG 31 -5.351 6.811 -7.004 816 HB2 ARG 31 HB2 ARG 31 -7.050 8.725 -7.147 817 HB3 ARG 31 HB3 ARG 31 -6.688 9.042 -5.434 818 HG2 ARG 31 HG2 ARG 31 -4.268 9.274 -6.041 819 HG3 ARG 31 HG3 ARG 31 -4.686 9.020 -7.752 820 HD2 ARG 31 HD2 ARG 31 -5.778 11.226 -5.981 821 HD3 ARG 31 HD3 ARG 31 -4.464 11.433 -7.164 822 HE ARG 31 HE ARG 31 -6.539 10.397 -8.655 823 HH11 ARG 31 HH11 ARG 31 -6.154 13.187 -6.517 824 HH12 ARG 31 HH12 ARG 31 -7.388 14.127 -7.323 825 HH21 ARG 31 HH21 ARG 31 -8.129 11.668 -9.713 826 HH22 ARG 31 HH22 ARG 31 -8.476 13.284 -9.144 827 H ILE 32 H ILE 32 -3.462 6.679 -5.819 828 HA ILE 32 HA ILE 32 -3.772 6.374 -2.866 829 HB ILE 32 HB ILE 32 -2.117 4.446 -4.499 830 HG12 ILE 32 HG12 ILE 32 -5.081 4.159 -3.858 831 HG13 ILE 32 HG13 ILE 32 -4.340 4.265 -5.468 832 HG21 ILE 32 HG21 ILE 32 -3.517 4.227 -1.796 833 HG22 ILE 32 HG22 ILE 32 -2.423 3.025 -2.508 834 HG23 ILE 32 HG23 ILE 32 -1.795 4.604 -2.031 835 HD11 ILE 32 HD11 ILE 32 -3.991 1.999 -3.479 836 HD12 ILE 32 HD12 ILE 32 -4.851 1.959 -5.031 837 HD13 ILE 32 HD13 ILE 32 -3.090 2.155 -5.016 838 H GLY 33 H GLY 33 -1.802 6.661 -1.683 839 HA2 GLY 33 HA2 GLY 33 0.475 7.774 -3.251 840 HA3 GLY 33 HA3 GLY 33 -0.119 8.559 -1.777 841 H ILE 34 H ILE 34 2.517 7.483 -2.286 842 HA ILE 34 HA ILE 34 2.717 5.494 -0.087 843 HB ILE 34 HB ILE 34 4.096 5.265 -2.799 844 HG12 ILE 34 HG12 ILE 34 1.886 3.492 -1.667 845 HG13 ILE 34 HG13 ILE 34 1.652 4.743 -2.908 846 HG21 ILE 34 HG21 ILE 34 5.475 4.414 -0.977 847 HG22 ILE 34 HG22 ILE 34 4.112 3.467 -0.341 848 HG23 ILE 34 HG23 ILE 34 4.855 3.045 -1.898 849 HD11 ILE 34 HD11 ILE 34 3.405 2.277 -3.198 850 HD12 ILE 34 HD12 ILE 34 1.850 2.595 -3.990 851 HD13 ILE 34 HD13 ILE 34 3.259 3.603 -4.383 852 H ASN 35 H ASN 35 4.664 5.634 1.057 853 HA ASN 35 HA ASN 35 6.494 7.822 0.238 854 HB2 ASN 35 HB2 ASN 35 4.573 8.635 1.669 855 HB3 ASN 35 HB3 ASN 35 5.197 7.651 2.980 856 HD21 ASN 35 HD22 ASN 35 4.916 10.671 2.423 857 HD22 ASN 35 HD21 ASN 35 6.498 11.335 2.765 858 H ALA 36 H ALA 36 8.325 6.721 0.036 859 HA ALA 36 HA ALA 36 9.395 5.286 2.389 860 HB1 ALA 36 HB1 ALA 36 8.302 3.535 1.035 861 HB2 ALA 36 HB2 ALA 36 9.190 4.090 -0.403 862 HB3 ALA 36 HB3 ALA 36 10.075 3.380 0.964 863 HA PRO 37 HA PRO 37 13.151 7.214 1.107 864 HB2 PRO 37 HB2 PRO 37 14.988 5.249 1.817 865 HB3 PRO 37 HB3 PRO 37 14.202 6.375 2.983 866 HG2 PRO 37 HG2 PRO 37 13.478 3.526 2.271 867 HG3 PRO 37 HG3 PRO 37 13.552 4.281 3.898 868 HD2 PRO 37 HD2 PRO 37 11.207 3.943 2.572 869 HD3 PRO 37 HD3 PRO 37 11.504 5.403 3.555 870 H LYS 38 H LYS 38 14.834 7.110 -0.510 871 HA LYS 38 HA LYS 38 14.171 5.461 -2.785 872 HB2 LYS 38 HB2 LYS 38 16.539 7.298 -2.190 873 HB3 LYS 38 HB3 LYS 38 16.212 6.578 -3.778 874 HG2 LYS 38 HG2 LYS 38 14.215 8.347 -2.286 875 HG3 LYS 38 HG3 LYS 38 15.348 8.946 -3.500 876 HD2 LYS 38 HD2 LYS 38 13.478 6.644 -4.161 877 HD3 LYS 38 HD3 LYS 38 12.902 8.310 -4.141 878 HE2 LYS 38 HE2 LYS 38 14.683 8.949 -5.741 879 HE3 LYS 38 HE3 LYS 38 15.282 7.276 -5.757 880 HZ1 LYS 38 HZ1 LYS 38 13.138 6.613 -6.645 881 HZ2 LYS 38 HZ2 LYS 38 12.624 8.182 -6.626 882 HZ3 LYS 38 HZ3 LYS 38 13.845 7.723 -7.624 883 H ASP 39 H ASP 39 15.657 4.738 0.030 884 HA ASP 39 HA ASP 39 17.695 2.871 -0.824 885 HB2 ASP 39 HB2 ASP 39 16.031 3.193 1.704 886 HB3 ASP 39 HB3 ASP 39 17.294 1.970 1.536 887 H VAL 40 H VAL 40 14.331 2.884 -1.204 888 HA VAL 40 HA VAL 40 14.314 -0.020 -1.780 889 HB VAL 40 HB VAL 40 12.139 -0.305 -0.729 890 HG11 VAL 40 HG11 VAL 40 12.739 -0.090 1.628 891 HG12 VAL 40 HG12 VAL 40 14.156 -0.638 0.702 892 HG13 VAL 40 HG13 VAL 40 14.028 1.062 1.235 893 HG21 VAL 40 HG21 VAL 40 12.414 2.536 0.305 894 HG22 VAL 40 HG22 VAL 40 11.342 2.065 -1.041 895 HG23 VAL 40 HG23 VAL 40 11.073 1.411 0.590 896 H ALA 41 H ALA 41 12.205 -0.529 -3.063 897 HA ALA 41 HA ALA 41 11.900 1.689 -5.035 898 HB1 ALA 41 HB1 ALA 41 13.142 -0.289 -5.857 899 HB2 ALA 41 HB2 ALA 41 11.753 -1.323 -5.446 900 HB3 ALA 41 HB3 ALA 41 11.594 -0.079 -6.705 901 H VAL 42 H VAL 42 9.856 1.833 -6.158 902 HA VAL 42 HA VAL 42 7.573 0.299 -5.206 903 HB VAL 42 HB VAL 42 7.428 1.861 -3.466 904 HG11 VAL 42 HG11 VAL 42 7.586 4.326 -3.773 905 HG12 VAL 42 HG12 VAL 42 9.106 3.477 -4.111 906 HG13 VAL 42 HG13 VAL 42 8.091 4.072 -5.455 907 HG21 VAL 42 HG21 VAL 42 5.308 1.635 -4.704 908 HG22 VAL 42 HG22 VAL 42 5.486 3.253 -3.979 909 HG23 VAL 42 HG23 VAL 42 5.747 3.039 -5.714 910 H HIS 43 H HIS 43 6.419 -0.148 -6.964 911 HA HIS 43 HA HIS 43 5.952 1.897 -9.013 912 HB2 HIS 43 HB2 HIS 43 7.068 -0.767 -9.915 913 HB3 HIS 43 HB3 HIS 43 6.839 0.717 -10.842 914 HD2 HIS 43 HD2 HIS 43 9.230 -0.947 -8.336 915 HE1 HIS 43 HE1 HIS 43 11.254 2.462 -9.873 916 HE2 HIS 43 HE2 HIS 43 11.498 0.373 -8.450 917 H ARG 44 H ARG 44 4.573 0.788 -10.848 918 HA ARG 44 HA ARG 44 2.314 -0.558 -9.611 919 HB2 ARG 44 HB2 ARG 44 3.042 0.065 -12.508 920 HB3 ARG 44 HB3 ARG 44 1.469 -0.530 -11.962 921 HG2 ARG 44 HG2 ARG 44 0.802 1.529 -11.394 922 HG3 ARG 44 HG3 ARG 44 2.204 1.777 -10.353 923 HD2 ARG 44 HD2 ARG 44 2.190 2.194 -13.367 924 HD3 ARG 44 HD3 ARG 44 1.993 3.471 -12.159 925 HE ARG 44 HE ARG 44 4.472 1.821 -12.485 926 HH11 ARG 44 HH11 ARG 44 2.914 4.912 -11.673 927 HH12 ARG 44 HH12 ARG 44 4.432 5.674 -11.259 928 HH21 ARG 44 HH21 ARG 44 6.420 2.897 -11.978 929 HH22 ARG 44 HH22 ARG 44 6.374 4.565 -11.459 930 H GLU 45 H GLU 45 1.502 -2.679 -10.464 931 HA GLU 45 HA GLU 45 3.512 -4.636 -10.128 932 HB2 GLU 45 HB2 GLU 45 1.020 -4.787 -9.710 933 HB3 GLU 45 HB3 GLU 45 0.782 -5.016 -11.440 934 HG2 GLU 45 HG2 GLU 45 2.540 -6.798 -9.686 935 HG3 GLU 45 HG3 GLU 45 0.827 -7.112 -9.987 936 H GLU 46 H GLU 46 2.440 -2.920 -12.967 937 HA GLU 46 HA GLU 46 3.309 -4.765 -14.976 938 HB2 GLU 46 HB2 GLU 46 1.748 -2.773 -15.231 939 HB3 GLU 46 HB3 GLU 46 3.147 -1.718 -15.025 940 HG2 GLU 46 HG2 GLU 46 2.664 -1.948 -17.393 941 HG3 GLU 46 HG3 GLU 46 4.189 -2.768 -17.055 942 H ILE 47 H ILE 47 4.880 -1.945 -13.376 943 HA ILE 47 HA ILE 47 7.243 -2.143 -15.061 944 HB ILE 47 HB ILE 47 6.876 -0.600 -12.478 945 HG12 ILE 47 HG12 ILE 47 4.981 0.020 -13.797 946 HG13 ILE 47 HG13 ILE 47 6.172 1.320 -13.934 947 HG21 ILE 47 HG21 ILE 47 8.624 -0.151 -14.931 948 HG22 ILE 47 HG22 ILE 47 8.470 0.980 -13.566 949 HG23 ILE 47 HG23 ILE 47 9.164 -0.627 -13.302 950 HD11 ILE 47 HD11 ILE 47 5.157 0.848 -16.106 951 HD12 ILE 47 HD12 ILE 47 6.880 0.403 -16.147 952 HD13 ILE 47 HD13 ILE 47 5.623 -0.858 -15.996 953 H TYR 48 H TYR 48 6.202 -3.460 -11.991 954 HA TYR 48 HA TYR 48 8.704 -3.887 -10.744 955 HB2 TYR 48 HB2 TYR 48 6.463 -4.008 -9.704 956 HB3 TYR 48 HB3 TYR 48 6.098 -5.455 -10.635 957 HD1 TYR 48 HD1 TYR 48 8.360 -4.076 -7.998 958 HD2 TYR 48 HD2 TYR 48 6.800 -7.604 -9.907 959 HE1 TYR 48 HE1 TYR 48 9.266 -5.463 -6.160 960 HE2 TYR 48 HE2 TYR 48 7.653 -8.991 -8.077 961 HH TYR 48 HH TYR 48 9.405 -7.581 -5.270 962 H GLN 49 H GLN 49 7.079 -5.617 -13.368 963 HA GLN 49 HA GLN 49 8.571 -8.062 -13.061 964 HB2 GLN 49 HB2 GLN 49 6.954 -6.885 -15.358 965 HB3 GLN 49 HB3 GLN 49 7.612 -8.533 -15.350 966 HG2 GLN 49 HG2 GLN 49 6.284 -9.141 -13.416 967 HG3 GLN 49 HG3 GLN 49 5.776 -7.468 -13.169 968 HE21 GLN 49 HE22 GLN 49 3.559 -8.104 -13.280 969 HE22 GLN 49 HE21 GLN 49 2.788 -8.445 -14.798 970 H ARG 50 H ARG 50 9.245 -4.963 -14.573 971 HA ARG 50 HA ARG 50 11.357 -5.953 -16.345 972 HB2 ARG 50 HB2 ARG 50 10.392 -3.226 -15.394 973 HB3 ARG 50 HB3 ARG 50 11.937 -3.403 -16.213 974 HG2 ARG 50 HG2 ARG 50 10.289 -2.817 -17.860 975 HG3 ARG 50 HG3 ARG 50 10.777 -4.501 -18.140 976 HD2 ARG 50 HD2 ARG 50 8.737 -5.301 -17.033 977 HD3 ARG 50 HD3 ARG 50 8.279 -3.630 -16.644 978 HE ARG 50 HE ARG 50 8.716 -3.876 -19.459 979 HH11 ARG 50 HH11 ARG 50 6.380 -4.829 -16.972 980 HH12 ARG 50 HH12 ARG 50 5.060 -4.929 -18.110 981 HH21 ARG 50 HH21 ARG 50 6.954 -4.024 -20.903 982 HH22 ARG 50 HH22 ARG 50 5.371 -4.467 -20.302 983 H ILE 51 H ILE 51 11.008 -5.340 -12.992 984 HA ILE 51 HA ILE 51 13.867 -4.645 -12.670 985 HB ILE 51 HB ILE 51 11.463 -4.506 -10.806 986 HG12 ILE 51 HG12 ILE 51 13.087 -2.320 -12.183 987 HG13 ILE 51 HG13 ILE 51 11.539 -2.928 -12.793 988 HG21 ILE 51 HG21 ILE 51 13.601 -4.891 -9.587 989 HG22 ILE 51 HG22 ILE 51 14.304 -3.479 -10.423 990 HG23 ILE 51 HG23 ILE 51 12.946 -3.277 -9.286 991 HD11 ILE 51 HD11 ILE 51 11.161 -0.895 -11.581 992 HD12 ILE 51 HD12 ILE 51 10.438 -2.252 -10.693 993 HD13 ILE 51 HD13 ILE 51 11.975 -1.537 -10.131 994 H GLN 52 H GLN 52 11.381 -6.987 -11.473 995 HA GLN 52 HA GLN 52 13.328 -8.456 -9.950 996 HB2 GLN 52 HB2 GLN 52 10.525 -9.190 -10.901 997 HB3 GLN 52 HB3 GLN 52 11.477 -10.120 -9.733 998 HG2 GLN 52 HG2 GLN 52 10.397 -7.312 -9.407 999 HG3 GLN 52 HG3 GLN 52 10.050 -8.767 -8.444 1000 HE21 GLN 52 HE22 GLN 52 11.754 -5.890 -8.454 1001 HE22 GLN 52 HE21 GLN 52 12.995 -6.294 -7.291 1002 H ALA 53 H ALA 53 13.226 -8.138 -13.207 1003 HA ALA 53 HA ALA 53 13.521 -10.829 -14.125 1004 HB1 ALA 53 HB1 ALA 53 13.011 -8.894 -15.582 1005 HB2 ALA 53 HB2 ALA 53 14.607 -8.201 -15.225 1006 HB3 ALA 53 HB3 ALA 53 14.486 -9.732 -16.116 1007 H GLY 54 H GLY 54 15.630 -8.834 -12.193 1008 HA2 GLY 54 HA2 GLY 54 17.431 -10.686 -11.471 1009 HA3 GLY 54 HA3 GLY 54 18.061 -10.246 -13.069 1010 H LEU 55 H LEU 55 16.488 -7.682 -11.225 1011 HA LEU 55 HA LEU 55 19.030 -6.626 -10.226 1012 HB2 LEU 55 HB2 LEU 55 18.901 -4.638 -11.780 1013 HB3 LEU 55 HB3 LEU 55 19.355 -6.180 -12.505 1014 HG LEU 55 HG LEU 55 16.892 -6.449 -13.208 1015 HD11 LEU 55 HD11 LEU 55 16.916 -3.454 -12.641 1016 HD12 LEU 55 HD12 LEU 55 15.676 -4.338 -13.556 1017 HD13 LEU 55 HD13 LEU 55 15.894 -4.665 -11.824 1018 HD21 LEU 55 HD21 LEU 55 17.284 -5.080 -15.202 1019 HD22 LEU 55 HD22 LEU 55 18.609 -4.232 -14.369 1020 HD23 LEU 55 HD23 LEU 55 18.739 -5.977 -14.724 1021 H THR 56 H THR 56 18.407 -3.970 -10.012 1022 HA THR 56 HA THR 56 15.733 -3.833 -8.722 1023 HB THR 56 HB THR 56 18.267 -2.781 -7.426 1024 HG1 THR 56 HG1 THR 56 18.003 -4.554 -6.031 1025 HG21 THR 56 HG21 THR 56 16.734 -2.751 -5.403 1026 HG22 THR 56 HG22 THR 56 16.295 -1.586 -6.659 1027 HG23 THR 56 HG23 THR 56 15.380 -3.104 -6.507 1028 H ALA 57 H ALA 57 18.012 -2.553 -10.868 1029 HA ALA 57 HA ALA 57 16.430 -0.100 -11.183 1030 HB1 ALA 57 HB1 ALA 57 19.427 -0.059 -10.626 1031 HB2 ALA 57 HB2 ALA 57 18.446 1.332 -11.145 1032 HB3 ALA 57 HB3 ALA 57 18.146 0.572 -9.567 1033 HA PRO 58 HA PRO 58 17.156 -2.046 -15.260 1034 HB2 PRO 58 HB2 PRO 58 15.599 0.501 -15.782 1035 HB3 PRO 58 HB3 PRO 58 15.449 -1.071 -16.618 1036 HG2 PRO 58 HG2 PRO 58 13.687 -0.434 -14.675 1037 HG3 PRO 58 HG3 PRO 58 14.453 -2.060 -14.620 1038 HD2 PRO 58 HD2 PRO 58 15.191 0.412 -13.044 1039 HD3 PRO 58 HD3 PRO 58 15.064 -1.284 -12.486 1040 H ASP 59 H ASP 59 17.688 1.355 -14.338 1041 HA ASP 59 HA ASP 59 20.178 1.518 -15.824 1042 HB2 ASP 59 HB2 ASP 59 18.491 1.663 -17.665 1043 HB3 ASP 59 HB3 ASP 59 17.693 2.970 -16.832 1044 H5' U 36 H5' U 36 -18.348 -6.075 8.522 1045 H5'' U 36 H5'' U 36 -17.888 -5.322 10.052 1046 H4' U 36 H4' U 36 -16.170 -6.887 9.427 1047 H3' U 36 H3' U 36 -15.568 -4.306 10.121 1048 H2' U 36 H2' U 36 -15.523 -3.445 7.905 1049 HO2' U 36 HO2' U 36 -12.897 -4.382 8.461 1050 H1' U 36 H1' U 36 -13.982 -5.898 7.021 1051 H3 U 36 H3 U 36 -14.429 -5.459 2.572 1052 H5 U 36 H5 U 36 -17.136 -2.618 4.070 1053 H6 U 36 H6 U 36 -16.650 -3.404 6.300 1054 HO5' U 36 HO5' U 36 -18.661 -3.803 8.521 1055 H5' C 37 H5' C 37 -12.601 -3.676 11.689 1056 H5'' C 37 H5'' C 37 -11.807 -5.183 12.142 1057 H4' C 37 H4' C 37 -11.351 -4.324 14.146 1058 H3' C 37 H3' C 37 -13.784 -5.354 14.644 1059 H2' C 37 H2' C 37 -15.149 -3.617 13.825 1060 HO2' C 37 HO2' C 37 -14.528 -2.894 16.499 1061 H1' C 37 H1' C 37 -13.607 -1.337 14.889 1062 H41 C 37 H41 C 37 -15.301 1.515 9.498 1063 H42 C 37 H42 C 37 -15.879 0.006 8.805 1064 H5 C 37 H5 C 37 -15.688 -2.145 9.978 1065 H6 C 37 H6 C 37 -14.918 -3.218 11.975 1066 H5' A 38 H5' A 38 -9.338 -5.169 17.003 1067 H5'' A 38 H5'' A 38 -9.975 -4.056 15.770 1068 H4' A 38 H4' A 38 -8.589 -6.700 15.141 1069 H3' A 38 H3' A 38 -7.233 -4.606 16.240 1070 H2' A 38 H2' A 38 -8.288 -2.956 14.840 1071 HO2' A 38 HO2' A 38 -5.821 -3.695 13.623 1072 H1' A 38 H1' A 38 -7.590 -4.729 12.485 1073 H8 A 38 H8 A 38 -9.884 -1.951 13.864 1074 H61 A 38 H61 A 38 -11.196 -0.855 7.906 1075 H62 A 38 H62 A 38 -11.378 -0.272 9.548 1076 H2 A 38 H2 A 38 -8.884 -4.651 8.143 1077 H5' G 39 H5' G 39 -7.661 -7.900 13.580 1078 H5'' G 39 H5'' G 39 -7.322 -9.270 14.652 1079 H4' G 39 H4' G 39 -7.533 -10.243 12.534 1080 H3' G 39 H3' G 39 -5.172 -10.657 13.739 1081 H2' G 39 H2' G 39 -4.012 -8.745 12.992 1082 HO2' G 39 HO2' G 39 -3.607 -10.723 11.020 1083 H1' G 39 H1' G 39 -4.965 -8.739 10.186 1084 H8 G 39 H8 G 39 -6.943 -6.204 11.039 1085 H1 G 39 H1 G 39 -1.085 -4.176 12.695 1086 H21 G 39 H21 G 39 0.308 -5.858 12.767 1087 H22 G 39 H22 G 39 -0.179 -7.500 12.393 1088 H5' G 40 H5' G 40 -4.472 -11.869 9.247 1089 H5'' G 40 H5'' G 40 -4.113 -13.597 9.275 1090 H4' G 40 H4' G 40 -2.757 -12.374 7.620 1091 H3' G 40 H3' G 40 -1.760 -14.306 9.416 1092 H2' G 40 H2' G 40 -0.654 -12.562 10.708 1093 HO2' G 40 HO2' G 40 1.093 -13.498 8.658 1094 H1' G 40 H1' G 40 -0.072 -11.387 7.958 1095 H8 G 40 H8 G 40 -0.924 -9.933 11.474 1096 H1 G 40 H1 G 40 4.669 -8.016 8.977 1097 H21 G 40 H21 G 40 5.033 -9.058 7.044 1098 H22 G 40 H22 G 40 3.875 -10.175 6.371 1099 H5' A 41 H5' A 41 -2.917 -14.983 4.910 1100 H5'' A 41 H5'' A 41 -3.242 -13.672 6.061 1101 H4' A 41 H4' A 41 -4.816 -16.258 6.095 1102 H3' A 41 H3' A 41 -5.035 -13.931 4.210 1103 H2' A 41 H2' A 41 -7.327 -13.654 4.575 1104 HO2' A 41 HO2' A 41 -7.793 -15.913 4.224 1105 H1' A 41 H1' A 41 -7.495 -14.481 7.224 1106 H8 A 41 H8 A 41 -5.368 -11.846 5.291 1107 H61 A 41 H61 A 41 -8.139 -7.836 9.169 1108 H62 A 41 H62 A 41 -7.096 -7.950 7.763 1109 H2 A 41 H2 A 41 -9.381 -11.913 10.294 1110 H5' C 42 H5' C 42 -7.066 -13.939 0.196 1111 H5'' C 42 H5'' C 42 -5.927 -13.240 1.371 1112 H4' C 42 H4' C 42 -7.693 -12.610 2.845 1113 H3' C 42 H3' C 42 -9.180 -14.571 1.549 1114 H2' C 42 H2' C 42 -9.973 -13.485 -0.254 1115 HO2' C 42 HO2' C 42 -11.452 -12.296 1.834 1116 H1' C 42 H1' C 42 -9.774 -10.705 0.718 1117 H41 C 42 H41 C 42 -9.143 -10.649 -5.654 1118 H42 C 42 H42 C 42 -7.537 -11.335 -5.507 1119 H5 C 42 H5 C 42 -6.582 -12.040 -3.354 1120 H6 C 42 H6 C 42 -7.025 -12.251 -0.994 1121 H5' A 43 H5' A 43 -12.840 -12.366 5.210 1122 H5'' A 43 H5'' A 43 -12.267 -13.804 4.332 1123 H4' A 43 H4' A 43 -14.352 -11.945 3.148 1124 H3' A 43 H3' A 43 -15.094 -13.188 5.379 1125 H2' A 43 H2' A 43 -13.901 -15.215 5.049 1126 HO2' A 43 HO2' A 43 -16.521 -15.589 3.981 1127 H1' A 43 H1' A 43 -14.840 -15.662 2.266 1128 H8 A 43 H8 A 43 -11.690 -14.816 1.346 1129 H61 A 43 H61 A 43 -9.082 -19.785 3.979 1130 H62 A 43 H62 A 43 -8.860 -18.502 2.803 1131 H2 A 43 H2 A 43 -13.117 -19.277 5.737 1132 H5' U 44 H5' U 44 -17.656 -11.718 0.683 1133 H5'' U 44 H5'' U 44 -16.612 -13.094 1.094 1134 H4' U 44 H4' U 44 -15.620 -10.467 -0.118 1135 H3' U 44 H3' U 44 -16.281 -13.170 -1.323 1136 HO3' U 44 HO3' U 44 -17.095 -11.782 -2.975 1137 H2' U 44 H2' U 44 -14.552 -12.756 -2.939 1138 HO2' U 44 HO2' U 44 -13.454 -10.722 -2.936 1139 H1' U 44 H1' U 44 -12.726 -11.988 -1.069 1140 H3 U 44 H3 U 44 -11.657 -16.247 -2.275 1141 H5 U 44 H5 U 44 -14.878 -16.681 0.396 1142 H6 U 44 H6 U 44 -15.131 -14.293 0.398 Start of MODEL 20 1 H1 MET 1 H1 MET 1 8.636 10.838 -2.684 2 H2 MET 1 H2 MET 1 8.647 9.249 -2.253 3 H3 MET 1 H3 MET 1 8.539 10.415 -1.096 4 HA MET 1 HA MET 1 6.416 9.372 -1.441 5 HB2 MET 1 HB2 MET 1 6.523 11.788 -0.783 6 HB3 MET 1 HB3 MET 1 6.562 12.235 -2.500 7 HG2 MET 1 HG2 MET 1 4.320 12.510 -1.731 8 HG3 MET 1 HG3 MET 1 4.350 11.127 -2.809 9 HE1 MET 1 HE1 MET 1 2.057 10.206 -2.084 10 HE2 MET 1 HE2 MET 1 1.481 10.251 -0.405 11 HE3 MET 1 HE3 MET 1 1.952 11.764 -1.238 12 H LEU 2 H LEU 2 4.876 8.524 -2.862 13 HA LEU 2 HA LEU 2 5.024 9.368 -5.691 14 HB2 LEU 2 HB2 LEU 2 5.626 6.691 -4.569 15 HB3 LEU 2 HB3 LEU 2 4.394 6.669 -5.847 16 HG LEU 2 HG LEU 2 7.186 7.820 -6.090 17 HD11 LEU 2 HD11 LEU 2 5.848 5.407 -7.390 18 HD12 LEU 2 HD12 LEU 2 7.531 5.957 -7.630 19 HD13 LEU 2 HD13 LEU 2 7.005 5.335 -6.047 20 HD21 LEU 2 HD21 LEU 2 4.907 7.599 -8.117 21 HD22 LEU 2 HD22 LEU 2 5.663 9.103 -7.541 22 HD23 LEU 2 HD23 LEU 2 6.604 7.974 -8.518 23 H ILE 3 H ILE 3 3.047 9.021 -6.833 24 HA ILE 3 HA ILE 3 0.704 8.234 -5.202 25 HB ILE 3 HB ILE 3 0.935 10.773 -6.882 26 HG12 ILE 3 HG12 ILE 3 -0.164 11.627 -4.642 27 HG13 ILE 3 HG13 ILE 3 0.520 10.155 -3.942 28 HG21 ILE 3 HG21 ILE 3 -1.505 9.485 -5.586 29 HG22 ILE 3 HG22 ILE 3 -1.446 11.085 -6.349 30 HG23 ILE 3 HG23 ILE 3 -1.207 9.630 -7.339 31 HD11 ILE 3 HD11 ILE 3 1.981 12.456 -5.307 32 HD12 ILE 3 HD12 ILE 3 2.020 12.022 -3.582 33 HD13 ILE 3 HD13 ILE 3 2.803 10.969 -4.767 34 H LEU 4 H LEU 4 -0.757 7.043 -6.307 35 HA LEU 4 HA LEU 4 -0.121 6.304 -9.127 36 HB2 LEU 4 HB2 LEU 4 -0.071 4.717 -6.580 37 HB3 LEU 4 HB3 LEU 4 -0.902 3.958 -7.924 38 HG LEU 4 HG LEU 4 1.426 3.239 -7.728 39 HD11 LEU 4 HD11 LEU 4 0.212 3.203 -9.871 40 HD12 LEU 4 HD12 LEU 