NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
467779 | 2kym | 16970 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET -2 H MET -2 1.808 0.000 0.855 2 HA MET -2 HA MET -2 2.105 1.009 -1.624 3 HB2 MET -2 2HB MET -2 4.092 -0.376 -1.901 4 HB3 MET -2 3HB MET -2 3.973 0.204 -0.245 5 HG2 MET -2 2HG MET -2 3.642 -1.864 0.607 6 HG3 MET -2 3HG MET -2 2.781 -2.435 -0.820 7 HE1 MET -2 3HE MET -2 5.192 -4.870 -2.036 8 HE2 MET -2 1HE MET -2 4.395 -4.895 -0.462 9 HE3 MET -2 2HE MET -2 3.542 -4.268 -1.873 10 H ALA -1 H ALA -1 2.891 -0.499 -3.595 11 HA ALA -1 HA ALA -1 0.493 -2.002 -4.346 12 HB1 ALA -1 1HB ALA -1 0.730 -1.053 -6.337 13 HB2 ALA -1 2HB ALA -1 2.109 -0.151 -5.707 14 HB3 ALA -1 3HB ALA -1 2.360 -1.707 -6.499 15 HA PRO 1 HA PRO 1 2.422 -5.943 -4.349 16 HB2 PRO 1 2HB PRO 1 1.395 -7.093 -6.583 17 HB3 PRO 1 3HB PRO 1 0.439 -6.807 -5.124 18 HG2 PRO 1 2HG PRO 1 0.574 -5.200 -7.647 19 HG3 PRO 1 3HG PRO 1 -0.844 -5.652 -6.683 20 HD2 PRO 1 2HD PRO 1 0.298 -3.202 -6.533 21 HD3 PRO 1 3HD PRO 1 -0.489 -3.976 -5.142 22 H LEU 2 H LEU 2 4.550 -4.884 -4.773 23 HA LEU 2 HA LEU 2 5.547 -4.821 -7.462 24 HB2 LEU 2 2HB LEU 2 7.424 -3.868 -6.598 25 HB3 LEU 2 3HB LEU 2 6.275 -3.486 -5.317 26 HG LEU 2 HG LEU 2 7.246 -5.829 -4.399 27 HD11 LEU 2 1HD1 LEU 2 9.141 -4.875 -6.398 28 HD12 LEU 2 2HD1 LEU 2 9.020 -6.445 -5.605 29 HD13 LEU 2 3HD1 LEU 2 9.862 -5.117 -4.806 30 HD21 LEU 2 3HD2 LEU 2 8.822 -4.383 -3.041 31 HD22 LEU 2 1HD2 LEU 2 7.119 -3.924 -3.015 32 HD23 LEU 2 2HD2 LEU 2 8.259 -3.023 -4.015 33 H PHE 3 H PHE 3 7.320 -6.104 -8.260 34 HA PHE 3 HA PHE 3 7.610 -8.727 -6.968 35 HB2 PHE 3 2HB PHE 3 6.904 -8.171 -9.846 36 HB3 PHE 3 3HB PHE 3 7.611 -9.700 -9.336 37 HD1 PHE 3 HD2 PHE 3 4.804 -7.420 -8.426 38 HD2 PHE 3 HD1 PHE 3 6.193 -11.424 -8.809 39 HE1 PHE 3 HE2 PHE 3 2.566 -8.249 -7.830 40 HE2 PHE 3 HE1 PHE 3 3.957 -12.261 -8.215 41 HZ PHE 3 HZ PHE 3 2.140 -10.673 -7.723 42 H ALA 4 H ALA 4 9.591 -9.746 -7.255 43 HA ALA 4 HA ALA 4 11.672 -8.128 -8.575 44 HB1 ALA 4 1HB ALA 4 13.141 -9.365 -6.743 45 HB2 ALA 4 2HB ALA 4 12.325 -7.835 -6.416 46 HB3 ALA 4 3HB ALA 4 11.606 -9.352 -5.874 47 H VAL 5 H VAL 5 13.448 -9.282 -9.484 48 HA VAL 5 HA VAL 5 12.886 -12.129 -10.009 49 HB VAL 5 HB VAL 5 12.413 -10.817 -12.011 50 HG11 VAL 5 1HG1 VAL 5 13.754 -9.214 -12.884 51 HG12 VAL 5 2HG1 VAL 5 14.319 -9.111 -11.215 52 HG13 VAL 5 3HG1 VAL 5 15.237 -10.038 -12.403 53 HG21 VAL 5 3HG2 VAL 5 14.763 -11.898 -13.154 54 HG22 VAL 5 1HG2 VAL 5 14.289 -12.954 -11.823 55 HG23 VAL 5 2HG2 VAL 5 13.145 -12.598 -13.117 56 H THR 6 H THR 6 14.492 -13.509 -9.598 57 HA THR 6 HA THR 6 16.909 -12.588 -8.396 58 HB THR 6 HB THR 6 17.255 -15.296 -9.071 59 HG1 THR 6 HG1 THR 6 15.112 -15.970 -8.055 60 HG21 THR 6 3HG2 THR 6 17.910 -15.014 -6.947 61 HG22 THR 6 1HG2 THR 6 16.223 -15.288 -6.517 62 HG23 THR 6 2HG2 THR 6 16.829 -13.642 -6.707 63 H LEU 7 H LEU 7 18.947 -12.464 -9.200 64 HA LEU 7 HA LEU 7 19.257 -12.969 -12.085 65 HB2 LEU 7 2HB LEU 7 20.986 -11.125 -10.472 66 HB3 LEU 7 3HB LEU 7 20.770 -11.182 -12.220 67 HG LEU 7 HG LEU 7 18.758 -10.188 -10.203 68 HD11 LEU 7 1HD1 LEU 7 19.359 -8.195 -12.030 69 HD12 LEU 7 2HD1 LEU 7 20.919 -8.924 -11.654 70 HD13 LEU 7 3HD1 LEU 7 19.907 -8.291 -10.357 71 HD21 LEU 7 3HD2 LEU 7 18.582 -10.150 -13.211 72 HD22 LEU 7 1HD2 LEU 7 17.356 -9.628 -12.055 73 HD23 LEU 7 2HD2 LEU 7 17.771 -11.337 -12.188 74 H TYR 8 H TYR 8 20.212 -13.972 -9.019 75 HA TYR 8 HA TYR 8 22.401 -15.537 -10.184 76 HB2 TYR 8 2HB TYR 8 22.573 -14.081 -7.537 77 HB3 TYR 8 3HB TYR 8 23.797 -15.156 -8.203 78 HD1 TYR 8 HD2 TYR 8 22.112 -11.898 -8.650 79 HD2 TYR 8 HD1 TYR 8 25.359 -14.386 -9.822 80 HE1 TYR 8 HE2 TYR 8 23.152 -9.989 -9.800 81 HE2 TYR 8 HE1 TYR 8 26.409 -12.483 -10.974 82 HH TYR 8 HH TYR 8 24.825 -9.307 -11.093 83 H GLU 9 H GLU 9 22.880 -17.497 -9.046 84 HA GLU 9 HA GLU 9 20.520 -18.685 -7.886 85 HB2 GLU 9 2HB GLU 9 21.731 -20.038 -9.437 86 HB3 GLU 9 3HB GLU 9 23.244 -19.775 -8.582 87 HG2 GLU 9 2HG GLU 9 22.782 -21.320 -6.990 88 HG3 GLU 9 3HG GLU 9 21.043 -21.045 -7.069 89 H PHE 10 H PHE 10 20.112 -18.155 -5.826 90 HA PHE 10 HA PHE 10 22.334 -18.244 -3.899 91 HB2 PHE 10 2HB PHE 10 21.231 -16.075 -3.977 92 HB3 PHE 10 3HB PHE 10 19.664 -16.835 -3.721 93 HD1 PHE 10 HD2 PHE 10 19.065 -17.746 -1.537 94 HD2 PHE 10 HD1 PHE 10 22.757 -15.725 -2.168 95 HE1 PHE 10 HE2 PHE 10 19.346 -17.508 0.895 96 HE2 PHE 10 HE1 PHE 10 23.045 -15.485 0.264 97 HZ PHE 10 HZ PHE 10 21.337 -16.375 1.799 98 H LYS 11 H LYS 11 22.416 -20.277 -3.137 99 HA LYS 11 HA LYS 11 20.044 -21.836 -2.666 100 HB2 LYS 11 2HB LYS 11 22.932 -22.371 -1.947 101 HB3 LYS 11 3HB LYS 11 21.621 -23.535 -1.804 102 HG2 LYS 11 2HG LYS 11 22.658 -22.303 -4.347 103 HG3 LYS 11 3HG LYS 11 22.887 -23.967 -3.805 104 HD2 LYS 11 2HD LYS 11 20.341 -24.136 -3.800 105 HD3 LYS 11 3HD LYS 11 20.354 -22.625 -4.713 106 HE2 LYS 11 2HE LYS 11 20.267 -24.293 -6.350 107 HE3 LYS 11 3HE LYS 11 21.962 -23.814 -6.306 108 HZ1 LYS 11 3HZ LYS 11 22.228 -26.042 -6.203 109 HZ2 LYS 11 1HZ LYS 11 20.719 -26.320 -5.492 110 HZ3 LYS 11 2HZ LYS 11 22.012 -25.776 -4.547 111 H ALA 12 H ALA 12 19.020 -22.224 -0.774 112 HA ALA 12 HA ALA 12 19.282 -20.414 1.360 113 HB1 ALA 12 1HB ALA 12 17.175 -21.475 0.934 114 HB2 ALA 12 2HB ALA 12 17.870 -23.072 1.213 115 HB3 ALA 12 3HB ALA 12 17.713 -21.933 2.550 116 H GLU 13 H GLU 13 19.733 -20.963 3.630 117 HA GLU 13 HA GLU 13 21.843 -23.005 3.880 118 HB2 GLU 13 2HB GLU 13 22.836 -21.421 5.627 119 HB3 GLU 13 3HB GLU 13 23.029 -20.979 3.937 120 HG2 GLU 13 2HG GLU 13 21.382 -19.306 4.078 121 HG3 GLU 13 3HG GLU 13 20.800 -19.903 5.631 122 H ARG 14 H ARG 14 19.242 -21.225 5.440 123 HA ARG 14 HA ARG 14 19.032 -23.397 7.410 124 HB2 ARG 14 2HB ARG 14 19.033 -20.434 7.908 125 HB3 ARG 14 3HB ARG 14 18.200 -21.529 9.003 126 HG2 ARG 14 2HG ARG 14 21.012 -22.157 8.309 127 HG3 ARG 14 3HG ARG 14 20.710 -20.789 9.382 128 HD2 ARG 14 2HD ARG 14 21.077 -22.865 10.632 129 HD3 ARG 14 3HD ARG 14 19.456 -22.223 10.890 130 HE ARG 14 HE ARG 14 18.585 -24.087 9.873 131 HH11 ARG 14 1HH1 ARG 14 22.010 -23.925 9.267 132 HH12 ARG 14 2HH1 ARG 14 22.094 -25.511 8.574 133 HH21 ARG 14 1HH2 ARG 14 18.683 -26.176 8.962 134 HH22 ARG 14 2HH2 ARG 14 20.201 -26.790 8.400 135 H ASP 15 H ASP 15 16.803 -22.901 8.689 136 HA ASP 15 HA ASP 15 14.763 -23.410 6.801 137 HB2 ASP 15 2HB ASP 15 14.755 -22.847 9.758 138 HB3 ASP 15 3HB ASP 15 13.252 -23.056 8.863 139 H ASP 16 H ASP 16 16.134 -20.516 7.906 140 HA ASP 16 HA ASP 16 13.755 -18.941 7.237 141 HB2 ASP 16 2HB ASP 16 14.751 -17.122 8.367 142 HB3 ASP 16 3HB ASP 16 15.124 -18.530 9.358 143 H GLU 17 H GLU 17 15.582 -20.368 5.307 144 HA GLU 17 HA GLU 17 16.037 -18.058 3.558 145 HB2 GLU 17 2HB GLU 17 18.032 -20.070 4.449 146 HB3 GLU 17 3HB GLU 17 18.080 -19.598 2.756 147 HG2 GLU 17 2HG GLU 17 19.534 -18.092 3.667 148 HG3 GLU 17 3HG GLU 17 18.029 -17.177 3.730 149 H LEU 18 H LEU 18 15.636 -18.407 1.400 150 HA LEU 18 HA LEU 18 14.623 -21.080 0.685 151 HB2 LEU 18 2HB LEU 18 12.819 -19.439 0.920 152 HB3 LEU 18 3HB LEU 18 13.613 -18.402 -0.264 153 HG LEU 18 HG LEU 18 13.338 -20.605 -1.754 154 HD11 LEU 18 1HD1 LEU 18 11.579 -21.954 -1.236 155 HD12 LEU 18 2HD1 LEU 18 10.746 -20.706 -0.311 156 HD13 LEU 18 3HD1 LEU 18 12.121 -21.555 0.395 157 HD21 LEU 18 3HD2 LEU 18 10.903 -19.477 -2.157 158 HD22 LEU 18 1HD2 LEU 18 12.418 -18.846 -2.802 159 HD23 LEU 18 2HD2 LEU 18 11.748 -18.178 -1.314 160 H ASP 19 H ASP 19 15.597 -22.026 -0.979 161 HA ASP 19 HA ASP 19 17.768 -20.823 -2.328 162 HB2 ASP 19 2HB ASP 19 17.951 -22.865 -3.550 163 HB3 ASP 19 3HB ASP 19 17.436 -23.294 -1.922 164 H VAL 20 H VAL 20 17.961 -19.933 -4.336 165 HA VAL 20 HA VAL 20 15.601 -19.805 -6.060 166 HB VAL 20 HB VAL 20 16.274 -17.295 -6.414 167 HG11 VAL 20 1HG1 VAL 20 14.327 -18.645 -4.866 168 HG12 VAL 20 2HG1 VAL 20 14.838 -17.221 -3.957 169 HG13 VAL 20 3HG1 VAL 20 14.224 -17.046 -5.601 170 HG21 VAL 20 3HG2 VAL 20 18.143 -17.823 -4.566 171 HG22 VAL 20 1HG2 VAL 20 17.434 -16.224 -4.790 172 HG23 VAL 20 2HG2 VAL 20 16.837 -17.282 -3.511 173 H SER 21 H SER 21 16.088 -19.080 -8.240 174 HA SER 21 HA SER 21 18.930 -19.371 -8.955 175 HB2 SER 21 2HB SER 21 16.536 -20.790 -10.043 176 HB3 SER 21 3HB SER 21 17.858 -20.406 -11.145 177 HG SER 21 HG SER 21 18.360 -22.366 -10.312 178 HA PRO 22 HA PRO 22 18.559 -15.741 -11.390 179 HB2 PRO 22 2HB PRO 22 20.102 -16.328 -13.545 180 HB3 PRO 22 3HB PRO 22 20.774 -16.003 -11.943 181 HG2 PRO 22 2HG PRO 22 20.263 -18.630 -13.286 182 HG3 PRO 22 3HG PRO 22 21.670 -18.112 -12.338 183 HD2 PRO 22 2HD PRO 22 19.713 -19.673 -11.307 184 HD3 PRO 22 3HD PRO 22 20.615 -18.501 -10.326 185 H GLY 23 H GLY 23 16.717 -15.183 -12.371 186 HA2 GLY 23 2HA GLY 23 15.583 -14.948 -14.499 187 HA3 GLY 23 3HA GLY 23 15.969 -16.631 -14.830 188 H GLU 24 H GLU 24 15.066 -16.291 -11.631 189 HA GLU 24 HA GLU 24 12.463 -17.471 -12.202 190 HB2 GLU 24 2HB GLU 24 14.292 -17.396 -9.858 191 HB3 GLU 24 3HB GLU 24 12.572 -17.556 -9.534 192 HG2 GLU 24 2HG GLU 24 14.159 -19.373 -11.332 193 HG3 GLU 24 3HG GLU 24 13.747 -19.716 -9.653 194 H ASN 25 H ASN 25 10.579 -16.792 -10.893 195 HA ASN 25 HA ASN 25 10.539 -13.863 -10.624 196 HB2 ASN 25 2HB ASN 25 8.240 -15.774 -11.099 197 HB3 ASN 25 3HB ASN 25 8.111 -14.021 -10.993 198 HD21 ASN 25 1HD2 ASN 25 8.396 -12.847 -12.774 199 HD22 ASN 25 2HD2 ASN 25 8.929 -13.465 -14.297 200 H LEU 26 H LEU 26 10.488 -13.089 -8.629 201 HA LEU 26 HA LEU 26 9.227 -14.715 -6.519 202 HB2 LEU 26 2HB LEU 26 11.539 -12.810 -6.196 203 HB3 LEU 26 3HB LEU 26 10.820 -13.811 -4.937 204 HG LEU 26 HG LEU 26 11.967 -15.172 -7.321 205 HD11 LEU 26 1HD1 LEU 26 14.061 -15.055 -5.513 206 HD12 LEU 26 2HD1 LEU 26 13.474 -13.394 -5.604 207 HD13 LEU 26 3HD1 LEU 26 13.968 -14.236 -7.072 208 HD21 LEU 26 3HD2 LEU 26 10.769 -16.161 -5.206 209 HD22 LEU 26 1HD2 LEU 26 12.360 -15.953 -4.472 210 HD23 LEU 26 2HD2 LEU 26 12.175 -16.965 -5.905 211 H SER 27 H SER 27 8.186 -13.558 -4.808 212 HA SER 27 HA SER 27 7.223 -10.912 -5.664 213 HB2 SER 27 2HB SER 27 5.685 -13.055 -5.244 214 HB3 SER 27 3HB SER 27 5.765 -12.469 -3.583 215 HG SER 27 HG SER 27 4.018 -11.513 -4.614 216 H ILE 28 H ILE 28 8.063 -9.267 -4.583 217 HA ILE 28 HA ILE 28 9.478 -9.576 -2.135 218 HB ILE 28 HB ILE 28 8.548 -7.068 -3.537 219 HG12 ILE 28 2HG1 ILE 28 10.146 -8.501 -4.802 220 HG13 ILE 28 3HG1 ILE 28 10.813 -6.927 -4.381 221 HG21 ILE 28 1HG2 ILE 28 8.938 -6.274 -1.423 222 HG22 ILE 28 2HG2 ILE 28 10.136 -7.514 -1.059 223 HG23 ILE 28 3HG2 ILE 28 10.558 -6.162 -2.109 224 HD11 ILE 28 3HD1 ILE 28 12.464 -8.652 -4.061 225 HD12 ILE 28 1HD1 ILE 28 12.009 -7.959 -2.505 226 HD13 ILE 28 2HD1 ILE 28 11.375 -9.533 -2.988 227 H CYS 29 H CYS 29 8.936 -8.970 -0.065 228 HA CYS 29 HA CYS 29 6.121 -8.228 0.385 229 HB2 CYS 29 2HB CYS 29 7.743 -10.009 2.206 230 HB3 CYS 29 3HB CYS 29 6.019 -9.672 2.296 231 HG CYS 29 HG CYS 29 7.643 -11.962 0.509 232 H ALA 30 H ALA 30 9.449 -8.035 1.509 233 HA ALA 30 HA ALA 30 9.096 -5.389 2.482 234 HB1 ALA 30 1HB ALA 30 8.730 -7.589 4.367 235 HB2 ALA 30 2HB ALA 30 9.937 -6.409 4.879 236 HB3 ALA 30 3HB ALA 30 8.294 -5.885 4.510 237 H HIS 31 H HIS 31 11.123 -4.659 3.710 238 HA HIS 31 HA HIS 31 13.475 -6.103 2.678 239 HB2 HIS 31 2HB HIS 31 14.537 -4.054 2.106 240 HB3 HIS 31 3HB HIS 31 12.906 -3.957 1.450 241 HD1 HIS 31 HD1 HIS 31 15.225 -1.903 3.080 242 HD2 HIS 31 HD2 HIS 31 11.162 -2.591 3.605 243 HE1 HIS 31 HE1 HIS 31 14.360 0.101 4.328 244 H TYR 32 H TYR 32 15.539 -5.196 3.817 245 HA TYR 32 HA TYR 32 15.039 -4.625 6.641 246 HB2 TYR 32 2HB TYR 32 15.221 -7.120 6.318 247 HB3 TYR 32 3HB TYR 32 16.876 -6.864 5.779 248 HD1 TYR 32 HD1 TYR 32 14.597 -6.716 8.661 249 HD2 TYR 32 HD2 TYR 32 18.625 -6.334 7.344 250 HE1 TYR 32 HE1 TYR 32 15.361 -6.788 10.997 251 HE2 TYR 32 HE2 TYR 32 19.401 -6.407 9.677 252 HH TYR 32 HH TYR 32 17.366 -6.000 12.303 253 H ASP 33 H ASP 33 16.007 -2.669 6.654 254 HA ASP 33 HA ASP 33 17.654 -1.100 6.647 255 HB2 ASP 33 2HB ASP 33 19.138 -3.654 7.046 256 HB3 ASP 33 3HB ASP 33 20.075 -2.211 6.669 257 H TYR 34 H TYR 34 16.704 -2.493 4.096 258 HA TYR 34 HA TYR 34 17.019 -2.216 1.860 259 HB2 TYR 34 2HB TYR 34 19.242 -0.305 2.596 260 HB3 TYR 34 3HB TYR 34 18.359 -0.374 1.075 261 HD1 TYR 34 HD2 TYR 34 18.219 0.657 4.591 262 HD2 TYR 34 HD1 TYR 34 16.135 0.562 0.883 263 HE1 TYR 34 HE2 TYR 34 16.604 2.294 5.464 264 HE2 TYR 34 HE1 TYR 34 14.515 2.199 1.745 265 HH TYR 34 HH TYR 34 14.738 4.124 3.758 266 H GLU 35 H GLU 35 18.607 -4.139 3.525 267 HA GLU 35 HA GLU 35 20.819 -4.589 1.630 268 HB2 GLU 35 2HB GLU 35 20.949 -6.016 4.194 269 HB3 GLU 35 3HB GLU 35 22.207 -5.156 3.318 270 HG2 GLU 35 2HG GLU 35 20.995 -3.027 4.114 271 HG3 GLU 35 3HG GLU 35 20.220 -4.095 5.281 272 H TRP 36 H TRP 36 18.291 -6.128 3.562 273 HA TRP 36 HA TRP 36 