4 0.835 4.824 -10.254 41 HD13 LEU 4 HD13 LEU 4 1.971 3.472 -10.098 42 HD21 LEU 4 HD21 LEU 4 2.394 5.424 -6.951 43 HD22 LEU 4 HD22 LEU 4 3.284 4.664 -8.287 44 HD23 LEU 4 HD23 LEU 4 2.211 6.033 -8.622 45 H THR 5 H THR 5 -1.924 5.208 -10.208 46 HA THR 5 HA THR 5 -4.459 5.197 -8.665 47 HB THR 5 HB THR 5 -4.589 5.893 -11.590 48 HG1 THR 5 HG1 THR 5 -3.240 7.463 -10.676 49 HG21 THR 5 HG21 THR 5 -6.598 5.229 -10.372 50 HG22 THR 5 HG22 THR 5 -6.267 6.427 -9.110 51 HG23 THR 5 HG23 THR 5 -6.676 6.964 -10.760 52 H ARG 6 H ARG 6 -5.350 3.322 -8.687 53 HA ARG 6 HA ARG 6 -5.003 1.408 -10.962 54 HB2 ARG 6 HB2 ARG 6 -4.895 0.919 -7.958 55 HB3 ARG 6 HB3 ARG 6 -5.073 -0.382 -9.138 56 HG2 ARG 6 HG2 ARG 6 -2.754 1.503 -9.500 57 HG3 ARG 6 HG3 ARG 6 -2.713 0.348 -8.150 58 HD2 ARG 6 HD2 ARG 6 -1.615 -0.533 -10.146 59 HD3 ARG 6 HD3 ARG 6 -2.967 -1.534 -9.598 60 HE ARG 6 HE ARG 6 -4.279 -0.173 -11.430 61 HH11 ARG 6 HH11 ARG 6 -0.997 -1.454 -11.656 62 HH12 ARG 6 HH12 ARG 6 -1.055 -1.614 -13.401 63 HH21 ARG 6 HH21 ARG 6 -4.333 -0.390 -13.674 64 HH22 ARG 6 HH22 ARG 6 -2.942 -0.987 -14.547 65 H LYS 7 H LYS 7 -6.800 -0.391 -10.589 66 HA LYS 7 HA LYS 7 -9.121 0.758 -9.151 67 HB2 LYS 7 HB2 LYS 7 -10.693 -0.005 -10.843 68 HB3 LYS 7 HB3 LYS 7 -9.650 1.256 -11.488 69 HG2 LYS 7 HG2 LYS 7 -8.414 -0.311 -12.804 70 HG3 LYS 7 HG3 LYS 7 -9.034 -1.700 -11.889 71 HD2 LYS 7 HD2 LYS 7 -10.795 0.119 -13.582 72 HD3 LYS 7 HD3 LYS 7 -10.104 -1.418 -14.134 73 HE2 LYS 7 HE2 LYS 7 -11.223 -2.595 -12.264 74 HE3 LYS 7 HE3 LYS 7 -11.998 -1.075 -11.775 75 HZ1 LYS 7 HZ1 LYS 7 -13.432 -2.394 -13.162 76 HZ2 LYS 7 HZ2 LYS 7 -13.039 -1.001 -13.952 77 HZ3 LYS 7 HZ3 LYS 7 -12.331 -2.414 -14.380 78 H VAL 8 H VAL 8 -10.934 -1.022 -9.105 79 HA VAL 8 HA VAL 8 -9.784 -2.864 -7.296 80 HB VAL 8 HB VAL 8 -11.931 -3.792 -6.991 81 HG11 VAL 8 HG11 VAL 8 -12.190 -0.812 -7.647 82 HG12 VAL 8 HG12 VAL 8 -13.205 -1.730 -6.528 83 HG13 VAL 8 HG13 VAL 8 -11.473 -1.477 -6.163 84 HG21 VAL 8 HG21 VAL 8 -12.755 -4.108 -9.274 85 HG22 VAL 8 HG22 VAL 8 -13.892 -3.180 -8.283 86 HG23 VAL 8 HG23 VAL 8 -12.869 -2.337 -9.487 87 H GLY 9 H GLY 9 -8.807 -4.707 -7.477 88 HA2 GLY 9 HA2 GLY 9 -8.661 -6.951 -8.323 89 HA3 GLY 9 HA3 GLY 9 -9.265 -6.387 -9.896 90 H GLU 10 H GLU 10 -7.044 -4.086 -8.835 91 HA GLU 10 HA GLU 10 -4.868 -5.377 -10.424 92 HB2 GLU 10 HB2 GLU 10 -5.468 -2.440 -9.953 93 HB3 GLU 10 HB3 GLU 10 -4.153 -3.096 -10.948 94 HG2 GLU 10 HG2 GLU 10 -5.837 -4.249 -12.380 95 HG3 GLU 10 HG3 GLU 10 -7.137 -3.503 -11.438 96 H SER 11 H SER 11 -2.648 -4.027 -9.772 97 HA SER 11 HA SER 11 -2.388 -4.134 -6.820 98 HB2 SER 11 HB2 SER 11 -0.927 -5.966 -8.756 99 HB3 SER 11 HB3 SER 11 -0.501 -5.762 -7.050 100 HG SER 11 HG SER 11 -2.992 -6.678 -8.063 101 H ILE 12 H ILE 12 -0.188 -3.696 -6.096 102 HA ILE 12 HA ILE 12 1.538 -2.077 -7.862 103 HB ILE 12 HB ILE 12 0.467 -1.168 -5.152 104 HG12 ILE 12 HG12 ILE 12 -0.056 -0.109 -7.961 105 HG13 ILE 12 HG13 ILE 12 -1.216 -0.952 -6.918 106 HG21 ILE 12 HG21 ILE 12 2.333 0.274 -7.099 107 HG22 ILE 12 HG22 ILE 12 1.701 0.936 -5.580 108 HG23 ILE 12 HG23 ILE 12 2.810 -0.419 -5.525 109 HD11 ILE 12 HD11 ILE 12 -0.015 1.789 -6.414 110 HD12 ILE 12 HD12 ILE 12 -1.700 1.400 -6.805 111 HD13 ILE 12 HD13 ILE 12 -1.025 0.894 -5.248 112 H ASN 13 H ASN 13 3.737 -1.758 -6.642 113 HA ASN 13 HA ASN 13 4.229 -4.037 -4.793 114 HB2 ASN 13 HB2 ASN 13 5.634 -3.492 -7.434 115 HB3 ASN 13 HB3 ASN 13 6.241 -4.607 -6.196 116 HD21 ASN 13 HD22 ASN 13 5.164 -6.593 -5.803 117 HD22 ASN 13 HD21 ASN 13 3.981 -7.222 -6.925 118 H ILE 14 H ILE 14 6.145 -3.918 -3.597 119 HA ILE 14 HA ILE 14 7.666 -1.376 -3.659 120 HB ILE 14 HB ILE 14 6.400 -2.560 -1.158 121 HG12 ILE 14 HG12 ILE 14 5.764 0.012 -2.662 122 HG13 ILE 14 HG13 ILE 14 4.732 -1.426 -2.600 123 HG21 ILE 14 HG21 ILE 14 8.067 -0.037 -1.561 124 HG22 ILE 14 HG22 ILE 14 7.320 -0.554 -0.035 125 HG23 ILE 14 HG23 ILE 14 8.612 -1.523 -0.751 126 HD11 ILE 14 HD11 ILE 14 5.457 0.382 -0.268 127 HD12 ILE 14 HD12 ILE 14 3.875 0.177 -1.025 128 HD13 ILE 14 HD13 ILE 14 4.589 -1.169 -0.113 129 H GLY 15 H GLY 15 9.795 -1.606 -2.837 130 HA2 GLY 15 HA2 GLY 15 11.792 -2.733 -2.606 131 HA3 GLY 15 HA3 GLY 15 10.892 -3.807 -1.517 132 H ASP 16 H ASP 16 11.730 -5.754 -2.121 133 HA ASP 16 HA ASP 16 10.988 -6.706 -4.843 134 HB2 ASP 16 HB2 ASP 16 13.540 -7.283 -3.295 135 HB3 ASP 16 HB3 ASP 16 13.033 -8.159 -4.746 136 H ASP 17 H ASP 17 10.022 -6.780 -1.827 137 HA ASP 17 HA ASP 17 9.302 -9.649 -1.860 138 HB2 ASP 17 HB2 ASP 17 10.535 -8.197 0.515 139 HB3 ASP 17 HB3 ASP 17 9.855 -9.826 0.547 140 H ILE 18 H ILE 18 8.072 -6.630 -2.004 141 HA ILE 18 HA ILE 18 5.810 -7.381 -0.214 142 HB ILE 18 HB ILE 18 6.849 -4.560 -0.651 143 HG12 ILE 18 HG12 ILE 18 7.059 -4.858 1.985 144 HG13 ILE 18 HG13 ILE 18 7.298 -6.560 1.560 145 HG21 ILE 18 HG21 ILE 18 4.605 -5.698 1.053 146 HG22 ILE 18 HG22 ILE 18 5.196 -4.027 1.147 147 HG23 ILE 18 HG23 ILE 18 4.438 -4.613 -0.345 148 HD11 ILE 18 HD11 ILE 18 9.195 -5.904 0.086 149 HD12 ILE 18 HD12 ILE 18 8.865 -4.194 0.445 150 HD13 ILE 18 HD13 ILE 18 9.434 -5.288 1.734 151 H THR 19 H THR 19 3.768 -6.962 -0.973 152 HA THR 19 HA THR 19 3.422 -5.681 -3.620 153 HB THR 19 HB THR 19 2.356 -8.436 -2.865 154 HG1 THR 19 HG1 THR 19 4.546 -8.459 -3.420 155 HG21 THR 19 HG21 THR 19 2.076 -6.773 -5.399 156 HG22 THR 19 HG22 THR 19 1.646 -8.496 -5.268 157 HG23 THR 19 HG23 THR 19 0.768 -7.295 -4.312 158 H ILE 20 H ILE 20 1.249 -4.997 -3.988 159 HA ILE 20 HA ILE 20 -0.533 -4.905 -1.602 160 HB ILE 20 HB ILE 20 0.248 -2.599 -3.435 161 HG12 ILE 20 HG12 ILE 20 2.021 -3.153 -1.791 162 HG13 ILE 20 HG13 ILE 20 1.322 -1.550 -1.561 163 HG21 ILE 20 HG21 ILE 20 -1.676 -2.717 -1.080 164 HG22 ILE 20 HG22 ILE 20 -1.122 -1.215 -1.865 165 HG23 ILE 20 HG23 ILE 20 -2.073 -2.386 -2.780 166 HD11 ILE 20 HD11 ILE 20 0.516 -4.005 0.056 167 HD12 ILE 20 HD12 ILE 20 1.680 -2.777 0.582 168 HD13 ILE 20 HD13 ILE 20 -0.018 -2.328 0.325 169 H THR 21 H THR 21 -2.735 -4.921 -2.150 170 HA THR 21 HA THR 21 -3.417 -4.927 -5.052 171 HB THR 21 HB THR 21 -4.272 -7.072 -3.067 172 HG1 THR 21 HG1 THR 21 -2.497 -7.199 -5.275 173 HG21 THR 21 HG21 THR 21 -4.679 -6.836 -6.082 174 HG22 THR 21 HG22 THR 21 -5.178 -8.207 -5.064 175 HG23 THR 21 HG23 THR 21 -5.950 -6.625 -4.857 176 H ILE 22 H ILE 22 -5.507 -4.267 -5.503 177 HA ILE 22 HA ILE 22 -6.987 -3.047 -3.228 178 HB ILE 22 HB ILE 22 -6.311 -1.343 -4.673 179 HG12 ILE 22 HG12 ILE 22 -8.288 -0.417 -5.664 180 HG13 ILE 22 HG13 ILE 22 -9.066 -2.008 -5.761 181 HG21 ILE 22 HG21 ILE 22 -6.656 -1.358 -7.127 182 HG22 ILE 22 HG22 ILE 22 -5.502 -2.580 -6.577 183 HG23 ILE 22 HG23 ILE 22 -7.162 -3.058 -7.029 184 HD11 ILE 22 HD11 ILE 22 -9.934 -0.660 -3.901 185 HD12 ILE 22 HD12 ILE 22 -9.181 -2.174 -3.360 186 HD13 ILE 22 HD13 ILE 22 -8.306 -0.623 -3.175 187 H LEU 23 H LEU 23 -8.262 -4.695 -2.519 188 HA LEU 23 HA LEU 23 -9.306 -6.708 -4.253 189 HB2 LEU 23 HB2 LEU 23 -10.306 -6.012 -1.481 190 HB3 LEU 23 HB3 LEU 23 -10.410 -7.563 -2.312 191 HG LEU 23 HG LEU 23 -7.907 -6.227 -1.203 192 HD11 LEU 23 HD11 LEU 23 -9.338 -8.841 -0.578 193 HD12 LEU 23 HD12 LEU 23 -7.841 -8.275 0.194 194 HD13 LEU 23 HD13 LEU 23 -9.357 -7.380 0.442 195 HD21 LEU 23 HD21 LEU 23 -7.309 -7.416 -3.297 196 HD22 LEU 23 HD22 LEU 23 -6.694 -8.261 -1.856 197 HD23 LEU 23 HD23 LEU 23 -8.137 -8.873 -2.693 198 H GLY 24 H GLY 24 -10.607 -3.566 -3.211 199 HA2 GLY 24 HA2 GLY 24 -12.448 -3.255 -5.189 200 HA3 GLY 24 HA3 GLY 24 -13.349 -4.241 -4.058 201 H VAL 25 H VAL 25 -14.677 -2.100 -4.269 202 HA VAL 25 HA VAL 25 -13.929 -0.393 -1.962 203 HB VAL 25 HB VAL 25 -14.447 1.640 -3.101 204 HG11 VAL 25 HG11 VAL 25 -12.150 0.766 -3.455 205 HG12 VAL 25 HG12 VAL 25 -12.698 0.016 -4.976 206 HG13 VAL 25 HG13 VAL 25 -12.721 1.786 -4.795 207 HG21 VAL 25 HG21 VAL 25 -16.290 0.909 -4.511 208 HG22 VAL 25 HG22 VAL 25 -15.066 1.733 -5.488 209 HG23 VAL 25 HG23 VAL 25 -15.172 -0.042 -5.527 210 H SER 26 H SER 26 -15.730 0.886 -1.149 211 HA SER 26 HA SER 26 -18.447 0.155 -1.996 212 HB2 SER 26 HB2 SER 26 -17.819 -1.610 -0.361 213 HB3 SER 26 HB3 SER 26 -17.474 -0.356 0.845 214 HG SER 26 HG SER 26 -19.599 -1.197 1.026 215 H GLY 27 H GLY 27 -18.634 2.373 -2.579 216 HA2 GLY 27 HA2 GLY 27 -19.271 4.564 -2.126 217 HA3 GLY 27 HA3 GLY 27 -19.254 4.164 -0.393 218 H GLN 28 H GLN 28 -17.531 4.858 0.858 219 HA GLN 28 HA GLN 28 -15.207 6.036 -0.607 220 HB2 GLN 28 HB2 GLN 28 -16.076 6.429 2.289 221 HB3 GLN 28 HB3 GLN 28 -14.713 7.211 1.485 222 HG2 GLN 28 HG2 GLN 28 -17.662 