18.489 -8.487 1.807 274 HB2 TRP 36 2HB TRP 36 17.453 -8.366 4.648 275 HB3 TRP 36 3HB TRP 36 17.552 -9.810 3.644 276 HD1 TRP 36 HD1 TRP 36 19.886 -7.238 5.344 277 HE1 TRP 36 HE1 TRP 36 22.132 -8.398 5.828 278 HE3 TRP 36 HE3 TRP 36 18.985 -11.732 3.079 279 HZ2 TRP 36 HZ2 TRP 36 23.360 -10.888 5.317 280 HZ3 TRP 36 HZ3 TRP 36 20.748 -13.449 3.121 281 HH2 TRP 36 HH2 TRP 36 22.889 -13.033 4.217 282 H PHE 37 H PHE 37 16.662 -9.255 0.833 283 HA PHE 37 HA PHE 37 14.201 -7.688 1.249 284 HB2 PHE 37 2HB PHE 37 15.703 -8.262 -1.169 285 HB3 PHE 37 3HB PHE 37 14.034 -8.807 -1.302 286 HD1 PHE 37 HD2 PHE 37 12.380 -6.932 -0.102 287 HD2 PHE 37 HD1 PHE 37 16.061 -6.216 -2.114 288 HE1 PHE 37 HE2 PHE 37 11.666 -4.627 -0.581 289 HE2 PHE 37 HE1 PHE 37 15.353 -3.909 -2.596 290 HZ PHE 37 HZ PHE 37 13.153 -3.112 -1.830 291 H ILE 38 H ILE 38 12.261 -8.769 1.340 292 HA ILE 38 HA ILE 38 12.462 -11.653 1.781 293 HB ILE 38 HB ILE 38 10.068 -9.904 2.325 294 HG12 ILE 38 2HG1 ILE 38 11.967 -9.003 3.563 295 HG13 ILE 38 3HG1 ILE 38 10.856 -9.809 4.665 296 HG21 ILE 38 1HG2 ILE 38 10.342 -12.071 4.127 297 HG22 ILE 38 2HG2 ILE 38 9.096 -11.809 2.908 298 HG23 ILE 38 3HG2 ILE 38 10.561 -12.699 2.494 299 HD11 ILE 38 3HD1 ILE 38 12.469 -11.130 5.390 300 HD12 ILE 38 1HD1 ILE 38 12.830 -11.666 3.749 301 HD13 ILE 38 2HD1 ILE 38 13.607 -10.220 4.396 302 H ALA 39 H ALA 39 12.422 -12.554 -0.244 303 HA ALA 39 HA ALA 39 10.089 -11.946 -1.934 304 HB1 ALA 39 1HB ALA 39 12.255 -13.553 -3.097 305 HB2 ALA 39 2HB ALA 39 11.364 -12.186 -3.769 306 HB3 ALA 39 3HB ALA 39 12.700 -11.905 -2.652 307 H LYS 40 H LYS 40 8.659 -13.512 -2.460 308 HA LYS 40 HA LYS 40 9.131 -16.185 -1.317 309 HB2 LYS 40 2HB LYS 40 6.559 -16.320 -1.481 310 HB3 LYS 40 3HB LYS 40 7.262 -15.335 -0.205 311 HG2 LYS 40 2HG LYS 40 6.829 -13.324 -1.442 312 HG3 LYS 40 3HG LYS 40 6.284 -14.255 -2.839 313 HD2 LYS 40 2HD LYS 40 4.400 -15.109 -1.568 314 HD3 LYS 40 3HD LYS 40 4.968 -14.270 -0.123 315 HE2 LYS 40 2HE LYS 40 4.790 -12.134 -1.516 316 HE3 LYS 40 3HE LYS 40 3.858 -13.100 -2.658 317 HZ1 LYS 40 3HZ LYS 40 2.414 -11.946 -1.114 318 HZ2 LYS 40 1HZ LYS 40 3.186 -12.674 0.203 319 HZ3 LYS 40 2HZ LYS 40 2.297 -13.617 -0.882 320 HA PRO 41 HA PRO 41 8.881 -18.068 -5.273 321 HB2 PRO 41 2HB PRO 41 7.560 -20.372 -4.714 322 HB3 PRO 41 3HB PRO 41 9.232 -20.080 -4.221 323 HG2 PRO 41 2HG PRO 41 6.715 -19.831 -2.620 324 HG3 PRO 41 3HG PRO 41 8.273 -20.535 -2.152 325 HD2 PRO 41 2HD PRO 41 7.518 -18.043 -1.408 326 HD3 PRO 41 3HD PRO 41 9.213 -18.477 -1.710 327 H ILE 42 H ILE 42 7.621 -17.873 -7.028 328 HA ILE 42 HA ILE 42 4.740 -17.446 -6.610 329 HB ILE 42 HB ILE 42 6.484 -16.550 -8.908 330 HG12 ILE 42 2HG1 ILE 42 5.090 -14.863 -6.825 331 HG13 ILE 42 3HG1 ILE 42 6.770 -15.369 -6.687 332 HG21 ILE 42 1HG2 ILE 42 3.663 -16.916 -8.732 333 HG22 ILE 42 2HG2 ILE 42 4.009 -15.191 -8.850 334 HG23 ILE 42 3HG2 ILE 42 4.618 -16.299 -10.080 335 HD11 ILE 42 3HD1 ILE 42 5.601 -13.670 -8.877 336 HD12 ILE 42 1HD1 ILE 42 6.613 -13.113 -7.544 337 HD13 ILE 42 2HD1 ILE 42 7.282 -14.192 -8.769 338 H ASN 43 H ASN 43 7.111 -19.116 -8.623 339 HA ASN 43 HA ASN 43 5.176 -20.404 -10.279 340 HB2 ASN 43 2HB ASN 43 8.124 -20.665 -9.846 341 HB3 ASN 43 3HB ASN 43 7.274 -21.952 -10.696 342 HD21 ASN 43 1HD2 ASN 43 7.991 -18.517 -10.715 343 HD22 ASN 43 2HD2 ASN 43 7.771 -18.291 -12.414 344 H ARG 43 H ARG 43 7.485 -21.902 -8.012 345 HA ARG 43 HA ARG 43 5.776 -24.199 -7.702 346 HB2 ARG 43 2HB ARG 43 7.538 -25.068 -6.261 347 HB3 ARG 43 3HB ARG 43 8.224 -24.430 -7.749 348 HG2 ARG 43 2HG ARG 43 8.896 -22.401 -6.588 349 HG3 ARG 43 3HG ARG 43 8.174 -23.006 -5.096 350 HD2 ARG 43 2HD ARG 43 9.844 -24.515 -4.736 351 HD3 ARG 43 3HD ARG 43 10.161 -24.736 -6.457 352 HE ARG 43 HE ARG 43 11.750 -23.107 -6.318 353 HH11 ARG 43 1HH1 ARG 43 9.603 -22.803 -3.595 354 HH12 ARG 43 2HH1 ARG 43 10.536 -21.559 -2.832 355 HH21 ARG 43 1HH2 ARG 43 12.987 -21.469 -5.324 356 HH22 ARG 43 2HH2 ARG 43 12.460 -20.799 -3.817 357 H LEU 44 H LEU 44 5.667 -25.016 -5.260 358 HA LEU 44 HA LEU 44 4.611 -22.797 -3.637 359 HB2 LEU 44 2HB LEU 44 3.375 -25.375 -4.417 360 HB3 LEU 44 3HB LEU 44 3.093 -24.813 -2.771 361 HG LEU 44 HG LEU 44 2.405 -23.299 -5.290 362 HD11 LEU 44 1HD1 LEU 44 0.747 -24.908 -3.365 363 HD12 LEU 44 2HD1 LEU 44 0.907 -25.118 -5.109 364 HD13 LEU 44 3HD1 LEU 44 0.059 -23.713 -4.464 365 HD21 LEU 44 3HD2 LEU 44 2.351 -21.508 -3.977 366 HD22 LEU 44 1HD2 LEU 44 2.692 -22.477 -2.544 367 HD23 LEU 44 2HD2 LEU 44 1.029 -22.269 -3.092 368 H GLY 45 H GLY 45 5.611 -22.601 -1.750 369 HA2 GLY 45 2HA GLY 45 6.327 -24.946 -0.204 370 HA3 GLY 45 3HA GLY 45 7.693 -23.995 -0.770 371 H GLY 46 H GLY 46 7.567 -21.609 -0.245 372 HA2 GLY 46 2HA GLY 46 5.964 -20.469 1.676 373 HA3 GLY 46 3HA GLY 46 7.191 -21.344 2.579 374 HA PRO 47 HA PRO 47 8.642 -17.045 1.143 375 HB2 PRO 47 2HB PRO 47 8.489 -15.764 3.532 376 HB3 PRO 47 3HB PRO 47 7.157 -15.792 2.370 377 HG2 PRO 47 2HG PRO 47 7.570 -17.463 4.819 378 HG3 PRO 47 3HG PRO 47 6.089 -16.684 4.233 379 HD2 PRO 47 2HD PRO 47 6.591 -19.319 3.867 380 HD3 PRO 47 3HD PRO 47 5.668 -18.352 2.699 381 H GLY 48 H GLY 48 10.742 -16.354 1.432 382 HA2 GLY 48 2HA GLY 48 12.286 -17.635 3.592 383 HA3 GLY 48 3HA GLY 48 12.853 -17.711 1.931 384 H LEU 49 H LEU 49 14.728 -16.571 2.182 385 HA LEU 49 HA LEU 49 14.413 -13.694 2.529 386 HB2 LEU 49 2HB LEU 49 15.326 -15.266 4.616 387 HB3 LEU 49 3HB LEU 49 16.802 -14.643 3.881 388 HG LEU 49 HG LEU 49 14.611 -12.729 4.534 389 HD11 LEU 49 1HD1 LEU 49 14.997 -12.669 6.783 390 HD12 LEU 49 2HD1 LEU 49 16.612 -13.362 6.641 391 HD13 LEU 49 3HD1 LEU 49 15.192 -14.397 6.488 392 HD21 LEU 49 3HD2 LEU 49 16.612 -11.992 3.327 393 HD22 LEU 49 1HD2 LEU 49 17.621 -12.569 4.653 394 HD23 LEU 49 2HD2 LEU 49 16.495 -11.237 4.918 395 H VAL 50 H VAL 50 15.465 -12.669 0.966 396 HA VAL 50 HA VAL 50 17.919 -13.854 -0.127 397 HB VAL 50 HB VAL 50 16.136 -14.472 -1.670 398 HG11 VAL 50 1HG1 VAL 50 14.670 -12.955 -2.689 399 HG12 VAL 50 2HG1 VAL 50 14.696 -12.470 -0.992 400 HG13 VAL 50 3HG1 VAL 50 15.623 -11.559 -2.184 401 HG21 VAL 50 3HG2 VAL 50 17.036 -13.367 -3.722 402 HG22 VAL 50 1HG2 VAL 50 17.972 -12.302 -2.673 403 HG23 VAL 50 2HG2 VAL 50 18.273 -14.039 -2.661 404 HA PRO 51 HA PRO 51 19.401 -9.730 0.464 405 HB2 PRO 51 2HB PRO 51 21.724 -9.989 -0.917 406 HB3 PRO 51 3HB PRO 51 21.479 -10.684 0.690 407 HG2 PRO 51 2HG PRO 51 