7.639 1.023 223 HG3 GLN 28 HG3 GLN 28 -16.416 8.801 1.532 224 HE21 GLN 28 HE22 GLN 28 -14.406 8.568 -0.284 225 HE22 GLN 28 HE21 GLN 28 -14.965 8.819 -1.928 226 H GLN 29 H GLN 29 -16.266 3.402 1.396 227 HA GLN 29 HA GLN 29 -13.700 2.789 2.557 228 HB2 GLN 29 HB2 GLN 29 -16.187 1.135 1.974 229 HB3 GLN 29 HB3 GLN 29 -14.750 0.472 2.754 230 HG2 GLN 29 HG2 GLN 29 -16.270 2.907 3.781 231 HG3 GLN 29 HG3 GLN 29 -16.509 1.260 4.371 232 HE21 GLN 29 HE22 GLN 29 -15.568 3.636 5.852 233 HE22 GLN 29 HE21 GLN 29 -13.997 3.204 6.498 234 H VAL 30 H VAL 30 -12.171 1.339 1.872 235 HA VAL 30 HA VAL 30 -12.249 0.377 -0.931 236 HB VAL 30 HB VAL 30 -10.032 2.025 0.362 237 HG11 VAL 30 HG11 VAL 30 -8.859 1.789 -1.750 238 HG12 VAL 30 HG12 VAL 30 -9.247 0.166 -1.145 239 HG13 VAL 30 HG13 VAL 30 -10.225 0.884 -2.448 240 HG21 VAL 30 HG21 VAL 30 -11.877 3.450 -0.415 241 HG22 VAL 30 HG22 VAL 30 -10.490 3.604 -1.520 242 HG23 VAL 30 HG23 VAL 30 -11.893 2.603 -1.976 243 H ARG 31 H ARG 31 -12.018 -1.751 -0.688 244 HA ARG 31 HA ARG 31 -10.702 -2.853 1.697 245 HB2 ARG 31 HB2 ARG 31 -12.828 -3.769 0.642 246 HB3 ARG 31 HB3 ARG 31 -11.842 -4.288 -0.743 247 HG2 ARG 31 HG2 ARG 31 -10.418 -5.625 0.803 248 HG3 ARG 31 HG3 ARG 31 -11.423 -5.099 2.174 249 HD2 ARG 31 HD2 ARG 31 -13.405 -6.119 1.137 250 HD3 ARG 31 HD3 ARG 31 -12.426 -6.646 -0.242 251 HE ARG 31 HE ARG 31 -11.913 -7.550 2.571 252 HH11 ARG 31 HH11 ARG 31 -12.369 -8.319 -0.856 253 HH12 ARG 31 HH12 ARG 31 -11.872 -9.982 -0.663 254 HH21 ARG 31 HH21 ARG 31 -11.291 -9.733 2.784 255 HH22 ARG 31 HH22 ARG 31 -11.327 -10.787 1.392 256 H ILE 32 H ILE 32 -8.619 -3.510 1.770 257 HA ILE 32 HA ILE 32 -7.091 -3.555 -0.787 258 HB ILE 32 HB ILE 32 -6.047 -2.248 1.743 259 HG12 ILE 32 HG12 ILE 32 -7.660 -0.957 -0.486 260 HG13 ILE 32 HG13 ILE 32 -8.013 -0.999 1.253 261 HG21 ILE 32 HG21 ILE 32 -4.477 -1.195 0.194 262 HG22 ILE 32 HG22 ILE 32 -4.430 -2.941 -0.034 263 HG23 ILE 32 HG23 ILE 32 -5.316 -1.929 -1.200 264 HD11 ILE 32 HD11 ILE 32 -5.742 0.510 -0.097 265 HD12 ILE 32 HD12 ILE 32 -7.172 1.184 0.699 266 HD13 ILE 32 HD13 ILE 32 -5.939 0.344 1.668 267 H GLY 33 H GLY 33 -5.117 -4.776 -0.666 268 HA2 GLY 33 HA2 GLY 33 -4.865 -6.544 1.714 269 HA3 GLY 33 HA3 GLY 33 -4.800 -7.198 0.066 270 H ILE 34 H ILE 34 -2.745 -7.383 2.024 271 HA ILE 34 HA ILE 34 -0.518 -5.945 0.677 272 HB ILE 34 HB ILE 34 -0.928 -6.119 3.700 273 HG12 ILE 34 HG12 ILE 34 -1.094 -3.646 1.922 274 HG13 ILE 34 HG13 ILE 34 -2.491 -4.497 2.600 275 HG21 ILE 34 HG21 ILE 34 1.078 -4.640 3.779 276 HG22 ILE 34 HG22 ILE 34 1.422 -6.203 3.044 277 HG23 ILE 34 HG23 ILE 34 1.225 -4.773 2.010 278 HD11 ILE 34 HD11 ILE 34 -1.996 -2.613 4.017 279 HD12 ILE 34 HD12 ILE 34 -1.629 -4.118 4.888 280 HD13 ILE 34 HD13 ILE 34 -0.309 -3.131 4.209 281 H ASN 35 H ASN 35 1.399 -7.121 0.661 282 HA ASN 35 HA ASN 35 1.322 -9.784 1.961 283 HB2 ASN 35 HB2 ASN 35 0.304 -9.809 -0.354 284 HB3 ASN 35 HB3 ASN 35 1.877 -9.362 -1.000 285 HD21 ASN 35 HD22 ASN 35 0.160 -11.813 -1.308 286 HD22 ASN 35 HD21 ASN 35 1.155 -13.167 -0.818 287 H ALA 36 H ALA 36 3.033 -9.618 3.240 288 HA ALA 36 HA ALA 36 5.690 -9.154 2.027 289 HB1 ALA 36 HB1 ALA 36 4.985 -6.924 2.837 290 HB2 ALA 36 HB2 ALA 36 4.624 -7.627 4.439 291 HB3 ALA 36 HB3 ALA 36 6.294 -7.594 3.843 292 HA PRO 37 HA PRO 37 6.837 -12.361 4.857 293 HB2 PRO 37 HB2 PRO 37 9.411 -11.561 5.499 294 HB3 PRO 37 HB3 PRO 37 8.952 -12.364 3.950 295 HG2 PRO 37 HG2 PRO 37 9.346 -9.423 4.548 296 HG3 PRO 37 HG3 PRO 37 9.932 -10.358 3.129 297 HD2 PRO 37 HD2 PRO 37 7.693 -8.825 3.010 298 HD3 PRO 37 HD3 PRO 37 7.771 -10.403 2.170 299 H LYS 38 H LYS 38 7.301 -12.755 7.141 300 HA LYS 38 HA LYS 38 6.395 -10.626 8.893 301 HB2 LYS 38 HB2 LYS 38 7.496 -13.425 9.411 302 HB3 LYS 38 HB3 LYS 38 6.860 -12.366 10.684 303 HG2 LYS 38 HG2 LYS 38 5.259 -13.172 8.214 304 HG3 LYS 38 HG3 LYS 38 5.186 -14.048 9.750 305 HD2 LYS 38 HD2 LYS 38 4.704 -11.050 9.696 306 HD3 LYS 38 HD3 LYS 38 3.447 -12.153 9.177 307 HE2 LYS 38 HE2 LYS 38 4.899 -12.330 11.864 308 HE3 LYS 38 HE3 LYS 38 3.355 -11.498 11.616 309 HZ1 LYS 38 HZ1 LYS 38 3.835 -14.368 11.157 310 HZ2 LYS 38 HZ2 LYS 38 3.009 -13.720 12.412 311 HZ3 LYS 38 HZ3 LYS 38 2.420 -13.582 10.879 312 H ASP 39 H ASP 39 9.248 -11.149 7.405 313 HA ASP 39 HA ASP 39 11.145 -10.274 9.403 314 HB2 ASP 39 HB2 ASP 39 11.094 -10.187 6.363 315 HB3 ASP 39 HB3 ASP 39 12.470 -9.641 7.324 316 H VAL 40 H VAL 40 8.512 -8.727 7.957 317 HA VAL 40 HA VAL 40 9.507 -6.075 8.802 318 HB VAL 40 HB VAL 40 8.577 -5.009 6.826 319 HG11 VAL 40 HG11 VAL 40 10.331 -7.356 5.974 320 HG12 VAL 40 HG12 VAL 40 10.131 -5.822 5.113 321 HG13 VAL 40 HG13 VAL 40 10.944 -5.849 6.703 322 HG21 VAL 40 HG21 VAL 40 6.764 -6.687 6.377 323 HG22 VAL 40 HG22 VAL 40 7.706 -6.235 4.935 324 HG23 VAL 40 HG23 VAL 40 8.014 -7.791 5.742 325 H ALA 41 H ALA 41 7.530 -4.522 8.901 326 HA ALA 41 HA ALA 41 5.330 -6.116 10.134 327 HB1 ALA 41 HB1 ALA 41 5.093 -4.226 11.703 328 HB2 ALA 41 HB2 ALA 41 6.728 -4.916 11.764 329 HB3 ALA 41 HB3 ALA 41 6.443 -3.389 10.899 330 H VAL 42 H VAL 42 3.191 -5.123 10.126 331 HA VAL 42 HA VAL 42 2.724 -2.825 8.391 332 HB VAL 42 HB VAL 42 2.719 -4.312 6.599 333 HG11 VAL 42 HG11 VAL 42 1.378 -6.356 8.401 334 HG12 VAL 42 HG12 VAL 42 1.589 -6.551 6.643 335 HG13 VAL 42 HG13 VAL 42 3.010 -6.419 7.693 336 HG21 VAL 42 HG21 VAL 42 0.404 -4.631 5.920 337 HG22 VAL 42 HG22 VAL 42 -0.158 -4.408 7.585 338 HG23 VAL 42 HG23 VAL 42 0.593 -3.046 6.718 339 H HIS 43 H HIS 43 1.090 -1.683 9.216 340 HA HIS 43 HA HIS 43 -1.194 -3.008 10.475 341 HB2 HIS 43 HB2 HIS 43 0.176 -0.871 12.116 342 HB3 HIS 43 HB3 HIS 43 -1.009 -2.075 12.601 343 HD2 HIS 43 HD2 HIS 43 2.778 -1.754 11.874 344 HE1 HIS 43 HE1 HIS 43 2.214 -5.305 14.138 345 HE2 HIS 43 HE2 HIS 43 3.939 -3.731 13.137 346 H ARG 44 H ARG 44 -2.792 -1.194 11.257 347 HA ARG 44 HA ARG 44 -3.066 0.806 9.164 348 HB2 ARG 44 HB2 ARG 44 -4.517 0.360 11.813 349 HB3 ARG 44 HB3 ARG 44 -5.014 1.512 10.555 350 HG2 ARG 44 HG2 ARG 44 -5.291 -0.318 8.941 351 HG3 ARG 44 HG3 ARG 44 -4.751 -1.501 10.146 352 HD2 ARG 44 HD2 ARG 44 -7.192 0.288 10.437 353 HD3 ARG 44 HD3 ARG 44 -7.227 -1.407 9.921 354 HE ARG 44 HE ARG 44 -6.450 -2.086 12.102 355 HH11 ARG 44 HH11 ARG 44 -7.386 1.340 11.892 356 HH12 ARG 44 HH12 ARG 44 -7.606 1.462 13.630 357 HH21 ARG 44 HH21 ARG 44 -6.818 -1.839 14.338 358 HH22 ARG 44 HH22 ARG 44 -7.306 -0.273 14.965 359 H GLU 45 H GLU 45 -3.221 3.185 9.728 360 HA GLU 45 HA GLU 45 -0.806 4.001 10.941 361 HB2 GLU 45 HB2 GLU 45 -2.246 5.183 9.220 362 HB3 GLU 45 HB3 GLU 45 -3.317 5.695 10.523 363 HG2 GLU 45 HG2 GLU 45 -0.331 6.309 10.357 364 HG3 GLU 45 HG3 GLU 45 -1.598 7.396 9.780 365 H GLU 46 H GLU 46 -3.999 3.395 12.292 366 HA GLU 46 HA GLU 46 -3.720 4.800 14.760 367 HB2 GLU 46 HB2 GLU 46 -5.837 3.871 13.786 368 HB3 GLU 46 HB3 GLU 46 -5.227 2.236 14.095 369 HG2 GLU 46 HG2 GLU 46 -5.162 2.717 16.524 370 HG3 GLU 46 HG3 GLU 46 -5.683 4.378 16.219 371 H ILE 47 H ILE 47 -2.697 1.549 13.688 372 HA ILE 47 HA ILE 47 -2.046 0.775 16.460 373 HB ILE 47 HB ILE 47 -1.786 -0.761 13.861 374 HG12 ILE 47 HG12 ILE 47 -4.089 -0.197 13.998 375 HG13 ILE 47 HG13 ILE 47 -3.939 -1.869 14.549 376 HG21 ILE 47 HG21 ILE 47 -1.898 -1.647 16.778 377 HG22 ILE 47 HG22 ILE 47 -1.926 -2.745 15.377 378 HG23 ILE 47 HG23 ILE 47 -0.495 -1.741 15.693 379 HD11 ILE 47 HD11 ILE 47 -5.472 -0.678 16.013 380 HD12 ILE 47 HD12 ILE 47 -3.984 -1.030 16.920 381 HD13 ILE 47 HD13 ILE 47 -4.287 0.610 16.279 382 H TYR 48 H TYR 48 -0.467 1.792 13.475 383 HA TYR 48 HA TYR 48 2.125 0.784 13.858 384 HB2 TYR 48 HB2 TYR 48 1.278 1.894 11.827 385 HB3 TYR 48 HB3 TYR 48 1.174 3.422 12.693 386 HD1 TYR 48 HD2 TYR 48 3.573 0.875 11.390 387 HD2 TYR 48 HD1 TYR 48 3.075 4.839 13.010 388 HE1 TYR 48 HE2 TYR 48 5.873 1.453 10.684 389 HE2 TYR 48 HE1 TYR 48 5.337 5.441 12.249 390 HH TYR 48 HH TYR 48 7.272 4.715 11.197 391 H GLN 49 H GLN 49 0.448 3.443 15.450 392 HA GLN 49 HA GLN 49 2.692 4.882 16.408 393 HB2 GLN 49 HB2 GLN 49 -0.165 4.591 17.369 394 HB3 GLN 49 HB3 GLN 49 0.977 5.769 18.054 395 HG2 GLN 49 HG2 GLN 49 1.256 6.872 15.932 396 HG3 GLN 49 HG3 GLN 49 0.417 5.596 15.060 397 HE21 GLN 49 HE22 GLN 49 -1.009 7.191 14.163 398 HE22 GLN 49 HE21 GLN 49 -2.335 7.838 15.092 399 H ARG 50 H ARG 50 1.540 1.741 17.393 400 HA ARG 50 HA ARG 50 2.617 1.938 20.120 401 HB2 ARG 50 HB2 ARG 50 1.542 -0.299 18.350 402 HB3 ARG 50 HB3 ARG 50 2.397 -0.654 19.847 403 HG2 ARG 50 HG2 ARG 50 0.027 -0.650 20.287 404 HG3 ARG 50 HG3 ARG 50 0.814 0.675 21.154 405 HD2 ARG 50 HD2 ARG 50 0.017 2.277 19.455 406 HD3 ARG 50 HD3 ARG 50 -0.773 0.946 18.573 407 HE ARG 50 HE ARG 50 -1.663 0.852 21.251 408 HH11 ARG 50 HH11 ARG 50 -1.923 3.031 18.469 409 HH12 ARG 50 HH12 ARG 50 -3.436 3.712 19.012 410 HH21 ARG 50 HH21 ARG 50 -3.644 1.745 21.910 411 HH22 ARG 50 HH22 ARG 50 -4.424 2.962 20.929 412 H ILE 51 H ILE 51 3.545 0.696 16.924 413 HA ILE 51 HA ILE 51 6.009 -0.531 17.697 414 HB ILE 51 HB ILE 51 4.991 0.522 15.030 415 HG12 ILE 51 HG12 ILE 51 4.478 -1.731 14.467 416 HG13 ILE 51 HG13 ILE 51 5.141 -2.370 15.978 417 HG21 ILE 51 HG21 ILE 51 7.288 -1.368 15.669 418 HG22 ILE 51 HG22 ILE 51 6.653 -1.047 14.036 419 HG23 ILE 51 HG23 ILE 51 7.443 0.251 14.955 420 HD11 ILE 51 HD11 ILE 51 2.632 -2.319 15.818 421 HD12 ILE 51 HD12 ILE 51 3.286 -1.479 17.231 422 HD13 ILE 51 HD13 ILE 51 2.727 -0.538 15.812 423 H GLN 52 H GLN 52 4.995 2.705 17.400 424 HA GLN 52 HA GLN 52 7.810 3.661 17.229 425 HB2 GLN 52 HB2 GLN 52 5.235 5.235 16.816 426 HB3 GLN 52 HB3 GLN 52 6.876 5.814 16.504 427 HG2 GLN 52 HG2 GLN 52 5.360 3.669 14.997 428 HG3 GLN 52 HG3 GLN 52 5.920 5.231 14.399 429 HE21 GLN 52 HE22 GLN 52 6.462 2.150 13.905 430 HE22 GLN 52 HE21 GLN 52 8.203 2.085 13.726 431 H ALA 53 H ALA 53 5.723 2.856 19.681 432 HA ALA 53 HA ALA 53 6.820 5.032 21.380 433 HB1 ALA 53 HB1 ALA 53 3.869 4.309 21.273 434 HB2 ALA 53 HB2 ALA 53 4.629 5.515 22.335 435 HB3 ALA 53 HB3 ALA 53 4.593 5.772 20.576 436 H GLY 54 H GLY 54 6.357 1.704 21.072 437 HA2 GLY 54 HA2 GLY 54 7.369 1.231 23.703 438 HA3 GLY 54 HA3 GLY 54 5.627 0.922 23.694 439 H LEU 55 H LEU 55 6.107 0.164 20.691 440 HA LEU 55 HA LEU 55 6.641 -1.584 19.373 441 HB2 LEU 55 HB2 LEU 55 8.639 -2.240 21.549 442 HB3 LEU 55 HB3 LEU 55 8.622 -2.935 19.943 443 HG LEU 55 HG LEU 55 9.740 -1.212 19.041 444 HD11 LEU 55 HD11 LEU 55 7.713 0.313 19.146 445 HD12 LEU 55 HD12 LEU 55 8.368 0.931 20.682 446 HD13 LEU 55 HD13 LEU 55 9.308 1.102 19.192 447 HD21 LEU 55 HD21 LEU 55 11.067 0.127 20.646 448 HD22 LEU 55 HD22 LEU 55 9.933 -0.319 21.945 449 HD23 LEU 55 HD23 LEU 55 10.949 -1.567 21.181 450 H THR 56 H THR 56 7.004 -4.139 19.470 451 HA THR 56 HA THR 56 5.097 -5.302 21.428 452 HB THR 56 HB THR 56 4.003 -6.547 19.581 453 HG1 THR 56 HG1 THR 56 5.637 -6.423 18.047 454 HG21 THR 56 HG21 THR 56 3.926 -3.526 19.147 455 HG22 THR 56 HG22 THR 56 2.671 -4.703 18.704 456 HG23 THR 56 HG23 THR 56 3.037 -4.398 20.417 457 H ALA 57 H ALA 57 8.149 -5.327 20.439 458 HA ALA 57 HA ALA 57 8.497 -8.154 21.158 459 HB1 ALA 57 HB1 ALA 57 9.550 -6.976 18.554 460 HB2 ALA 57 HB2 ALA 57 9.968 -8.574 19.209 461 HB3 ALA 57 HB3 ALA 57 8.297 -8.229 18.710 462 HA PRO 58 HA PRO 58 11.578 -5.964 23.614 463 HB2 PRO 58 HB2 PRO 58 12.568 -8.831 23.546 464 HB3 PRO 58 HB3 PRO 58 12.590 -7.708 24.931 465 HG2 PRO 58 HG2 PRO 58 10.628 -9.549 24.759 466 HG3 PRO 58 HG3 PRO 58 10.160 -7.846 25.108 467 HD2 PRO 58 HD2 PRO 58 10.060 -9.314 22.465 468 HD3 PRO 58 HD3 PRO 58 8.859 -8.201 23.188 469 H ASP 59 H ASP 59 12.353 -8.186 20.929 470 HA ASP 59 HA ASP 59 14.595 -6.586 20.038 471 HB2 ASP 59 HB2 ASP 59 15.502 -7.745 22.083 472 HB3 ASP 59 HB3 ASP 59 15.094 -9.285 21.370 473 H5' U 36 H5' U 36 -8.764 8.777 -17.623 474 H5'' U 36 H5'' U 36 -9.075 8.957 -15.884 475 H4' U 36 H4' U 36 -6.430 9.671 -17.207 476 H3' U 36 H3' U 36 -7.252 7.136 -17.221 477 H2' U 36 H2' U 36 -8.172 7.242 -15.045 478 HO2' U 36 HO2' U 36 -5.614 6.022 -14.842 479 H1' U 36 H1' U 36 -5.545 8.351 -14.030 480 H3 U 36 H3 U 36 -6.980 10.489 -10.242 481 H5 U 36 H5 U 36 -10.180 8.028 -11.387 482 H6 U 36 H6 U 36 -9.040 7.576 -13.453 483 HO5' U 36 HO5' U 36 -9.708 10.811 -17.084 484 H5' C 37 H5' C 37 -1.839 5.504 -17.419 485 H5'' C 37 H5'' C 37 -2.209 7.153 -16.903 486 H4' C 37 H4' C 37 -1.171 6.213 -19.613 487 H3' C 37 H3' C 37 0.278 6.907 -17.425 488 H2' C 37 H2' C 37 -0.927 8.857 -16.874 489 HO2' C 37 HO2' C 37 1.189 9.704 -18.578 490 H1' C 37 H1' C 37 -0.810 9.816 -19.709 491 H41 C 37 H41 C 37 -5.452 13.589 -17.515 492 H42 C 37 H42 C 37 -5.907 12.421 -16.285 493 H5 C 37 H5 C 37 -4.780 10.253 -16.027 494 H6 C 37 H6 C 37 -3.047 8.838 -16.899 495 H5' A 38 H5' A 38 3.202 8.338 -18.038 496 H5'' A 38 H5'' A 38 4.546 7.376 -18.678 497 H4' A 38 H4' A 38 5.013 8.112 -16.393 498 H3' A 38 H3' A 38 5.486 5.560 -17.204 499 H2' A 38 H2' A 38 3.279 4.756 -16.708 500 HO2' A 38 HO2' A 38 4.911 4.274 -14.443 501 H1' A 38 H1' A 38 3.458 6.094 -14.008 502 H8 A 38 H8 A 38 1.226 4.797 -16.868 503 H61 A 38 H61 A 38 -3.337 5.105 -12.688 504 H62 A 38 H62 A 38 -2.946 4.689 -14.347 505 H2 A 38 H2 A 38 0.246 7.067 -10.953 506 H5' G 39 H5' G 39 5.394 8.823 -14.533 507 H5'' G 39 H5'' G 39 6.819 9.723 -15.103 508 H4' G 39 H4' G 39 6.104 10.952 -13.255 509 H3' G 39 H3' G 39 8.581 9.963 -12.992 510 H2' G 39 H2' G 39 8.019 7.850 -12.069 511 HO2' G 39 HO2' G 39 8.350 9.617 -9.888 512 H1' G 39 H1' G 39 5.954 8.837 -10.173 513 H8 G 39 H8 G 39 3.729 7.431 -12.253 514 H1 G 39 H1 G 39 7.570 2.577 -10.567 515 H21 G 39 H21 G 39 9.453 3.334 -9.774 516 H22 G 39 H22 G 39 9.784 5.047 -9.608 517 H5' G 40 H5' G 40 7.233 11.145 -8.702 518 H5'' G 40 H5'' G 40 8.238 12.542 -8.260 519 H4' G 40 H4' G 40 7.802 11.101 -6.334 520 H3' G 40 H3' G 40 10.353 12.066 -7.081 521 H2' G 40 H2' G 40 11.019 9.839 -7.774 522 HO2' G 40 HO2' G 40 12.410 10.670 -6.040 523 H1' G 40 H1' G 40 9.450 8.940 -5.331 524 H8 G 40 H8 G 40 10.030 7.602 -8.950 525 H1 G 40 H1 G 40 11.851 3.647 -4.233 526 H21 G 40 H21 G 40 11.591 4.650 -2.259 527 H22 G 40 H22 G 40 10.902 6.245 -2.134 528 H5' A 41 H5' A 41 7.382 13.968 -3.870 529 H5'' A 41 H5'' A 41 7.170 12.623 -5.004 530 H4' A 41 H4' A 41 7.040 15.519 -5.919 531 H3' A 41 H3' A 41 4.960 13.824 -4.556 532 H2' A 41 H2' A 41 3.344 14.375 -6.150 533 HO2' A 41 HO2' A 41 3.767 16.682 -5.883 534 H1' A 41 H1' A 41 5.095 14.896 -8.328 535 H8 A 41 H8 A 41 4.292 11.783 -6.103 536 H61 A 41 H61 A 41 2.160 9.359 -11.415 537 H62 A 41 H62 A 41 2.336 9.085 -9.692 538 H2 A 41 H2 A 41 3.808 13.377 -12.290 539 H5' C 42 H5' C 42 2.413 14.122 -1.954 540 H5'' C 42 H5'' C 42 2.931 13.815 -3.626 541 H4' C 42 H4' C 42 1.008 14.689 -4.561 542 H3' C 42 H3' C 42 0.636 16.155 -1.934 543 H2' C 42 H2' C 42 -1.709 16.039 -2.180 544 HO2' C 42 HO2' C 42 -1.702 16.507 -4.514 545 H1' C 42 H1' C 42 -1.824 13.546 -3.295 546 H41 C 42 H41 C 42 -2.916 13.248 3.056 547 H42 C 42 H42 C 42 -1.213 12.900 3.325 548 H5 C 42 H5 C 42 0.435 12.910 1.511 549 H6 C 42 H6 C 42 0.739 13.305 -0.873 550 H5' A 43 H5' A 43 -0.350 16.084 -5.941 551 H5'' A 43 H5'' A 43 0.296 17.564 -6.611 552 H4' A 43 H4' A 43 -1.128 17.418 -8.371 553 H3' A 43 H3' A 43 -3.373 16.939 -6.386 554 H2' A 43 H2' A 43 -4.712 16.546 -8.387 555 HO2' A 43 HO2' A 43 -3.723 18.089 -9.781 556 H1' A 43 H1' A 43 -2.862 14.824 -9.387 557 H8 A 43 H8 A 43 -2.548 14.160 -5.714 558 H61 A 43 H61 A 43 -8.101 11.423 -5.946 559 H62 A 43 H62 A 43 -6.670 11.700 -4.966 560 H2 A 43 H2 A 43 -7.449 13.525 -9.807 561 H5' U 44 H5' U 44 -5.779 19.985 -4.560 562 H5'' U 44 H5'' U 44 -4.109 19.392 -4.497 563 H4' U 44 H4' U 44 -5.384 18.505 -2.641 564 H3' U 44 H3' U 44 -3.785 16.974 -4.300 565 HO3' U 44 HO3' U 44 -4.004 15.594 -2.306 566 H2' U 44 H2' U 44 -5.270 15.534 -5.303 567 HO2' U 44 HO2' U 44 -4.654 14.120 -3.663 568 H1' U 44 H1' U 44 -7.507 15.695 -3.484 569 H3 U 44 H3 U 44 -10.707 15.908 -6.666 570 H5 U 44 H5 U 44 -7.117 16.611 -8.755 571 H6 U 44 H6 U 44 -5.964 16.608 -6.689 572 H1 MET 1 H1 MET 1 0.875 -12.658 3.720 573 H2 MET 1 H2 MET 1 -0.073 -12.934 5.035 574 H3 MET 1 H3 MET 1 0.813 -11.551 4.933 575 HA MET 1 HA MET 1 -0.468 -10.787 3.067 576 HB2 MET 1 HB2 MET 1 -1.033 -13.050 2.197 577 HB3 MET 1 HB3 MET 1 -2.064 -13.321 3.615 578 HG2 MET 1 HG2 MET 1 -3.460 -12.710 1.755 579 HG3 MET 1 HG3 MET 1 -3.496 -11.411 2.937 580 HE1 MET 1 HE1 MET 1 -4.608 -11.247 0.029 581 HE2 MET 1 HE2 MET 1 -4.652 -9.899 1.176 582 HE3 MET 1 HE3 MET 1 -4.039 -9.632 -0.475 583 H LEU 2 H LEU 2 -1.887 -9.180 3.663 584 HA LEU 2 HA LEU 2 -3.655 -9.682 5.989 585 HB2 LEU 2 HB2 LEU 2 -1.461 -7.706 5.760 586 HB3 LEU 2 HB3 LEU 2 -3.019 -6.986 6.195 587 HG LEU 2 HG LEU 2 -1.619 -9.224 7.670 588 HD11 LEU 2 HD11 LEU 2 -0.592 -6.988 7.907 589 HD12 LEU 2 HD12 LEU 2 -2.149 -6.313 8.415 590 HD13 LEU 2 HD13 LEU 2 -1.328 -7.546 9.422 591 HD21 LEU 2 HD21 LEU 2 -4.243 -7.752 8.249 592 HD22 LEU 2 HD22 LEU 2 -4.060 -9.489 7.921 593 HD23 LEU 2 HD23 LEU 2 -3.400 -8.806 9.409 594 H ILE 3 H ILE 3 -5.536 -8.337 5.985 595 HA ILE 3 HA ILE 