21.309 -12.005 -1.991 408 HG3 PRO 51 3HG PRO 51 22.055 -12.599 -0.496 409 HD2 PRO 51 2HD PRO 51 19.609 -13.412 -1.325 410 HD3 PRO 51 3HD PRO 51 20.038 -13.274 0.392 411 H VAL 52 H VAL 52 19.685 -7.804 -0.692 412 HA VAL 52 HA VAL 52 18.232 -7.581 -3.108 413 HB VAL 52 HB VAL 52 20.161 -5.520 -2.053 414 HG11 VAL 52 1HG1 VAL 52 17.648 -4.559 -3.078 415 HG12 VAL 52 2HG1 VAL 52 19.291 -4.175 -3.595 416 HG13 VAL 52 3HG1 VAL 52 18.458 -5.577 -4.268 417 HG21 VAL 52 3HG2 VAL 52 17.749 -6.578 -0.824 418 HG22 VAL 52 1HG2 VAL 52 18.986 -5.513 -0.156 419 HG23 VAL 52 2HG2 VAL 52 17.660 -4.839 -1.102 420 H SER 53 H SER 53 21.537 -8.245 -2.429 421 HA SER 53 HA SER 53 22.569 -7.365 -4.961 422 HB2 SER 53 2HB SER 53 23.651 -8.704 -2.546 423 HB3 SER 53 3HB SER 53 24.494 -9.027 -4.062 424 HG SER 53 HG SER 53 24.683 -6.753 -4.331 425 H TYR 54 H TYR 54 20.587 -9.847 -4.163 426 HA TYR 54 HA TYR 54 21.551 -11.487 -6.411 427 HB2 TYR 54 2HB TYR 54 20.477 -12.386 -3.742 428 HB3 TYR 54 3HB TYR 54 20.494 -13.445 -5.147 429 HD1 TYR 54 HD1 TYR 54 22.866 -11.146 -3.384 430 HD2 TYR 54 HD2 TYR 54 22.265 -14.907 -5.281 431 HE1 TYR 54 HE1 TYR 54 25.192 -11.767 -2.878 432 HE2 TYR 54 HE2 TYR 54 24.589 -15.538 -4.780 433 HH TYR 54 HH TYR 54 26.414 -14.997 -3.525 434 H VAL 55 H VAL 55 19.500 -9.304 -6.116 435 HA VAL 55 HA VAL 55 17.389 -10.680 -7.563 436 HB VAL 55 HB VAL 55 15.574 -9.807 -6.237 437 HG11 VAL 55 1HG1 VAL 55 16.632 -11.980 -5.605 438 HG12 VAL 55 2HG1 VAL 55 17.537 -11.114 -4.361 439 HG13 VAL 55 3HG1 VAL 55 15.775 -11.177 -4.289 440 HG21 VAL 55 3HG2 VAL 55 16.536 -8.886 -3.867 441 HG22 VAL 55 1HG2 VAL 55 17.723 -8.239 -5.000 442 HG23 VAL 55 2HG2 VAL 55 16.013 -7.860 -5.203 443 H ARG 56 H ARG 56 15.808 -9.108 -8.500 444 HA ARG 56 HA ARG 56 16.970 -6.435 -8.875 445 HB2 ARG 56 2HB ARG 56 17.678 -7.510 -10.839 446 HB3 ARG 56 3HB ARG 56 16.178 -8.414 -10.992 447 HG2 ARG 56 2HG ARG 56 15.012 -6.580 -11.824 448 HG3 ARG 56 3HG ARG 56 16.207 -5.430 -11.221 449 HD2 ARG 56 2HD ARG 56 16.405 -5.638 -13.622 450 HD3 ARG 56 3HD ARG 56 17.836 -6.310 -12.843 451 HE ARG 56 HE ARG 56 17.255 -8.396 -13.623 452 HH11 ARG 56 1HH1 ARG 56 14.621 -6.173 -14.113 453 HH12 ARG 56 2HH1 ARG 56 13.720 -7.259 -15.118 454 HH21 ARG 56 1HH2 ARG 56 16.078 -9.835 -14.945 455 HH22 ARG 56 2HH2 ARG 56 14.549 -9.342 -15.590 456 H ILE 57 H ILE 57 15.516 -5.022 -8.182 457 HA ILE 57 HA ILE 57 12.758 -5.627 -7.877 458 HB ILE 57 HB ILE 57 14.016 -2.885 -7.855 459 HG12 ILE 57 2HG1 ILE 57 15.204 -4.431 -6.334 460 HG13 ILE 57 3HG1 ILE 57 14.327 -3.183 -5.455 461 HG21 ILE 57 1HG2 ILE 57 11.876 -2.287 -7.614 462 HG22 ILE 57 2HG2 ILE 57 11.359 -3.939 -7.280 463 HG23 ILE 57 3HG2 ILE 57 12.017 -2.943 -5.983 464 HD11 ILE 57 3HD1 ILE 57 14.221 -5.919 -5.033 465 HD12 ILE 57 1HD1 ILE 57 13.151 -4.696 -4.349 466 HD13 ILE 57 2HD1 ILE 57 12.700 -5.531 -5.836 467 H ILE 58 H ILE 58 11.131 -5.442 -9.271 468 HA ILE 58 HA ILE 58 11.334 -3.572 -11.507 469 HB ILE 58 HB ILE 58 10.461 -5.327 -13.074 470 HG12 ILE 58 2HG1 ILE 58 11.404 -7.224 -10.914 471 HG13 ILE 58 3HG1 ILE 58 9.717 -6.909 -11.305 472 HG21 ILE 58 1HG2 ILE 58 13.074 -6.398 -12.295 473 HG22 ILE 58 2HG2 ILE 58 12.553 -5.662 -13.810 474 HG23 ILE 58 3HG2 ILE 58 13.018 -4.642 -12.449 475 HD11 ILE 58 3HD1 ILE 58 11.706 -8.001 -13.274 476 HD12 ILE 58 1HD1 ILE 58 10.657 -9.004 -12.273 477 HD13 ILE 58 2HD1 ILE 58 9.955 -7.896 -13.453 478 H ASP 59 H ASP 59 9.130 -3.915 -12.859 479 HA ASP 59 HA ASP 59 6.921 -4.118 -10.929 480 HB2 ASP 59 2HB ASP 59 7.713 -1.711 -11.576 481 HB3 ASP 59 3HB ASP 59 6.867 -2.036 -13.086 482 H LEU 60 H LEU 60 5.200 -5.241 -11.622 483 HA LEU 60 HA LEU 60 5.320 -6.809 -13.933 484 HB2 LEU 60 2HB LEU 60 2.971 -6.037 -12.213 485 HB3 LEU 60 3HB LEU 60 2.902 -7.256 -13.484 486 HG LEU 60 HG LEU 60 4.505 -7.382 -10.933 487 HD11 LEU 60 1HD1 LEU 60 2.059 -8.797 -11.948 488 HD12 LEU 60 2HD1 LEU 60 2.271 -7.902 -10.443 489 HD13 LEU 60 3HD1 LEU 60 3.065 -9.462 -10.660 490 HD21 LEU 60 3HD2 LEU 60 5.798 -8.360 -12.729 491 HD22 LEU 60 1HD2 LEU 60 4.404 -9.302 -13.257 492 HD23 LEU 60 2HD2 LEU 60 5.153 -9.635 -11.694 493 H MET 61 H MET 61 4.273 -3.567 -13.473 494 HA MET 61 HA MET 61 2.748 -3.505 -15.951 495 HB2 MET 61 2HB MET 61 3.301 -1.499 -13.781 496 HB3 MET 61 3HB MET 61 2.605 -1.003 -15.318 497 HG2 MET 61 2HG MET 61 0.593 -1.840 -14.822 498 HG3 MET 61 3HG MET 61 1.267 -3.285 -14.074 499 HE1 MET 61 3HE MET 61 2.468 -3.330 -12.070 500 HE2 MET 61 1HE MET 61 2.664 -2.027 -10.897 501 HE3 MET 61 2HE MET 61 1.297 -3.133 -10.766 502 H ASP 62 H ASP 62 5.875 -2.588 -14.712 503 HA ASP 62 HA ASP 62 6.800 -2.079 -17.412 504 HB2 ASP 62 2HB ASP 62 5.937 0.114 -16.213 505 HB3 ASP 62 3HB ASP 62 7.506 0.030 -15.417 506 HA PRO 63 HA PRO 63 9.796 -4.306 -14.665 507 HB2 PRO 63 2HB PRO 63 10.371 -6.241 -16.481 508 HB3 PRO 63 3HB PRO 63 9.006 -6.348 -15.362 509 HG2 PRO 63 2HG PRO 63 9.037 -5.524 -18.240 510 HG3 PRO 63 3HG PRO 63 7.888 -6.573 -17.389 511 HD2 PRO 63 2HD PRO 63 7.356 -3.977 -17.942 512 HD3 PRO 63 3HD PRO 63 6.731 -4.792 -16.494 513 H ALA 64 H ALA 64 9.849 -2.732 -17.687 514 HA ALA 64 HA ALA 64 12.737 -3.018 -18.013 515 HB1 ALA 64 1HB ALA 64 12.471 -1.998 -20.150 516 HB2 ALA 64 2HB ALA 64 11.180 -3.187 -19.967 517 HB3 ALA 64 3HB ALA 64 10.833 -1.470 -19.759 518 H LYS 65 H LYS 65 10.658 -1.068 -16.327 519 HA LYS 65 HA LYS 65 12.042 1.439 -16.723 520 HB2 LYS 65 2HB LYS 65 9.544 1.086 -16.125 521 HB3 LYS 65 3HB LYS 65 10.126 0.868 -14.480 522 HG2 LYS 65 2HG LYS 65 11.246 3.111 -14.697 523 HG3 LYS 65 3HG LYS 65 10.358 3.315 -16.209 524 HD2 LYS 65 2HD LYS 65 8.940 2.616 -13.660 525 HD3 LYS 65 3HD LYS 65 9.347 4.290 -14.048 526 HE2 LYS 65 2HE LYS 65 8.063 2.788 -16.222 527 HE3 LYS 65 3HE LYS 65 7.054 3.036 -14.798 528 HZ1 LYS 65 3HZ LYS 65 8.483 5.203 -16.239 529 HZ2 LYS 65 1HZ LYS 65 7.387 5.389 -14.963 530 HZ3 LYS 65 2HZ LYS 65 6.850 4.820 -16.462 531 H TYR 66 H TYR 66 11.652 -0.872 -14.042 532 HA TYR 66 HA TYR 66 13.923 0.382 -12.680 533 HB2 TYR 66 2HB TYR 66 11.885 -1.627 -11.702 534 HB3 TYR 66 3HB TYR 66 13.214 -1.002 -10.732 535 HD1 TYR 66 HD1 TYR 66 10.064 -0.092 -12.434 536 HD2 TYR 66 HD2 TYR 66 13.085 1.139 -9.702 537 HE1 TYR 66 HE1 TYR 66 8.660 1.808 -11.747 538 HE2 TYR 66 HE2 TYR 66 11.689 3.041 -9.006 539 HH TYR 66 HH TYR 66 8.381 3.357 -10.007 540 H ALA 67 H ALA 67 14.049 -1.456 -15.055 541 HA ALA 67 HA ALA 67 15.317 -3.842 -13.995 542 HB1 ALA 67 1HB ALA 67 15.782 -3.861 -16.700 543 HB2 ALA 67 2HB ALA 67 14.403 -4.602 -15.886 544 HB3 ALA 67 3HB ALA 67 14.258 -2.983 -16.571 545 H SER 68 H SER 68 16.220 -0.704 -15.056 546 HA SER 68 HA SER 68 18.995 -1.470 -15.528 547 HB2 SER 68 2HB SER 68 18.345 0.117 -17.111 548 HB3 SER 68 3HB SER 68 17.407 1.045 -15.941 549 HG SER 68 HG SER 68 19.240 2.199 -16.242 550 H VAL 69 H VAL 69 16.995 -0.198 -13.048 551 HA VAL 69 HA VAL 69 18.694 1.371 -11.546 552 HB VAL 69 HB VAL 69 16.283 0.906 -11.039 553 HG11 VAL 69 1HG1 VAL 69 15.533 -1.066 -10.240 554 HG12 VAL 69 2HG1 VAL 69 16.965 -1.701 -11.053 555 HG13 VAL 69 3HG1 VAL 69 17.005 -1.376 -9.320 556 HG21 VAL 69 3HG2 VAL 69 17.594 0.374 -8.470 557 HG22 VAL 69 1HG2 VAL 69 18.295 1.704 -9.392 558 HG23 VAL 69 2HG2 VAL 69 16.583 1.729 -8.969 559 H ASP 70 H ASP 70 20.055 0.951 -9.751 560 HA ASP 70 HA ASP 70 21.398 -1.657 -9.918 561 HB2 ASP 70 2HB ASP 70 22.425 0.923 -8.717 562 HB3 ASP 70 3HB ASP 70 23.345 -0.561 -8.955 563 H THR 71 H THR 71 20.087 -2.856 -8.553 564 HA THR 71 HA THR 71 19.036 -2.134 -6.108 565 HB THR 71 HB THR 71 19.732 -4.777 -5.698 566 HG1 THR 71 HG1 THR 71 19.563 -5.775 -7.702 567 HG21 THR 71 3HG2 THR 71 17.352 -4.042 -7.363 568 HG22 THR 71 1HG2 THR 71 17.474 -3.495 -5.691 569 HG23 THR 71 2HG2 THR 71 17.478 -5.220 -6.057 570 H TYR 72 H TYR 72 22.297 -3.198 -6.878 571 HA TYR 72 HA TYR 72 23.243 -3.693 -4.301 572 HB2 TYR 72 2HB TYR 72 24.596 -4.345 -6.149 573 HB3 TYR 72 3HB TYR 72 24.638 -2.705 -6.788 574 HD1 TYR 72 HD2 TYR 72 25.254 -3.935 -3.323 575 HD2 TYR 72 HD1 TYR 72 26.882 -2.096 -6.797 576 HE1 TYR 72 HE2 TYR 72 27.355 -3.523 -2.113 577 HE2 TYR 72 HE1 TYR 72 28.989 -1.681 -5.597 578 HH TYR 72 HH TYR 72 29.281 -2.093 -2.202 579 H ASP 73 H ASP 73 23.132 -0.673 -6.151 580 HA ASP 73 HA ASP 73 24.470 0.929 -4.259 581 HB2 ASP 73 2HB ASP 73 22.672 1.455 -6.586 582 HB3 ASP 73 3HB ASP 73 23.008 2.775 -5.469 583 H ARG 74 H ARG 74 23.824 1.093 -2.210 584 HA ARG 74 HA ARG 74 21.303 0.638 -1.182 585 HB2 ARG 74 2HB ARG 74 22.061 1.607 0.844 586 HB3 ARG 74 3HB ARG 74 23.480 0.892 0.090 587 HG2 ARG 74 2HG ARG 74 22.776 3.801 -0.178 588 HG3 ARG 74 3HG ARG 74 23.799 3.166 1.112 589 HD2 ARG 74 2HD ARG 74 24.311 3.083 -1.854 590 HD3 ARG 74 3HD ARG 74 25.225 3.963 -0.630 591 HE ARG 74 HE ARG 74 25.511 1.208 -1.343 592 HH11 ARG 74 1HH1 ARG 74 25.850 3.506 1.250 593 HH12 ARG 74 2HH1 ARG 74 27.048 2.578 2.090 594 HH21 ARG 74 1HH2 ARG 74 27.088 -0.023 -0.247 595 HH22 ARG 74 2HH2 ARG 74 27.752 0.572 1.237 596 H GLU 75 H GLU 75 22.569 3.492 -2.716 597 HA GLU 75 HA GLU 75 20.639 5.340 -1.788 598 HB2 GLU 75 2HB GLU 75 22.695 5.264 -3.906 599 HB3 GLU 75 3HB GLU 75 21.349 6.356 -4.202 600 HG2 GLU 75 2HG GLU 75 21.775 7.340 -1.936 601 HG3 GLU 75 3HG GLU 75 23.250 6.377 -1.876 602 H GLN 76 H GLN 76 20.886 3.603 -4.893 603 HA GLN 76 HA GLN 76 18.440 4.462 -5.941 604 HB2 GLN 76 2HB GLN 76 19.843 1.838 -6.472 605 HB3 GLN 76 3HB GLN 76 18.634 2.596 -7.500 606 HG2 GLN 76 2HG GLN 76 20.578 4.545 -7.182 607 HG3 GLN 76 3HG GLN 76 21.484 3.042 -7.354 608 HE21 GLN 76 1HE2 GLN 76 22.222 3.121 -9.373 609 HE22 GLN 76 2HE2 GLN 76 21.249 3.331 -10.785 610 H VAL 77 H VAL 77 19.204 1.348 -4.374 611 HA VAL 77 HA VAL 77 16.653 0.277 -4.342 612 HB VAL 77 HB VAL 77 18.864 -0.812 -3.623 613 HG11 VAL 77 1HG1 VAL 77 18.007 0.300 -0.953 614 HG12 VAL 77 2HG1 VAL 77 19.347 -0.809 -1.246 615 HG13 VAL 77 3HG1 VAL 77 19.408 0.836 -1.879 616 HG21 VAL 77 3HG2 VAL 77 17.390 -2.074 -1.718 617 HG22 VAL 77 1HG2 VAL 77 16.132 -1.270 -2.656 618 HG23 VAL 77 2HG2 VAL 77 17.255 -2.373 -3.451 619 H MET 78 H MET 78 18.085 2.681 -2.239 620 HA MET 78 HA MET 78 16.124 2.595 -0.198 621 HB2 MET 78 2HB MET 78 18.342 4.380 -0.974 622 HB3 MET 78 3HB MET 78 17.042 5.148 -0.072 623 HG2 MET 78 2HG MET 78 17.293 3.394 1.667 624 HG3 MET 78 3HG MET 78 18.693 2.787 0.787 625 HE1 MET 78 3HE MET 78 20.805 3.180 1.522 626 HE2 MET 78 1HE MET 78 21.005 4.525 0.398 627 HE3 MET 78 2HE MET 78 21.519 4.695 2.076 628 H LYS 79 H LYS 79 16.582 4.870 -2.906 629 HA LYS 79 HA LYS 79 14.292 6.394 -2.510 630 HB2 LYS 79 2HB LYS 79 15.981 5.768 -4.899 631 HB3 LYS 79 3HB LYS 79 14.474 6.645 -5.124 632 HG2 LYS 79 2HG LYS 79 15.691 8.473 -4.753 633 HG3 LYS 79 3HG LYS 79 15.629 8.006 -3.052 634 HD2 LYS 79 2HD LYS 79 17.773 7.160 -3.068 635 HD3 LYS 79 3HD LYS 79 17.751 6.851 -4.806 636 HE2 LYS 79 2HE LYS 79 17.802 9.597 -3.560 637 HE3 LYS 79 3HE LYS 79 19.232 8.735 -4.126 638 HZ1 LYS 79 3HZ LYS 79 18.839 9.538 -6.136 639 HZ2 LYS 79 1HZ LYS 79 17.414 10.285 -5.612 640 HZ3 LYS 79 2HZ LYS 79 17.372 8.698 -6.193 641 H ILE 80 H ILE 80 14.713 3.337 -4.208 642 HA ILE 80 HA ILE 80 12.141 3.232 -5.376 643 HB ILE 80 HB ILE 80 13.988 0.966 -4.618 644 HG12 ILE 80 2HG1 ILE 80 13.542 2.224 -7.328 645 HG13 ILE 80 3HG1 ILE 80 14.848 2.701 -6.247 646 HG21 ILE 80 1HG2 ILE 80 12.569 -0.025 -6.648 647 HG22 ILE 80 2HG2 ILE 80 12.082 -0.211 -4.964 648 HG23 ILE 80 3HG2 ILE 80 11.352 1.049 -5.958 649 HD11 ILE 80 3HD1 ILE 80 16.087 0.938 -6.799 650 HD12 ILE 80 1HD1 ILE 80 14.720 -0.171 -6.700 651 HD13 ILE 80 2HD1 ILE 80 14.990 0.768 -8.169 652 H ILE 81 H ILE 81 13.437 1.651 -2.454 653 HA ILE 81 HA ILE 81 11.013 0.500 -1.628 654 HB ILE 81 HB ILE 81 13.408 1.321 0.016 655 HG12 ILE 81 2HG1 ILE 81 12.582 -1.420 -0.952 656 HG13 ILE 81 3HG1 ILE 81 13.735 -0.396 -1.802 657 HG21 ILE 81 1HG2 ILE 81 12.164 0.910 1.812 658 HG22 ILE 81 2HG2 ILE 81 10.814 0.356 0.823 659 HG23 ILE 81 3HG2 ILE 81 12.086 -0.773 1.291 660 HD11 ILE 81 3HD1 ILE 81 14.298 -2.250 0.166 661 HD12 ILE 81 1HD1 ILE 81 15.386 -1.012 -0.461 662 HD13 ILE 81 2HD1 ILE 81 14.427 -0.694 0.986 663 H ASP 82 H ASP 82 12.428 3.664 -1.035 664 HA ASP 82 HA ASP 82 10.546 4.462 0.948 665 HB2 ASP 82 2HB ASP 82 12.769 5.516 0.705 666 HB3 ASP 82 3HB ASP 82 12.272 6.179 -0.850 667 H GLU 83 H GLU 83 10.847 5.126 -2.533 668 HA GLU 83 HA GLU 83 8.580 6.757 -2.768 669 HB2 GLU 83 2HB GLU 83 10.040 5.014 -4.744 670 HB3 GLU 83 3HB GLU 83 8.645 5.979 -5.208 671 HG2 GLU 83 2HG GLU 83 9.761 8.001 -4.739 672 HG3 GLU 83 3HG GLU 83 11.065 7.171 -3.891 673 H PHE 84 H PHE 84 8.941 3.281 -3.470 674 HA PHE 84 HA PHE 84 6.176 2.871 -3.965 675 HB2 PHE 84 2HB PHE 84 8.484 1.015 -3.427 676 HB3 PHE 84 3HB PHE 84 6.843 0.408 -3.622 677 HD1 PHE 84 HD1 PHE 84 9.144 2.785 -5.356 678 HD2 PHE 84 HD2 PHE 