3 -6.062 -6.831 3.476 596 HB ILE 3 HB ILE 3 -7.879 -8.910 4.770 597 HG12 ILE 3 HG12 ILE 3 -7.865 -9.613 2.224 598 HG13 ILE 3 HG13 ILE 3 -6.322 -8.738 2.171 599 HG21 ILE 3 HG21 ILE 3 -8.419 -6.949 2.503 600 HG22 ILE 3 HG22 ILE 3 -9.475 -8.302 2.968 601 HG23 ILE 3 HG23 ILE 3 -9.218 -6.960 4.095 602 HD11 ILE 3 HD11 ILE 3 -7.095 -11.035 4.004 603 HD12 ILE 3 HD12 ILE 3 -6.007 -11.147 2.597 604 HD13 ILE 3 HD13 ILE 3 -5.493 -10.238 4.010 605 H LEU 4 H LEU 4 -7.495 -5.116 3.734 606 HA LEU 4 HA LEU 4 -8.394 -4.391 6.455 607 HB2 LEU 4 HB2 LEU 4 -6.542 -2.734 4.688 608 HB3 LEU 4 HB3 LEU 4 -7.363 -2.115 6.119 609 HG LEU 4 HG LEU 4 -5.324 -4.384 6.158 610 HD11 LEU 4 HD11 LEU 4 -3.899 -2.607 7.209 611 HD12 LEU 4 HD12 LEU 4 -4.323 -2.274 5.513 612 HD13 LEU 4 HD13 LEU 4 -5.173 -1.421 6.826 613 HD21 LEU 4 HD21 LEU 4 -5.325 -3.930 8.608 614 HD22 LEU 4 HD22 LEU 4 -6.670 -2.787 8.381 615 HD23 LEU 4 HD23 LEU 4 -6.904 -4.522 8.050 616 H THR 5 H THR 5 -9.821 -2.465 6.382 617 HA THR 5 HA THR 5 -10.734 -1.726 3.658 618 HB THR 5 HB THR 5 -12.866 -1.841 5.738 619 HG1 THR 5 HG1 THR 5 -11.847 -4.133 4.408 620 HG21 THR 5 HG21 THR 5 -12.703 -2.625 2.798 621 HG22 THR 5 HG22 THR 5 -14.180 -2.489 3.768 622 HG23 THR 5 HG23 THR 5 -13.217 -1.030 3.416 623 H ARG 6 H ARG 6 -9.763 0.172 3.617 624 HA ARG 6 HA ARG 6 -10.064 2.075 5.884 625 HB2 ARG 6 HB2 ARG 6 -7.804 1.216 4.879 626 HB3 ARG 6 HB3 ARG 6 -8.217 2.163 3.456 627 HG2 ARG 6 HG2 ARG 6 -6.725 3.476 4.705 628 HG3 ARG 6 HG3 ARG 6 -8.316 4.200 4.989 629 HD2 ARG 6 HD2 ARG 6 -7.029 2.159 6.856 630 HD3 ARG 6 HD3 ARG 6 -6.785 3.899 7.029 631 HE ARG 6 HE ARG 6 -9.242 4.140 7.285 632 HH11 ARG 6 HH11 ARG 6 -7.798 0.992 8.017 633 HH12 ARG 6 HH12 ARG 6 -9.097 0.542 9.103 634 HH21 ARG 6 HH21 ARG 6 -10.851 3.551 8.720 635 HH22 ARG 6 HH22 ARG 6 -10.822 1.998 9.516 636 H LYS 7 H LYS 7 -10.510 4.451 5.222 637 HA LYS 7 HA LYS 7 -11.782 4.533 2.529 638 HB2 LYS 7 HB2 LYS 7 -13.358 6.200 3.274 639 HB3 LYS 7 HB3 LYS 7 -13.604 4.693 4.131 640 HG2 LYS 7 HG2 LYS 7 -12.500 5.627 6.124 641 HG3 LYS 7 HG3 LYS 7 -12.073 7.107 5.211 642 HD2 LYS 7 HD2 LYS 7 -14.544 7.447 4.783 643 HD3 LYS 7 HD3 LYS 7 -14.872 6.112 5.897 644 HE2 LYS 7 HE2 LYS 7 -13.420 8.713 6.542 645 HE3 LYS 7 HE3 LYS 7 -15.082 8.312 6.985 646 HZ1 LYS 7 HZ1 LYS 7 -14.211 6.465 8.289 647 HZ2 LYS 7 HZ2 LYS 7 -12.664 6.931 7.950 648 HZ3 LYS 7 HZ3 LYS 7 -13.635 7.906 8.825 649 H VAL 8 H VAL 8 -12.080 6.845 1.747 650 HA VAL 8 HA VAL 8 -9.467 7.666 1.132 651 HB VAL 8 HB VAL 8 -10.414 9.406 -0.151 652 HG11 VAL 8 HG11 VAL 8 -12.056 8.126 -1.470 653 HG12 VAL 8 HG12 VAL 8 -10.744 7.057 -0.925 654 HG13 VAL 8 HG13 VAL 8 -12.326 7.017 -0.118 655 HG21 VAL 8 HG21 VAL 8 -13.054 8.965 1.296 656 HG22 VAL 8 HG22 VAL 8 -12.017 10.416 1.387 657 HG23 VAL 8 HG23 VAL 8 -12.777 9.978 -0.151 658 H GLY 9 H GLY 9 -8.054 9.034 1.889 659 HA2 GLY 9 HA2 GLY 9 -7.357 11.046 2.914 660 HA3 GLY 9 HA3 GLY 9 -8.886 11.139 3.797 661 H GLU 10 H GLU 10 -7.860 7.950 4.051 662 HA GLU 10 HA GLU 10 -6.545 8.508 6.670 663 HB2 GLU 10 HB2 GLU 10 -8.111 6.099 5.700 664 HB3 GLU 10 HB3 GLU 10 -7.368 6.266 7.304 665 HG2 GLU 10 HG2 GLU 10 -8.769 8.238 7.764 666 HG3 GLU 10 HG3 GLU 10 -9.490 8.132 6.150 667 H SER 11 H SER 11 -5.217 6.246 7.266 668 HA SER 11 HA SER 11 -3.365 5.795 4.982 669 HB2 SER 11 HB2 SER 11 -2.549 6.914 7.678 670 HB3 SER 11 HB3 SER 11 -1.452 6.490 6.345 671 HG SER 11 HG SER 11 -1.966 8.722 6.390 672 H ILE 12 H ILE 12 -1.575 4.353 5.544 673 HA ILE 12 HA ILE 12 -2.049 2.324 7.636 674 HB ILE 12 HB ILE 12 -1.699 1.643 4.683 675 HG12 ILE 12 HG12 ILE 12 -4.258 1.505 6.332 676 HG13 ILE 12 HG13 ILE 12 -3.913 2.668 5.038 677 HG21 ILE 12 HG21 ILE 12 -2.374 -0.132 7.073 678 HG22 ILE 12 HG22 ILE 12 -2.249 -0.665 5.389 679 HG23 ILE 12 HG23 ILE 12 -0.815 -0.079 6.209 680 HD11 ILE 12 HD11 ILE 12 -3.674 0.817 3.414 681 HD12 ILE 12 HD12 ILE 12 -4.174 -0.332 4.679 682 HD13 ILE 12 HD13 ILE 12 -5.297 0.924 4.139 683 H ASN 13 H ASN 13 0.035 0.839 7.640 684 HA ASN 13 HA ASN 13 2.394 2.321 6.603 685 HB2 ASN 13 HB2 ASN 13 1.871 1.593 9.508 686 HB3 ASN 13 HB3 ASN 13 3.462 2.031 8.860 687 HD21 ASN 13 HD22 ASN 13 3.918 4.173 8.267 688 HD22 ASN 13 HD21 ASN 13 2.867 5.497 8.724 689 H ILE 14 H ILE 14 4.341 1.147 6.578 690 HA ILE 14 HA ILE 14 4.205 -1.781 7.000 691 HB ILE 14 HB ILE 14 5.116 -0.494 4.398 692 HG12 ILE 14 HG12 ILE 14 2.590 -2.097 4.993 693 HG13 ILE 14 HG13 ILE 14 2.669 -0.364 4.610 694 HG21 ILE 14 HG21 ILE 14 4.790 -3.416 5.208 695 HG22 ILE 14 HG22 ILE 14 5.283 -2.841 3.603 696 HG23 ILE 14 HG23 ILE 14 6.340 -2.570 4.975 697 HD11 ILE 14 HD11 ILE 14 3.383 -2.654 2.740 698 HD12 ILE 14 HD12 ILE 14 2.003 -1.553 2.628 699 HD13 ILE 14 HD13 ILE 14 3.643 -0.928 2.379 700 H GLY 15 H GLY 15 6.314 -2.736 7.174 701 HA2 GLY 15 HA2 GLY 15 8.454 -2.783 8.030 702 HA3 GLY 15 HA3 GLY 15 8.784 -1.442 6.915 703 H ASP 16 H ASP 16 10.068 -0.223 8.231 704 HA ASP 16 HA ASP 16 8.720 1.080 10.545 705 HB2 ASP 16 HB2 ASP 16 11.656 0.297 10.303 706 HB3 ASP 16 HB3 ASP 16 10.934 1.197 11.643 707 H ASP 17 H ASP 17 9.396 1.511 7.486 708 HA ASP 17 HA ASP 17 10.189 4.338 7.757 709 HB2 ASP 17 HB2 ASP 17 11.644 2.328 5.993 710 HB3 ASP 17 HB3 ASP 17 11.891 4.077 5.967 711 H ILE 18 H ILE 18 7.819 2.383 6.721 712 HA ILE 18 HA ILE 18 7.472 3.946 4.206 713 HB ILE 18 HB ILE 18 6.666 1.038 4.598 714 HG12 ILE 18 HG12 ILE 18 8.363 0.909 2.549 715 HG13 ILE 18 HG13 ILE 18 9.104 2.300 3.365 716 HG21 ILE 18 HG21 ILE 18 6.530 2.925 2.209 717 HG22 ILE 18 HG22 ILE 18 6.207 1.175 2.157 718 HG23 ILE 18 HG23 ILE 18 5.157 2.233 3.103 719 HD11 ILE 18 HD11 ILE 18 10.078 0.107 4.064 720 HD12 ILE 18 HD12 ILE 18 9.308 0.922 5.440 721 HD13 ILE 18 HD13 ILE 18 8.470 -0.413 4.626 722 H THR 19 H THR 19 5.423 4.607 3.699 723 HA THR 19 HA THR 19 3.209 4.026 5.586 724 HB THR 19 HB THR 19 4.064 6.809 4.694 725 HG1 THR 19 HG1 THR 19 4.599 7.075 6.858 726 HG21 THR 19 HG21 THR 19 2.361 7.553 6.360 727 HG22 THR 19 HG22 THR 19 1.648 6.702 4.983 728 HG23 THR 19 HG23 THR 19 1.835 5.863 6.542 729 H ILE 20 H ILE 20 1.123 4.425 4.629 730 HA ILE 20 HA ILE 20 1.095 4.733 1.667 731 HB ILE 20 HB ILE 20 -0.360 2.642 3.338 732 HG12 ILE 20 HG12 ILE 20 2.045 2.118 3.024 733 HG13 ILE 20 HG13 ILE 20 0.955 0.948 2.270 734 HG21 ILE 20 HG21 ILE 20 -0.414 3.209 0.348 735 HG22 ILE 20 HG22 ILE 20 -1.093 1.749 1.117 736 HG23 ILE 20 HG23 ILE 20 -1.760 3.340 1.500 737 HD11 ILE 20 HD11 ILE 20 1.355 1.904 0.058 738 HD12 ILE 20 HD12 ILE 20 2.356 3.194 0.769 739 HD13 ILE 20 HD13 ILE 20 2.903 1.504 0.830 740 H THR 21 H THR 21 -0.807 5.741 0.904 741 HA THR 21 HA THR 21 -2.834 6.536 2.933 742 HB THR 21 HB THR 21 -1.556 8.482 0.970 743 HG1 THR 21 HG1 THR 21 -0.081 7.868 2.588 744 HG21 THR 21 HG21 THR 21 -2.668 10.183 2.368 745 HG22 THR 21 HG22 THR 21 -3.860 9.060 1.683 746 HG23 THR 21 HG23 THR 21 -3.364 8.909 3.387 747 H ILE 22 H ILE 22 -4.889 6.860 2.085 748 HA ILE 22 HA ILE 22 -5.259 6.039 -0.755 749 HB ILE 22 HB ILE 22 -6.274 4.464 0.636 750 HG12 ILE 22 HG12 ILE 22 -8.611 4.573 0.195 751 HG13 ILE 22 HG13 ILE 22 -8.588 6.342 0.060 752 HG21 ILE 22 HG21 ILE 22 -7.447 6.730 2.271 753 HG22 ILE 22 HG22 ILE 22 -7.865 5.013 2.458 754 HG23 ILE 22 HG23 ILE 22 -6.211 5.548 2.777 755 HD11 ILE 22 HD11 ILE 22 -8.715 5.275 -2.138 756 HD12 ILE 22 HD12 ILE 22 -7.239 6.231 -1.946 757 HD13 ILE 22 HD13 ILE 22 -7.160 4.450 -1.831 758 H LEU 23 H LEU 23 -5.066 8.001 -1.842 759 HA LEU 23 HA LEU 23 -5.868 10.458 -0.620 760 HB2 LEU 23 HB2 LEU 23 -5.486 9.945 -3.585 761 HB3 LEU 23 HB3 LEU 23 -5.409 11.487 -2.732 762 HG LEU 23 HG LEU 23 -3.377 9.250 -2.753 763 HD11 LEU 23 HD11 LEU 23 -3.235 11.001 -4.460 764 HD12 LEU 23 HD12 LEU 23 -3.361 12.264 -3.224 765 HD13 LEU 23 HD13 LEU 23 -1.915 11.234 -3.290 766 HD21 LEU 23 HD21 LEU 23 -3.544 9.776 -0.395 767 HD22 LEU 23 HD22 LEU 23 -2.094 10.564 -1.055 768 HD23 LEU 23 HD23 LEU 23 -3.571 11.523 -0.746 769 H GLY 24 H GLY 24 -7.593 8.156 -2.719 770 HA2 GLY 24 HA2 GLY 24 -10.135 8.888 -2.036 771 HA3 GLY 24 HA3 GLY 24 -9.760 10.067 -3.275 772 H VAL 25 H VAL 25 -11.771 8.789 -4.113 773 HA VAL 25 HA VAL 25 -10.733 6.771 -6.026 774 HB VAL 25 HB VAL 25 -12.474 5.248 -5.671 775 HG11 VAL 25 HG11 VAL 25 -12.397 4.613 -3.343 776 HG12 VAL 25 HG12 VAL 25 -10.794 5.206 -3.834 777 HG13 VAL 25 HG13 VAL 25 -11.873 6.238 -2.861 778 HG21 VAL 25 HG21 VAL 25 -14.374 6.722 -5.606 779 HG22 VAL 25 HG22 VAL 25 -14.423 5.653 -4.205 780 HG23 VAL 25 HG23 VAL 25 -13.893 7.344 -3.999 781 H SER 26 H SER 26 -12.085 