84 6.294 -0.356 -5.705 679 HE1 PHE 84 HE1 PHE 84 9.437 2.795 -7.798 680 HE2 PHE 84 HE2 PHE 84 6.583 -0.352 -8.148 681 HZ PHE 84 HZ PHE 84 8.157 1.225 -9.198 682 H LYS 85 H LYS 85 7.900 3.365 -1.122 683 HA LYS 85 HA LYS 85 7.388 3.209 1.089 684 HB2 LYS 85 2HB LYS 85 4.601 2.999 -0.059 685 HB3 LYS 85 3HB LYS 85 4.938 3.166 1.659 686 HG2 LYS 85 2HG LYS 85 6.058 5.160 -0.254 687 HG3 LYS 85 3HG LYS 85 4.360 5.256 0.220 688 HD2 LYS 85 2HD LYS 85 5.294 5.060 2.637 689 HD3 LYS 85 3HD LYS 85 6.819 5.557 1.901 690 HE2 LYS 85 2HE LYS 85 5.635 7.533 0.949 691 HE3 LYS 85 3HE LYS 85 4.204 7.058 1.864 692 HZ1 LYS 85 3HZ LYS 85 5.875 8.776 2.836 693 HZ2 LYS 85 1HZ LYS 85 6.753 7.400 3.281 694 HZ3 LYS 85 2HZ LYS 85 5.174 7.614 3.846 695 H ILE 86 H ILE 86 8.462 0.952 0.298 696 HA ILE 86 HA ILE 86 6.760 -1.327 0.772 697 HB ILE 86 HB ILE 86 9.771 -1.332 0.630 698 HG12 ILE 86 2HG1 ILE 86 7.790 -1.548 -1.648 699 HG13 ILE 86 3HG1 ILE 86 8.846 -0.174 -1.340 700 HG21 ILE 86 1HG2 ILE 86 8.384 -3.352 1.423 701 HG22 ILE 86 2HG2 ILE 86 7.909 -3.500 -0.268 702 HG23 ILE 86 3HG2 ILE 86 9.611 -3.610 0.183 703 HD11 ILE 86 3HD1 ILE 86 9.635 -1.693 -3.132 704 HD12 ILE 86 1HD1 ILE 86 10.787 -1.479 -1.814 705 HD13 ILE 86 2HD1 ILE 86 9.827 -2.956 -1.916 706 HA PRO 87 HA PRO 87 7.248 -1.335 5.172 707 HB2 PRO 87 2HB PRO 87 6.245 -3.818 5.617 708 HB3 PRO 87 3HB PRO 87 5.227 -2.426 5.229 709 HG2 PRO 87 2HG PRO 87 6.208 -4.613 3.436 710 HG3 PRO 87 3HG PRO 87 4.598 -3.876 3.523 711 HD2 PRO 87 2HD PRO 87 6.405 -3.204 1.623 712 HD3 PRO 87 3HD PRO 87 5.229 -2.045 2.275 713 H THR 88 H THR 88 8.436 -2.444 6.815 714 HA THR 88 HA THR 88 10.786 -3.813 5.761 715 HB THR 88 HB THR 88 10.669 -3.345 8.660 716 HG1 THR 88 HG1 THR 88 9.576 -1.481 8.069 717 HG21 THR 88 3HG2 THR 88 12.877 -2.192 8.033 718 HG22 THR 88 1HG2 THR 88 12.599 -2.832 6.415 719 HG23 THR 88 2HG2 THR 88 12.762 -3.933 7.783 720 H VAL 89 H VAL 89 11.706 -5.583 7.221 721 HA VAL 89 HA VAL 89 10.088 -7.817 7.163 722 HB VAL 89 HB VAL 89 12.432 -7.324 9.004 723 HG11 VAL 89 1HG1 VAL 89 12.188 -10.041 8.233 724 HG12 VAL 89 2HG1 VAL 89 12.070 -9.343 9.849 725 HG13 VAL 89 3HG1 VAL 89 10.624 -9.512 8.852 726 HG21 VAL 89 3HG2 VAL 89 13.616 -8.688 7.201 727 HG22 VAL 89 1HG2 VAL 89 12.220 -8.334 6.183 728 HG23 VAL 89 2HG2 VAL 89 13.212 -7.017 6.809 729 H GLU 90 H GLU 90 11.011 -5.994 10.091 730 HA GLU 90 HA GLU 90 9.441 -7.331 11.920 731 HB2 GLU 90 2HB GLU 90 10.283 -4.440 11.795 732 HB3 GLU 90 3HB GLU 90 9.400 -5.101 13.164 733 HG2 GLU 90 2HG GLU 90 11.183 -6.671 13.603 734 HG3 GLU 90 3HG GLU 90 12.056 -6.114 12.176 735 H GLN 91 H GLN 91 8.557 -4.424 10.061 736 HA GLN 91 HA GLN 91 5.957 -4.147 11.019 737 HB2 GLN 91 2HB GLN 91 6.831 -3.505 8.203 738 HB3 GLN 91 3HB GLN 91 5.541 -2.744 9.124 739 HG2 GLN 91 2HG GLN 91 8.501 -2.452 9.447 740 HG3 GLN 91 3HG GLN 91 7.285 -1.205 9.178 741 HE21 GLN 91 1HE2 GLN 91 9.260 -2.567 11.423 742 HE22 GLN 91 2HE2 GLN 91 8.442 -2.078 12.864 743 H TRP 92 H TRP 92 7.223 -6.127 8.393 744 HA TRP 92 HA TRP 92 4.723 -6.952 7.360 745 HB2 TRP 92 2HB TRP 92 6.854 -7.152 6.117 746 HB3 TRP 92 3HB TRP 92 7.379 -8.397 7.247 747 HD1 TRP 92 HD1 TRP 92 4.104 -7.967 5.185 748 HE1 TRP 92 HE1 TRP 92 3.636 -10.197 3.988 749 HE3 TRP 92 HE3 TRP 92 8.177 -10.615 6.779 750 HZ2 TRP 92 HZ2 TRP 92 4.834 -12.742 3.752 751 HZ3 TRP 92 HZ3 TRP 92 8.441 -12.941 6.022 752 HH2 TRP 92 HH2 TRP 92 6.803 -13.981 4.540 753 H LYS 93 H LYS 93 6.911 -8.367 9.760 754 HA LYS 93 HA LYS 93 5.504 -10.760 10.176 755 HB2 LYS 93 2HB LYS 93 7.198 -9.202 12.138 756 HB3 LYS 93 3HB LYS 93 6.721 -10.886 12.310 757 HG2 LYS 93 2HG LYS 93 8.248 -9.979 9.905 758 HG3 LYS 93 3HG LYS 93 9.076 -10.331 11.424 759 HD2 LYS 93 2HD LYS 93 9.155 -12.433 10.626 760 HD3 LYS 93 3HD LYS 93 7.479 -12.515 11.176 761 HE2 LYS 93 2HE LYS 93 7.076 -11.448 8.762 762 HE3 LYS 93 3HE LYS 93 8.578 -12.309 8.431 763 HZ1 LYS 93 3HZ LYS 93 7.009 -14.085 9.824 764 HZ2 LYS 93 1HZ LYS 93 7.341 -14.113 8.165 765 HZ3 LYS 93 2HZ LYS 93 5.949 -13.341 8.736 766 H ASP 94 H ASP 94 5.328 -7.648 11.886 767 HA ASP 94 HA ASP 94 3.344 -8.433 13.731 768 HB2 ASP 94 2HB ASP 94 4.882 -6.372 13.797 769 HB3 ASP 94 3HB ASP 94 3.698 -5.612 12.737 770 H GLN 95 H GLN 95 3.171 -6.961 10.527 771 HA GLN 95 HA GLN 95 0.432 -6.382 10.497 772 HB2 GLN 95 2HB GLN 95 2.444 -6.949 8.340 773 HB3 GLN 95 3HB GLN 95 0.750 -6.696 7.942 774 HG2 GLN 95 2HG GLN 95 0.806 -4.484 8.472 775 HG3 GLN 95 3HG GLN 95 2.083 -4.689 9.670 776 HE21 GLN 95 1HE2 GLN 95 3.010 -2.801 8.644 777 HE22 GLN 95 2HE2 GLN 95 3.970 -2.996 7.221 778 H THR 96 H THR 96 2.170 -9.270 9.360 779 HA THR 96 HA THR 96 -0.136 -10.679 8.534 780 HB THR 96 HB THR 96 1.518 -12.713 8.998 781 HG1 THR 96 HG1 THR 96 3.707 -11.823 8.671 782 HG21 THR 96 3HG2 THR 96 1.746 -10.649 6.814 783 HG22 THR 96 1HG2 THR 96 0.828 -12.154 6.788 784 HG23 THR 96 2HG2 THR 96 2.592 -12.196 6.773 785 H ARG 97 H ARG 97 1.696 -10.652 11.563 786 HA ARG 97 HA ARG 97 0.365 -12.747 12.852 787 HB2 ARG 97 2HB ARG 97 1.964 -10.397 13.739 788 HB3 ARG 97 3HB ARG 97 1.008 -11.238 14.951 789 HG2 ARG 97 2HG ARG 97 2.843 -12.755 13.144 790 HG3 ARG 97 3HG ARG 97 3.460 -11.934 14.579 791 HD2 ARG 97 2HD ARG 97 1.710 -13.169 15.901 792 HD3 ARG 97 3HD ARG 97 1.387 -14.113 14.448 793 HE ARG 97 HE ARG 97 4.138 -14.198 15.017 794 HH11 ARG 97 1HH1 ARG 97 1.098 -15.368 16.245 795 HH12 ARG 97 2HH1 ARG 97 1.786 -16.786 16.965 796 HH21 ARG 97 1HH2 ARG 97 5.056 -16.061 15.960 797 HH22 ARG 97 2HH2 ARG 97 4.038 -17.178 16.804 798 H ARG 98 H ARG 98 -0.293 -9.252 12.902 799 HA ARG 98 HA ARG 98 -2.603 -9.497 14.554 800 HB2 ARG 98 2HB ARG 98 -2.922 -7.163 14.192 801 HB3 ARG 98 3HB ARG 98 -1.187 -7.428 14.306 802 HG2 ARG 98 2HG ARG 98 -0.965 -7.286 11.908 803 HG3 ARG 98 3HG ARG 98 -2.715 -7.149 11.728 804 HD2 ARG 98 2HD ARG 98 -2.139 -4.942 11.621 805 HD3 ARG 98 3HD ARG 98 -2.376 -5.107 13.360 806 HE ARG 98 HE ARG 98 0.319 -5.636 12.610 807 HH11 ARG 98 1HH1 ARG 98 -1.966 -3.073 13.185 808 HH12 ARG 98 2HH1 ARG 98 -0.753 -1.911 13.612 809 HH21 ARG 98 1HH2 ARG 98 1.924 -4.116 13.171 810 HH22 ARG 98 2HH2 ARG 98 1.459 -2.506 13.603 811 H TYR 99 H TYR 99 -2.021 -9.499 11.105 812 HA TYR 99 HA TYR 99 -4.703 -9.106 10.282 813 HB2 TYR 99 2HB TYR 99 -2.945 -8.722 8.698 814 HB3 TYR 99 3HB TYR 99 -2.328 -10.358 8.896 815 HD1 TYR 99 HD2 TYR 99 -5.692 -8.888 8.162 816 HD2 TYR 99 HD1 TYR 99 -2.657 -11.640 7.015 817 HE1 TYR 99 HE2 TYR 99 -7.090 -9.636 6.282 818 HE2 TYR 99 HE1 TYR 99 -4.046 -12.395 5.130 819 HH TYR 99 HH TYR 99 -6.674 -10.725 4.000 820 H LYS 100 H LYS 100 -2.836 -11.934 11.176 821 HA LYS 100 HA LYS 100 -4.751 -13.843 10.249 822 HB2 LYS 100 2HB LYS 100 -2.281 -13.940 11.930 823 HB3 LYS 100 3HB LYS 100 -3.377 -15.316 11.956 824 HG2 LYS 100 2HG LYS 100 -2.493 -14.233 9.328 825 HG3 LYS 100 3HG LYS 100 -1.374 -15.216 10.275 826 HD2 LYS 100 2HD LYS 100 -4.175 -16.150 9.764 827 HD3 LYS 100 3HD LYS 100 -2.914 -16.378 8.550 828 HE2 LYS 100 2HE LYS 100 -1.547 -17.433 10.435 829 HE3 LYS 100 3HE LYS 100 -3.061 -17.491 11.336 830 HZ1 LYS 100 3HZ LYS 100 -3.959 -18.671 9.270 831 HZ2 LYS 100 1HZ LYS 100 -2.945 -19.547 10.303 832 HZ3 LYS 100 2HZ LYS 100 -2.337 -18.916 8.856 833 H GLU 101 H GLU 101 -4.344 -11.971 13.133 834 HA GLU 101 HA GLU 101 -5.819 -13.556 14.931 835 HB2 GLU 101 2HB GLU 101 -5.180 -10.622 14.804 836 HB3 GLU 101 3HB GLU 101 -6.226 -11.264 16.063 837 HG2 GLU 101 2HG GLU 101 -3.548 -12.489 15.588 838 HG3 GLU 101 3HG GLU 101 -3.686 -10.986 16.499 839 H SER 102 H SER 102 -7.905 -12.435 15.959 840 HA SER 102 HA SER 102 -9.894 -12.544 13.849 841 HB2 SER 102 2HB SER 102 -10.044 -12.554 16.860 842 HB3 SER 102 3HB SER 102 -11.488 -12.399 15.859 843 HG SER 102 HG SER 102 -11.405 -14.463 15.539 844 H SER 103 H SER 103 -10.675 -10.800 12.889 845 HA SER 103 HA SER 103 -11.381 -8.435 14.326 846 HB2 SER 103 2HB SER 103 -9.875 -6.900 13.041 847 HB3 SER 103 3HB SER 103 -9.021 -7.943 14.178 848 HG SER 103 HG SER 103 -8.430 -7.679 11.708 849 H ILE 104 H ILE 104 -11.698 -6.596 12.435 850 HA ILE 104 HA ILE 104 -13.847 -7.592 10.884 851 HB ILE 104 HB ILE 104 -12.428 -4.970 10.438 852 HG12 ILE 104 2HG1 ILE 104 -12.916 -5.125 12.804 853 HG13 ILE 104 3HG1 ILE 104 -14.068 -4.024 12.058 854 HG21 ILE 104 1HG2 ILE 104 -14.933 -4.372 9.968 855 HG22 ILE 104 2HG2 ILE 104 -13.953 -5.160 8.732 856 HG23 ILE 104 3HG2 ILE 104 -15.081 -6.109 9.699 857 HD11 ILE 104 3HD1 ILE 104 -15.621 -5.192 13.132 858 HD12 ILE 104 1HD1 ILE 104 -15.356 -6.438 11.913 859 HD13 ILE 104 2HD1 ILE 104 -14.514 -6.526 13.461 860 H GLN 105 H GLN 105 -14.058 -7.754 8.624 861 HA GLN 105 HA GLN 105 -11.956 -7.339 6.795 862 HB2 GLN 105 2HB GLN 105 -11.446 -9.720 6.273 863 HB3 GLN 105 3HB GLN 105 -10.865 -9.205 7.851 864 HG2 GLN 105 2HG GLN 105 -12.782 -10.281 8.911 865 HG3 GLN 105 3HG GLN 105 -13.367 -10.796 7.330 866 HE21 GLN 105 1HE2 GLN 105 -10.825 -11.176 9.704 867 HE22 GLN 105 2HE2 GLN 105 -10.270 -12.714 9.147 868 H ILE 106 H ILE 106 -12.435 -8.855 4.730 869 HA ILE 106 HA ILE 106 -15.357 -8.910 4.368 870 HB ILE 106 HB ILE 106 -13.404 -8.056 2.234 871 HG12 ILE 106 2HG1 ILE 106 -13.370 -6.394 4.010 872 HG13 ILE 106 3HG1 ILE 106 -14.253 -5.760 2.625 873 HG21 ILE 106 1HG2 ILE 106 -15.462 -7.231 1.127 874 HG22 ILE 106 2HG2 ILE 106 -15.442 -8.980 1.349 875 HG23 ILE 106 3HG2 ILE 106 -16.411 -7.966 2.419 876 HD11 ILE 106 3HD1 ILE 106 -15.132 -6.204 5.345 877 HD12 ILE 106 1HD1 ILE 106 -15.845 -5.217 4.069 878 HD13 ILE 106 2HD1 ILE 106 -16.214 -6.940 4.162 879 H GLY 107 H GLY 107 -16.130 -10.779 3.625 880 HA2 GLY 107 2HA GLY 107 -14.381 -12.967 3.077 881 HA3 GLY 107 3HA GLY 107 -16.134 -12.979 2.944 882 H ASN 108 H ASN 108 -16.252 -10.769 1.071 883 HA ASN 108 HA ASN 108 -16.142 -12.188 -1.337 884 HB2 ASN 108 2HB ASN 108 -16.290 -9.229 -0.758 885 HB3 ASN 108 3HB ASN 108 -16.368 -9.881 -2.392 886 HD21 ASN 108 1HD2 ASN 108 -18.267 -10.542 -3.147 887 HD22 ASN 108 2HD2 ASN 108 -19.709 -10.712 -2.210 888 H GLY 109 H GLY 109 -14.669 -12.321 -2.976 889 HA2 GLY 109 2HA GLY 109 -12.683 -11.083 -3.983 890 HA3 GLY 109 3HA GLY 109 -11.993 -11.233 -2.374 891 H HIS 110 H HIS 110 -11.781 -12.465 -5.345 892 HA HIS 110 HA HIS 110 -10.785 -15.027 -4.339 893 HB2 HIS 110 2HB HIS 110 -13.155 -15.179 -5.377 894 HB3 HIS 110 3HB HIS 110 -12.331 -14.941 -6.916 895 HD1 HIS 110 HD1 HIS 110 -13.647 -17.572 -5.083 896 HD2 HIS 110 HD2 HIS 110 -9.954 -16.977 -6.890 897 HE1 HIS 110 HE1 HIS 110 -12.681 -19.871 -5.411 898 H GLY 111 H GLY 111 -8.869 -15.608 -5.192 899 HA2 GLY 111 2HA GLY 111 -7.966 -14.201 -7.624 900 HA3 GLY 111 3HA GLY 111 -6.935 -14.306 -6.205 901 H GLN 112 H GLN 112 -6.344 -15.258 -8.855 902 HA GLN 112 HA GLN 112 -5.678 -18.001 -8.158 903 HB2 GLN 112 2HB GLN 112 -7.384 -17.231 -10.509 904 HB3 GLN 112 3HB GLN 112 -6.387 -18.679 -10.551 905 HG2 GLN 112 2HG GLN 112 -7.547 -19.586 -8.643 906 HG3 GLN 112 3HG GLN 112 -8.484 -18.102 -8.472 907 HE21 GLN 112 1HE2 GLN 112 -9.365 -20.859 -8.898 908 HE22 GLN 112 2HE2 GLN 112 -10.322 -20.834 -10.336 909 H SER 113 H SER 113 -4.252 -18.969 -9.959 910 HA SER 113 HA SER 113 -2.357 -16.877 -10.785 911 HB2 SER 113 2HB SER 113 -1.944 -19.826 -10.250 912 HB3 SER 113 3HB SER 113 -0.699 -18.759 -10.897 913 HG SER 113 HG SER 113 -0.376 -18.727 -8.742 914 H GLN 114 H GLN 114 -1.562 -16.799 -12.868 915 HA GLN 114 HA GLN 114 -3.288 -17.651 -14.930 916 HB2 GLN 114 2HB GLN 114 -0.507 -16.496 -14.934 917 HB3 GLN 114 3HB GLN 114 -1.336 -16.928 -16.424 918 HG2 GLN 114 2HG GLN 114 -2.404 -14.994 -14.381 919 HG3 GLN 114 3HG GLN 114 -1.511 -14.533 -15.829 920 HE21 GLN 114 1HE2 GLN 114 -4.212 -13.834 -15.059 921 HE22 GLN 114 2HE2 GLN 114 -5.246 -14.408 -16.319 922 H GLY 115 H GLY 115 -2.187 -18.767 -16.957 923 HA2 GLY 115 2HA GLY 115 -0.279 -20.802 -16.515 924 HA3 GLY 115 3HA GLY 115 -1.893 -21.473 -16.334 925 H LEU 116 H LEU 116 0.561 -20.724 -18.501 926 HA LEU 116 HA LEU 116 -1.247 -21.237 -20.764 927 HB2 LEU 116 2HB LEU 116 1.139 -19.404 -20.873 928 HB3 LEU 116 3HB LEU 116 -0.041 -19.698 -22.147 929 HG LEU 116 HG LEU 116 -0.692 -18.357 -19.527 930 HD11 LEU 116 1HD1 LEU 116 -0.865 -16.342 -21.187 931 HD12 LEU 116 2HD1 LEU 116 0.308 -17.274 -22.117 932 HD13 LEU 116 3HD1 LEU 116 0.684 -16.780 -20.466 933 HD21 LEU 116 3HD2 LEU 116 -2.212 -19.093 -21.962 934 HD22 LEU 116 1HD2 LEU 116 -2.573 -17.535 -21.217 935 HD23 LEU 116 2HD2 LEU 116 -2.731 -19.020 -20.278 936 H GLU 117 H GLU 117 -0.109 -22.107 -22.685 937 HA GLU 117 HA GLU 117 1.109 -23.792 -23.617 938 HB2 GLU 117 2HB GLU 117 2.823 -21.902 -23.212 939 HB3 GLU 117 3HB GLU 117 3.408 -22.907 -21.893 940 HG2 GLU 117 2HG GLU 117 3.694 -24.756 -23.571 941 HG3 GLU 117 3HG GLU 117 3.364 -23.560 -24.824 942 H1 GLY -9 H GLY -9 9.876 -13.883 15.076 943 HA2 GLY -9 2HA