6.483 -7.910 782 HA SER 26 HA SER 26 -14.336 8.314 -8.345 783 HB2 SER 26 HB2 SER 26 -12.384 9.689 -9.013 784 HB3 SER 26 HB3 SER 26 -11.847 8.386 -10.095 785 HG SER 26 HG SER 26 -13.090 10.000 -11.167 786 H GLY 27 H GLY 27 -15.842 6.889 -9.066 787 HA2 GLY 27 HA2 GLY 27 -16.799 5.159 -10.287 788 HA3 GLY 27 HA3 GLY 27 -15.382 5.238 -11.361 789 H GLN 28 H GLN 28 -13.903 3.587 -11.279 790 HA GLN 28 HA GLN 28 -13.969 1.834 -8.862 791 HB2 GLN 28 HB2 GLN 28 -13.032 1.074 -11.662 792 HB3 GLN 28 HB3 GLN 28 -13.117 0.031 -10.242 793 HG2 GLN 28 HG2 GLN 28 -15.437 1.230 -11.773 794 HG3 GLN 28 HG3 GLN 28 -14.970 -0.483 -11.632 795 HE21 GLN 28 HE22 GLN 28 -14.626 -0.993 -9.002 796 HE22 GLN 28 HE21 GLN 28 -16.065 -0.596 -8.081 797 H GLN 29 H GLN 29 -12.146 4.113 -10.692 798 HA GLN 29 HA GLN 29 -9.549 3.041 -10.059 799 HB2 GLN 29 HB2 GLN 29 -10.448 5.865 -10.815 800 HB3 GLN 29 HB3 GLN 29 -8.773 5.395 -10.510 801 HG2 GLN 29 HG2 GLN 29 -9.158 5.374 -12.888 802 HG3 GLN 29 HG3 GLN 29 -8.791 3.759 -12.275 803 HE21 GLN 29 HE22 GLN 29 -9.896 2.324 -13.465 804 HE22 GLN 29 HE21 GLN 29 -11.615 2.443 -13.815 805 H VAL 30 H VAL 30 -8.108 3.732 -8.481 806 HA VAL 30 HA VAL 30 -9.226 5.126 -6.112 807 HB VAL 30 HB VAL 30 -7.714 2.470 -6.169 808 HG11 VAL 30 HG11 VAL 30 -7.159 3.950 -4.218 809 HG12 VAL 30 HG12 VAL 30 -8.894 3.999 -3.821 810 HG13 VAL 30 HG13 VAL 30 -8.018 2.454 -3.754 811 HG21 VAL 30 HG21 VAL 30 -10.580 3.140 -5.360 812 HG22 VAL 30 HG22 VAL 30 -10.087 2.179 -6.778 813 HG23 VAL 30 HG23 VAL 30 -9.787 1.560 -5.145 814 H ARG 31 H ARG 31 -7.963 6.863 -5.905 815 HA ARG 31 HA ARG 31 -5.200 6.909 -6.902 816 HB2 ARG 31 HB2 ARG 31 -7.244 8.838 -5.876 817 HB3 ARG 31 HB3 ARG 31 -5.551 9.251 -5.545 818 HG2 ARG 31 HG2 ARG 31 -6.333 8.413 -8.337 819 HG3 ARG 31 HG3 ARG 31 -6.653 10.061 -7.788 820 HD2 ARG 31 HD2 ARG 31 -4.302 10.355 -7.155 821 HD3 ARG 31 HD3 ARG 31 -3.931 8.700 -7.666 822 HE ARG 31 HE ARG 31 -4.888 9.559 -9.955 823 HH11 ARG 31 HH11 ARG 31 -2.802 11.366 -7.747 824 HH12 ARG 31 HH12 ARG 31 -2.109 12.340 -9.027 825 HH21 ARG 31 HH21 ARG 31 -4.011 10.862 -11.574 826 HH22 ARG 31 HH22 ARG 31 -2.791 12.053 -11.187 827 H ILE 32 H ILE 32 -3.471 6.495 -5.727 828 HA ILE 32 HA ILE 32 -3.777 6.205 -2.770 829 HB ILE 32 HB ILE 32 -2.147 4.294 -4.472 830 HG12 ILE 32 HG12 ILE 32 -5.106 4.107 -3.794 831 HG13 ILE 32 HG13 ILE 32 -4.342 4.086 -5.387 832 HG21 ILE 32 HG21 ILE 32 -3.433 4.034 -1.721 833 HG22 ILE 32 HG22 ILE 32 -2.363 2.847 -2.503 834 HG23 ILE 32 HG23 ILE 32 -1.717 4.410 -2.021 835 HD11 ILE 32 HD11 ILE 32 -4.135 1.928 -3.262 836 HD12 ILE 32 HD12 ILE 32 -4.986 1.831 -4.820 837 HD13 ILE 32 HD13 ILE 32 -3.212 1.937 -4.790 838 H GLY 33 H GLY 33 -1.769 6.434 -1.592 839 HA2 GLY 33 HA2 GLY 33 0.448 7.695 -3.138 840 HA3 GLY 33 HA3 GLY 33 -0.163 8.402 -1.626 841 H ILE 34 H ILE 34 2.511 7.461 -2.169 842 HA ILE 34 HA ILE 34 2.796 5.369 -0.074 843 HB ILE 34 HB ILE 34 4.177 5.337 -2.792 844 HG12 ILE 34 HG12 ILE 34 2.047 3.405 -1.779 845 HG13 ILE 34 HG13 ILE 34 1.740 4.723 -2.932 846 HG21 ILE 34 HG21 ILE 34 5.553 4.420 -0.975 847 HG22 ILE 34 HG22 ILE 34 4.212 3.364 -0.466 848 HG23 ILE 34 HG23 ILE 34 5.017 3.110 -2.026 849 HD11 ILE 34 HD11 ILE 34 3.440 3.778 -4.461 850 HD12 ILE 34 HD12 ILE 34 3.592 2.364 -3.385 851 HD13 ILE 34 HD13 ILE 34 2.044 2.707 -4.186 852 H ASN 35 H ASN 35 4.686 5.593 1.119 853 HA ASN 35 HA ASN 35 6.498 7.802 0.336 854 HB2 ASN 35 HB2 ASN 35 4.586 8.613 1.764 855 HB3 ASN 35 HB3 ASN 35 5.160 7.562 3.060 856 HD21 ASN 35 HD22 ASN 35 4.928 10.595 2.666 857 HD22 ASN 35 HD21 ASN 35 6.523 11.213 3.044 858 H ALA 36 H ALA 36 8.341 6.725 0.143 859 HA ALA 36 HA ALA 36 9.422 5.270 2.474 860 HB1 ALA 36 HB1 ALA 36 10.135 3.390 1.010 861 HB2 ALA 36 HB2 ALA 36 8.360 3.501 1.111 862 HB3 ALA 36 HB3 ALA 36 9.223 4.092 -0.333 863 HA PRO 37 HA PRO 37 13.131 7.272 1.168 864 HB2 PRO 37 HB2 PRO 37 15.015 5.344 1.820 865 HB3 PRO 37 HB3 PRO 37 14.217 6.432 3.017 866 HG2 PRO 37 HG2 PRO 37 13.561 3.572 2.279 867 HG3 PRO 37 HG3 PRO 37 13.629 4.315 3.912 868 HD2 PRO 37 HD2 PRO 37 11.287 3.923 2.600 869 HD3 PRO 37 HD3 PRO 37 11.558 5.383 3.613 870 H LYS 38 H LYS 38 14.834 7.184 -0.445 871 HA LYS 38 HA LYS 38 14.176 5.559 -2.756 872 HB2 LYS 38 HB2 LYS 38 16.503 7.439 -2.113 873 HB3 LYS 38 HB3 LYS 38 16.234 6.702 -3.706 874 HG2 LYS 38 HG2 LYS 38 14.110 8.373 -2.290 875 HG3 LYS 38 HG3 LYS 38 15.292 9.060 -3.419 876 HD2 LYS 38 HD2 LYS 38 13.614 6.678 -4.267 877 HD3 LYS 38 HD3 LYS 38 12.916 8.299 -4.221 878 HE2 LYS 38 HE2 LYS 38 14.748 9.131 -5.680 879 HE3 LYS 38 HE3 LYS 38 15.448 7.498 -5.721 880 HZ1 LYS 38 HZ1 LYS 38 12.789 8.257 -6.699 881 HZ2 LYS 38 HZ2 LYS 38 14.102 7.965 -7.652 882 HZ3 LYS 38 HZ3 LYS 38 13.436 6.741 -6.782 883 H ASP 39 H ASP 39 15.653 4.829 0.050 884 HA ASP 39 HA ASP 39 17.741 3.010 -0.811 885 HB2 ASP 39 HB2 ASP 39 16.081 3.293 1.721 886 HB3 ASP 39 HB3 ASP 39 17.346 2.089 1.543 887 H VAL 40 H VAL 40 14.376 2.936 -1.216 888 HA VAL 40 HA VAL 40 14.448 0.018 -1.738 889 HB VAL 40 HB VAL 40 12.240 -0.272 -0.737 890 HG11 VAL 40 HG11 VAL 40 14.062 1.156 1.245 891 HG12 VAL 40 HG12 VAL 40 12.801 -0.033 1.626 892 HG13 VAL 40 HG13 VAL 40 14.260 -0.541 0.736 893 HG21 VAL 40 HG21 VAL 40 11.430 2.079 -1.114 894 HG22 VAL 40 HG22 VAL 40 11.130 1.457 0.525 895 HG23 VAL 40 HG23 VAL 40 12.472 2.580 0.252 896 H ALA 41 H ALA 41 12.418 -0.587 -3.071 897 HA ALA 41 HA ALA 41 12.112 1.572 -5.099 898 HB1 ALA 41 HB1 ALA 41 11.987 -1.454 -5.421 899 HB2 ALA 41 HB2 ALA 41 11.837 -0.256 -6.722 900 HB3 ALA 41 HB3 ALA 41 13.373 -0.411 -5.843 901 H VAL 42 H VAL 42 10.090 1.736 -6.243 902 HA VAL 42 HA VAL 42 7.803 0.169 -5.333 903 HB VAL 42 HB VAL 42 7.587 1.711 -3.606 904 HG11 VAL 42 HG11 VAL 42 8.458 3.880 -5.545 905 HG12 VAL 42 HG12 VAL 42 7.822 4.192 -3.910 906 HG13 VAL 42 HG13 VAL 42 9.322 3.279 -4.109 907 HG21 VAL 42 HG21 VAL 42 5.500 1.575 -4.959 908 HG22 VAL 42 HG22 VAL 42 5.691 3.147 -4.160 909 HG23 VAL 42 HG23 VAL 42 6.031 2.997 -5.891 910 H HIS 43 H HIS 43 6.502 -0.190 -7.007 911 HA HIS 43 HA HIS 43 6.010 1.855 -9.037 912 HB2 HIS 43 HB2 HIS 43 6.862 -0.835 -10.109 913 HB3 HIS 43 HB3 HIS 43 6.801 0.733 -10.898 914 HD2 HIS 43 HD2 HIS 43 9.030 -1.220 -8.377 915 HE1 HIS 43 HE1 HIS 43 11.446 1.765 -10.201 916 HE2 HIS 43 HE2 HIS 43 11.443 -0.225 -8.621 917 H ARG 44 H ARG 44 4.293 0.936 -10.668 918 HA ARG 44 HA ARG 44 2.359 -0.625 -9.112 919 HB2 ARG 44 HB2 ARG 44 0.870 -0.207 -11.065 920 HB3 ARG 44 HB3 ARG 44 1.539 1.266 -10.357 921 HG2 ARG 44 HG2 ARG 44 3.323 1.245 -12.134 922 HG3 ARG 44 HG3 ARG 44 2.457 -0.100 -12.910 923 HD2 ARG 44 HD2 ARG 44 0.440 1.349 -13.086 924 HD3 ARG 44 HD3 ARG 44 1.332 2.674 -12.312 925 HE ARG 44 HE ARG 44 2.725 2.888 -14.235 926 HH11 ARG 44 HH11 ARG 44 0.032 0.633 -14.664 927 HH12 ARG 44 HH12 ARG 44 0.246 0.528 -16.396 928 HH21 ARG 44 HH21 ARG 44 2.952 2.767 -16.490 929 HH22 ARG 44 HH22 ARG 44 1.871 1.768 -17.435 930 H GLU 45 H GLU 45 1.266 -2.526 -10.274 931 HA GLU 45 HA GLU 45 3.225 -4.515 -10.446 932 HB2 GLU 45 HB2 GLU 45 0.762 -4.653 -9.876 933 HB3 GLU 45 HB3 GLU 45 0.406 -4.665 -11.599 934 HG2 GLU 45 HG2 GLU 45 2.193 -6.676 -10.149 935 HG3 GLU 45 HG3 GLU 45 0.473 -6.921 -10.463 936 H GLU 46 H GLU 46 1.983 -2.430 -13.000 937 HA GLU 46 HA GLU 46 2.713 -4.092 -15.223 938 HB2 GLU 46 HB2 GLU 46 1.141 -2.134 -15.264 939 HB3 GLU 46 HB3 GLU 46 2.535 -1.063 -15.026 940 HG2 GLU 46 HG2 GLU 46 3.522 -1.899 -17.153 941 HG3 GLU 46 HG3 GLU 46 2.170 -3.026 -17.337 942 H ILE 47 H ILE 47 4.485 -1.640 -13.301 943 HA ILE 47 HA ILE 47 6.682 -1.619 -15.267 944 HB ILE 47 HB ILE 47 6.428 -0.162 -12.625 945 HG12 ILE 47 HG12 ILE 47 4.478 0.477 -13.842 946 HG13 ILE 47 HG13 ILE 47 5.647 1.802 -13.954 947 HG21 ILE 47 HG21 ILE 47 7.972 1.458 -13.728 948 HG22 ILE 47 HG22 ILE 47 8.685 -0.154 -13.541 949 HG23 ILE 47 HG23 ILE 47 8.084 0.367 -15.129 950 HD11 ILE 47 HD11 ILE 47 5.014 -0.256 -16.100 951 HD12 ILE 47 HD12 ILE 47 4.587 1.467 -16.108 952 HD13 ILE 47 HD13 ILE 47 6.293 0.983 -16.231 953 H TYR 48 H TYR 48 5.880 -2.915 -12.085 954 HA TYR 48 HA TYR 48 8.418 -3.350 -10.986 955 HB2 TYR 48 HB2 TYR 48 6.258 -3.654 -9.845 956 HB3 TYR 48 HB3 TYR 48 5.881 -5.023 -10.875 957 HD1 TYR 48 HD1 TYR 48 8.119 -3.824 -8.152 958 HD2 TYR 48 HD2 TYR 48 6.821 -7.219 -10.472 959 HE1 TYR 48 HE1 TYR 48 9.152 -5.346 -6.505 960 HE2 TYR 48 HE2 TYR 48 7.782 -8.737 -8.807 961 HH TYR 48 HH TYR 48 9.460 -7.541 -5.860 962 H GLN 49 H GLN 49 6.768 -5.031 -13.594 963 HA GLN 49 HA GLN 49 8.171 -7.497 -13.509 964 HB2 GLN 49 HB2 GLN 49 6.773 -5.985 -15.738 965 HB3 GLN 49 HB3 GLN 49 7.373 -7.651 -15.906 966 HG2 GLN 49 HG2 GLN 49 5.933 -8.447 -14.153 967 HG3 GLN 49 HG3 GLN 49 5.527 -6.822 -13.635 968 HE21 GLN 49 HE22 GLN 49 3.257 -7.420 -13.865 969 HE22 GLN 49 HE21 GLN 49 2.499 -7.433 -15.430 970 H ARG 50 H ARG 50 9.352 -4.348 -14.424 971 HA ARG 50 HA ARG 50 11.424 -5.395 -16.234 972 HB2 ARG 50 HB2 ARG 50 10.747 -2.685 -15.014 973 HB3 ARG 50 HB3 ARG 50 12.305 -2.982 -15.785 974 HG2 ARG 50 HG2 ARG 50 10.803 -1.980 -17.389 975 HG3 ARG 50 HG3 ARG 50 11.220 -3.629 -17.878 976 HD2 ARG 50 HD2 ARG 50 9.030 -4.438 -17.062 977 HD3 ARG 50 HD3 ARG 50 8.618 -2.790 -16.544 978 HE ARG 50 HE ARG 50 9.373 -2.733 -19.285 979 HH11 ARG 50 HH11 ARG 50 6.725 -3.919 -17.245 980 HH12 ARG 50 HH12 ARG 50 5.562 -3.876 -18.541 981 HH21 ARG 50 HH21 ARG 50 7.821 -2.641 -20.930 982 HH22 ARG 50 HH22 ARG 50 6.171 -3.125 -20.615 983 H ILE 51 H ILE 51 11.052 -4.193 -12.905 984 HA ILE 51 HA ILE 51 13.801 -4.342 -12.142 985 HB ILE 51 HB ILE 51 11.232 -4.454 -10.511 986 HG12 ILE 51 HG12 ILE 51 11.549 -2.160 -10.043 987 HG13 ILE 51 HG13 ILE 51 13.086 -2.074 -10.933 988 HG21 ILE 51 HG21 ILE 51 13.131 -5.250 -9.159 989 HG22 ILE 51 HG22 ILE 51 14.103 -3.859 -9.671 990 HG23 ILE 51 HG23 ILE 51 12.662 -3.623 -8.647 991 HD11 ILE 51 HD11 ILE 51 11.917 -2.231 -13.041 992 HD12 ILE 51 HD12 ILE 51 10.391 -2.658 -12.198 993 HD13 ILE 51 HD13 ILE 51 11.077 -1.021 -12.059 994 H GLN 52 H GLN 52 11.543 -6.745 -12.877 995 HA GLN 52 HA GLN 52 13.192 -8.735 -11.392 996 HB2 GLN 52 HB2 GLN 52 10.276 -9.041 -12.228 997 HB3 GLN 52 HB3 GLN 52 11.183 -10.149 -11.199 998 HG2 GLN 52 HG2 GLN 52 10.265 -7.342 -10.535 999 HG3 GLN 52 HG3 GLN 52 9.738 -8.863 -9.812 1000 HE21 GLN 52 HE22 GLN 52 10.924 -6.376 -8.644 1001 HE22 GLN 52 HE21 GLN 52 12.338 -6.888 -7.756 1002 H ALA 53 H ALA 53 12.865 -7.613 -14.509 1003 HA ALA 53 HA ALA 53 13.644 -10.268 -15.541 1004 HB1 ALA 53 HB1 ALA 53 11.165 -10.090 -15.826 1005 HB2 ALA 53 HB2 ALA 53 11.416 -8.635 -16.821 1006 HB3 ALA 53 HB3 ALA 53 12.038 -10.202 -17.366 1007 H GLY 54 H GLY 54 14.471 -7.074 -15.353 1008 HA2 GLY 54 HA2 GLY 54 16.369 -7.356 -17.529 1009 HA3 GLY 54 HA3 GLY 54 15.098 -6.166 -17.883 1010 H LEU 55 H LEU 55 15.074 -5.857 -14.771 1011 HA LEU 55 HA LEU 55 15.737 -4.376 -13.256 1012 HB2 LEU 55 HB2 LEU 55 18.530 -5.027 -14.232 1013 HB3 LEU 55 HB3 LEU 55 18.074 -4.364 -12.663 1014 HG LEU 55 HG LEU 55 18.352 -6.567 -12.101 1015 HD11 LEU 55 HD11 LEU 55 15.441 -6.606 -12.955 1016 HD12 LEU 55 HD12 LEU 55 16.217 -7.591 -11.702 1017 HD13 LEU 55 HD13 LEU 55 16.081 -5.832 -11.487 1018 HD21 LEU 55 HD21 LEU 55 16.997 -7.538 -14.649 1019 HD22 LEU 55 HD22 LEU 55 18.759 -7.385 -14.431 1020 HD23 LEU 55 HD23 LEU 55 17.821 -8.509 -13.422 1021 H THR 56 H THR 56 17.552 -2.452 -12.897 1022 HA THR 56 HA THR 56 17.228 -0.637 -15.223 1023 HB THR 56 HB THR 56 16.495 1.156 -13.657 1024 HG1 THR 56 HG1 THR 56 15.829 0.508 -11.598 1025 HG21 THR 56 HG21 THR 56 14.192 0.362 -13.382 1026 HG22 THR 56 HG22 THR 56 14.831 -0.202 -14.936 1027 HG23 THR 56 HG23 THR 56 14.720 -1.327 -13.565 1028 H ALA 57 H ALA 57 19.366 -2.089 -13.197 1029 HA ALA 57 HA ALA 57 21.376 -0.009 -13.657 1030 HB1 ALA 57 HB1 ALA 57 20.693 -0.979 -10.851 1031 HB2 ALA 57 HB2 ALA 57 22.061 0.072 -11.297 1032 HB3 ALA 57 HB3 ALA 57 20.389 0.648 -11.502 1033 HA PRO 58 HA PRO 58 22.482 -4.607 -14.225 1034 HB2 PRO 58 HB2 PRO 58 23.849 -3.109 -16.470 1035 HB3 PRO 58 HB3 PRO 58 23.195 -4.775 -16.481 1036 HG2 PRO 58 HG2 PRO 58 21.771 -2.755 -17.588 1037 HG3 PRO 58 HG3 PRO 58 20.937 -3.938 -16.523 1038 HD2 PRO 58 HD2 PRO 58 21.865 -1.146 -15.840 1039 HD3 PRO 58 HD3 PRO 58 20.352 -1.997 -15.403 1040 H ASP 59 H ASP 59 24.346 -1.556 -14.213 1041 HA ASP 59 HA ASP 59 26.404 -2.710 -12.558 1042 HB2 ASP 59 HB2 ASP 59 27.066 -3.763 -14.590 1043 HB3 ASP 59 HB3 ASP 59 26.879 -2.272 -15.526 1044 H5' U 36 H5' U 36 -17.387 -3.292 10.128 1045 H5'' U 36 H5'' U 36 -16.923 -3.056 8.435 1046 H4' U 36 H4' U 36 -17.033 -5.745 9.889 1047 H3' U 36 H3' U 36 -15.130 -3.873 10.386 1048 H2' U 36 H2' U 36 -14.136 -3.387 8.396 1049 HO2' U 36 HO2' U 36 -12.652 -4.992 9.192 1050 H1' U 36 H1' U 36 -14.727 -5.632 6.690 1051 H3 U 36 H3 U 36 -18.003 -3.629 3.972 1052 H5 U 36 H5 U 36 -15.655 -0.602 5.688 1053 H6 U 36 H6 U 36 -14.690 -2.224 7.147 1054 HO5' U 36 HO5' U 36 -18.665 -4.459 7.879 1055 H5' C 37 H5' C 37 -14.955 -4.053 14.031 1056 H5'' C 37 H5'' C 37 -15.066 -3.659 12.319 1057 H4' C 37 H4' C 37 -12.336 -3.647 13.589 1058 H3' C 37 H3' C 37 -14.362 -2.360 14.987 1059 H2' C 37 H2' C 37 -15.082 -0.973 13.291 1060 HO2' C 37 HO2' C 37 -12.897 0.397 14.492 1061 H1' C 37 H1' C 37 -12.268 -0.457 12.338 1062 H41 C 37 H41 C 37 -15.535 1.724 7.339 1063 H42 C 37 H42 C 37 -16.899 0.677 7.672 1064 H5 C 37 H5 C 37 -16.898 -0.931 9.530 1065 H6 C 37 H6 C 37 -15.605 -1.769 11.417 1066 H5' A 38 H5' A 38 -11.896 -5.217 14.810 1067 H5'' A 38 H5'' A 38 -11.214 -5.389 16.438 1068 H4' A 38 H4' A 38 -9.922 -6.790 15.017 1069 H3' A 38 H3' A 38 -8.688 -4.926 16.577 1070 H2' A 38 H2' A 38 -8.701 -3.143 15.014 1071 HO2' A 38 HO2' A 38 -6.307 -4.593 14.552 1072 H1' A 38 H1' A 38 -7.828 -4.917 12.759 1073 H8 A 38 H8 A 38 -9.634 -1.767 13.887 1074 H61 A 38 H61 A 38 -11.015 -0.878 7.917 1075 H62 A 38 H62 A 38 -11.109 -0.216 9.534 1076 H2 A 38 H2 A 38 -9.177 -4.925 8.320 1077 H5' G 39 H5' G 39 -5.675 -9.473 15.134 1078 H5'' G 39 H5'' G 39 -5.764 -8.032 14.104 1079 H4' G 39 H4' G 39 -7.199 -10.550 13.218 1080 H3' G 39 H3' G 39 -4.651 -10.891 13.893 1081 H2' G 39 H2' G 39 -3.877 -8.801 13.152 1082 HO2' G 39 HO2' G 39 -2.663 -9.115 11.277 1083 H1' G 39 H1' G 39 -5.190 -8.944 10.460 1084 H8 G 39 H8 G 39 -7.127 -6.476 11.416 1085 H1 G 39 H1 G 39 -1.243 -4.101 12.358 1086 H21 G 39 H21 G 39 0.222 -5.712 12.406 1087 H22 G 39 H22 G 39 -0.217 -7.398 12.211 1088 H5' G 40 H5' G 40 -4.300 -11.981 9.374 1089 H5'' G 40 H5'' G 40 -3.878 -13.695 9.347 1090 H4' G 40 H4' G 40 -2.634 -12.396 7.681 1091 H3' G 40 H3' G 40 -1.486 -14.312 9.419 1092 H2' G 40 H2' G 40 -0.426 -12.540 10.681 1093 HO2' G 40 HO2' G 40 1.303 -13.335 8.555 1094 H1' G 40 H1' G 40 0.009 -11.287 7.943 1095 H8 G 40 H8 G 40 -0.823 -10.006 11.527 1096 H1 G 40 H1 G 40 4.693 -7.815 9.088 1097 H21 G 40 H21 G 40 5.109 -8.810 7.142 1098 H22 G 40 H22 G 40 3.973 -9.917 6.414 1099 H5' A 41 H5' A 41 -2.763 -15.030 4.933 1100 H5'' A 41 H5'' A 41 -3.053 -13.699 6.076 1101 H4' A 41 H4' A 41 -4.613 -16.304 6.174 1102 H3' A 41 H3' A 41 -4.929 -13.960 4.320 1103 H2' A 41 H2' A 41 -7.194 -13.700 4.790 1104 HO2' A 41 HO2' A 41 -8.446 -15.376 5.145 1105 H1' A 41 H1' A 41 -7.230 -14.493 7.458 1106 H8 A 41 H8 A 41 -5.317 -11.923 5.262 1107 H61 A 41 H61 A 41 -7.605 -7.788 9.298 1108 H62 A 41 H62 A 41 -6.784 -7.947 7.758 1109 H2 A 41 H2 A 41 -8.401 -11.807 10.880 1110 H5' C 42 H5' C 42 -7.246 -14.104 0.263 1111 H5'' C 42 H5'' C 42 -5.910 -13.383 1.180 1112 H4' C 42 H4' C 42 -7.490 -12.576 2.872 1113 H3' C 42 H3' C 42 -9.361 -14.303 2.082 1114 H2' C 42 H2' C 42 -9.614 -13.622 -0.176 1115 HO2' C 42 HO2' C 42 -11.671 -13.170 0.930 1116 H1' C 42 H1' C 42 -9.496 -10.703 0.382 1117 H41 C 42 H41 C 42 -8.198 -11.487 -5.825 1118 H42 C 42 H42 C 42 -6.577 -12.026 -5.425 1119 H5 C 42 H5 C 42 -5.824 -12.341 -3.108 1120 H6 C 42 H6 C 42 -6.512 -12.251 -0.796 1121 H5' A 43 H5' A 43 -12.256 -11.948 2.600 1122 H5'' A 43 H5'' A 43 -13.077 -11.960 4.156 1123 H4' A 43 H4' A 43 -14.543 -12.258 2.139 1124 H3' A 43 H3' A 43 -15.062 -13.506 4.468 1125 H2' A 43 H2' A 43 -13.506 -15.274 4.175 1126 HO2' A 43 HO2' A 43 -14.733 -17.143 3.780 1127 H1' A 43 H1' A 43 -14.497 -15.876 1.410 1128 H8 A 43 H8 A 43 -11.466 -14.908 0.385 1129 H61 A 43 H61 A 43 -8.440 -19.628 3.040 1130 H62 A 43 H62 A 43 -8.330 -18.339 1.855 1131 H2 A 43 H2 A 43 -12.444 -19.356 4.906 1132 H5' U 44 H5' U 44 -17.680 -12.287 -0.300 1133 H5'' U 44 H5'' U 44 -16.532 -13.568 0.131 1134 H4' U 44 H4' U 44 -15.712 -10.795 -0.869 1135 H3' U 44 H3' U 44 -16.106 -13.444 -2.299 1136 HO3' U 44 HO3' U 44 -17.712 -11.843 -2.632 1137 H2' U 44 H2' U 44 -14.320 -12.803 -3.780 1138 HO2' U 44 HO2' U 44 -14.857 -10.535 -3.884 1139 H1' U 44 H1' U 44 -12.646 -12.077 -1.769 1140 H3 U 44 H3 U 44 -11.330 -16.214 -3.170 1141 H5 U 44 H5 U 44 -14.521 -16.932 -0.529 1142 H6 U 44 H6 U 44 -14.936 -14.564 -0.470
Contact the webmaster for help, if required. Monday, April 29, 2024 6:41:57 PM GMT (wattos1)