GLY -9 8.134 -13.620 12.703 944 HA3 GLY -9 3HA GLY -9 9.557 -12.628 12.985 945 H LYS -8 H LYS -8 11.365 -14.593 13.792 946 HA LYS -8 HA LYS -8 12.853 -16.101 12.965 947 HB2 LYS -8 2HB LYS -8 10.694 -17.488 12.890 948 HB3 LYS -8 3HB LYS -8 10.673 -17.142 11.166 949 HG2 LYS -8 2HG LYS -8 13.161 -18.048 11.344 950 HG3 LYS -8 3HG LYS -8 12.474 -18.895 12.732 951 HD2 LYS -8 2HD LYS -8 12.004 -20.427 11.114 952 HD3 LYS -8 3HD LYS -8 10.558 -19.425 10.967 953 HE2 LYS -8 2HE LYS -8 12.930 -18.646 9.367 954 HE3 LYS -8 3HE LYS -8 12.063 -20.099 8.872 955 HZ1 LYS -8 3HZ LYS -8 11.219 -17.315 8.788 956 HZ2 LYS -8 1HZ LYS -8 10.030 -18.443 9.209 957 HZ3 LYS -8 2HZ LYS -8 10.853 -18.590 7.739 958 H PHE -7 H PHE -7 12.344 -13.500 11.640 959 HA PHE -7 HA PHE -7 13.710 -14.119 9.121 960 HB2 PHE -7 2HB PHE -7 11.224 -12.471 9.469 961 HB3 PHE -7 3HB PHE -7 12.344 -12.123 8.156 962 HD1 PHE -7 HD1 PHE -7 12.967 -14.101 6.618 963 HD2 PHE -7 HD2 PHE -7 9.576 -14.065 9.189 964 HE1 PHE -7 HE1 PHE -7 11.920 -15.862 5.256 965 HE2 PHE -7 HE2 PHE -7 8.524 -15.827 7.832 966 HZ PHE -7 HZ PHE -7 9.696 -16.728 5.862 967 H ILE -6 H ILE -6 15.243 -13.451 11.101 968 HA ILE -6 HA ILE -6 15.671 -10.542 10.937 969 HB ILE -6 HB ILE -6 16.815 -12.398 13.020 970 HG12 ILE -6 2HG1 ILE -6 14.401 -12.449 13.233 971 HG13 ILE -6 3HG1 ILE -6 15.073 -11.470 14.532 972 HG21 ILE -6 1HG2 ILE -6 17.333 -10.390 14.230 973 HG22 ILE -6 2HG2 ILE -6 17.986 -10.250 12.599 974 HG23 ILE -6 3HG2 ILE -6 16.501 -9.401 13.030 975 HD11 ILE -6 3HD1 ILE -6 13.165 -10.767 12.507 976 HD12 ILE -6 1HD1 ILE -6 13.644 -9.885 13.957 977 HD13 ILE -6 2HD1 ILE -6 14.554 -9.682 12.460 978 HA PRO -5 HA PRO -5 19.109 -12.372 8.469 979 HB2 PRO -5 2HB PRO -5 19.161 -10.355 6.652 980 HB3 PRO -5 3HB PRO -5 18.071 -11.741 6.519 981 HG2 PRO -5 2HG PRO -5 17.516 -8.986 7.552 982 HG3 PRO -5 3HG PRO -5 16.524 -10.004 6.491 983 HD2 PRO -5 2HD PRO -5 16.032 -9.749 9.142 984 HD3 PRO -5 3HD PRO -5 15.695 -11.246 8.248 985 H SER -4 H SER -4 20.255 -11.776 10.518 986 HA SER -4 HA SER -4 21.357 -9.110 10.683 987 HB2 SER -4 2HB SER -4 21.726 -11.621 12.314 988 HB3 SER -4 3HB SER -4 22.688 -10.170 12.600 989 HG SER -4 HG SER -4 21.059 -9.551 13.763 990 H ARG -3 H ARG -3 22.009 -11.625 8.725 991 HA ARG -3 HA ARG -3 24.829 -11.856 8.872 992 HB2 ARG -3 2HB ARG -3 22.687 -12.800 7.134 993 HB3 ARG -3 3HB ARG -3 24.151 -12.412 6.240 994 HG2 ARG -3 2HG ARG -3 24.387 -14.663 6.764 995 HG3 ARG -3 3HG ARG -3 25.368 -13.841 7.980 996 HD2 ARG -3 2HD ARG -3 24.028 -15.601 8.995 997 HD3 ARG -3 3HD ARG -3 23.525 -14.015 9.579 998 HE ARG -3 HE ARG -3 21.916 -14.664 7.400 999 HH11 ARG -3 1HH1 ARG -3 22.538 -15.806 10.630 1000 HH12 ARG -3 2HH1 ARG -3 20.940 -16.434 10.856 1001 HH21 ARG -3 1HH2 ARG -3 19.807 -15.487 7.686 1002 HH22 ARG -3 2HH2 ARG -3 19.387 -16.253 9.181 1003 HA PRO -2 HA PRO -2 26.343 -8.325 6.757 1004 HB2 PRO -2 2HB PRO -2 28.303 -9.355 5.185 1005 HB3 PRO -2 3HB PRO -2 28.450 -9.223 6.942 1006 HG2 PRO -2 2HG PRO -2 27.725 -11.602 5.275 1007 HG3 PRO -2 3HG PRO -2 28.808 -11.505 6.675 1008 HD2 PRO -2 2HD PRO -2 26.267 -12.421 6.861 1009 HD3 PRO -2 3HD PRO -2 27.067 -11.551 8.185 1010 H ALA -1 H ALA -1 26.468 -7.214 4.734 1011 HA ALA -1 HA ALA -1 24.604 -8.273 2.761 1012 HB1 ALA -1 1HB ALA -1 25.823 -5.543 3.126 1013 HB2 ALA -1 2HB ALA -1 24.740 -5.970 1.800 1014 HB3 ALA -1 3HB ALA -1 24.163 -6.036 3.465 1015 HA PRO 0 HA PRO 0 28.147 -9.574 0.334 1016 HB2 PRO 0 2HB PRO 0 26.679 -10.837 -1.569 1017 HB3 PRO 0 3HB PRO 0 27.028 -11.554 0.008 1018 HG2 PRO 0 2HG PRO 0 24.554 -10.153 -0.930 1019 HG3 PRO 0 3HG PRO 0 24.704 -11.637 0.030 1020 HD2 PRO 0 2HD PRO 0 24.143 -9.232 1.142 1021 HD3 PRO 0 3HD PRO 0 25.079 -10.481 1.989 1022 H LYS 1 H LYS 1 29.075 -8.904 -1.591 1023 HA LYS 1 HA LYS 1 27.729 -6.652 -2.899 1024 HB2 LYS 1 2HB LYS 1 30.566 -7.422 -2.446 1025 HB3 LYS 1 3HB LYS 1 30.199 -6.529 -3.916 1026 HG2 LYS 1 2HG LYS 1 29.414 -4.668 -2.718 1027 HG3 LYS 1 3HG LYS 1 29.312 -5.581 -1.211 1028 HD2 LYS 1 2HD LYS 1 31.917 -5.115 -2.642 1029 HD3 LYS 1 3HD LYS 1 31.274 -3.978 -1.455 1030 HE2 LYS 1 2HE LYS 1 31.575 -5.431 0.299 1031 HE3 LYS 1 3HE LYS 1 31.464 -6.860 -0.726 1032 HZ1 LYS 1 3HZ LYS 1 33.732 -5.065 -1.146 1033 HZ2 LYS 1 1HZ LYS 1 33.647 -6.750 -1.279 1034 HZ3 LYS 1 2HZ LYS 1 33.747 -6.027 0.246 1035 HA PRO 2 HA PRO 2 27.149 -8.703 -6.734 1036 HB2 PRO 2 2HB PRO 2 27.809 -6.786 -8.539 1037 HB3 PRO 2 3HB PRO 2 26.334 -6.723 -7.567 1038 HG2 PRO 2 2HG PRO 2 28.943 -5.318 -7.142 1039 HG3 PRO 2 3HG PRO 2 27.293 -4.688 -6.979 1040 HD2 PRO 2 2HD PRO 2 28.779 -5.450 -4.847 1041 HD3 PRO 2 3HD PRO 2 27.012 -5.614 -4.887 1042 HA PRO 3 HA PRO 3 30.848 -10.391 -8.409 1043 HB2 PRO 3 2HB PRO 3 30.231 -10.720 -11.032 1044 HB3 PRO 3 3HB PRO 3 29.536 -11.719 -9.749 1045 HG2 PRO 3 2HG PRO 3 28.356 -9.356 -11.159 1046 HG3 PRO 3 3HG PRO 3 27.590 -10.893 -10.719 1047 HD2 PRO 3 2HD PRO 3 27.249 -8.630 -9.273 1048 HD3 PRO 3 3HD PRO 3 27.251 -10.243 -8.533 1049 H SER 4 H SER 4 32.168 -8.502 -8.065 1050 HA SER 4 HA SER 4 33.181 -7.419 -10.550 1051 HB2 SER 4 2HB SER 4 33.068 -5.054 -9.668 1052 HB3 SER 4 3HB SER 4 31.513 -5.752 -10.117 1053 HG SER 4 HG SER 4 30.929 -5.831 -8.059 1054 H SER 5 H SER 5 35.230 -6.311 -10.282 1055 HA SER 5 HA SER 5 36.790 -7.513 -8.164 1056 HB2 SER 5 2HB SER 5 37.621 -5.718 -10.457 1057 HB3 SER 5 3HB SER 5 38.727 -6.543 -9.359 1058 HG SER 5 HG SER 5 38.455 -7.753 -11.248 1059 H ALA 6 H ALA 6 36.385 -6.517 -6.247 1060 HA ALA 6 HA ALA 6 36.264 -3.645 -6.025 1061 HB1 ALA 6 1HB ALA 6 34.965 -5.346 -4.622 1062 HB2 ALA 6 2HB ALA 6 36.464 -5.547 -3.714 1063 HB3 ALA 6 3HB ALA 6 35.681 -3.969 -3.785 Start of MODEL 2 1 H1 MET -2 H MET -2 3.921 5.776 -1.810 2 HA MET -2 HA MET -2 6.709 5.357 -2.476 3 HB2 MET -2 2HB MET -2 6.748 3.010 -1.853 4 HB3 MET -2 3HB MET -2 6.404 3.996 -0.439 5 HG2 MET -2 2HG MET -2 4.270 3.226 -0.244 6 HG3 MET -2 3HG MET -2 4.109 2.908 -1.969 7 HE1 MET -2 3HE MET -2 6.839 0.161 -2.201 8 HE2 MET -2 1HE MET -2 5.240 -0.051 -2.915 9 HE3 MET -2 2HE MET -2 6.035 1.522 -2.984 10 H ALA -1 H ALA -1 6.949 3.662 -4.184 11 HA ALA -1 HA ALA -1 4.497 3.337 -5.776 12 HB1 ALA -1 1HB ALA -1 5.440 5.064 -6.964 13 HB2 ALA -1 2HB ALA -1 7.091 4.554 -6.607 14 HB3 ALA -1 3HB ALA -1 6.130 3.666 -7.789 15 HA PRO 1 HA PRO 1 5.696 -0.852 -6.313 16 HB2 PRO 1 2HB PRO 1 4.770 -1.366 -8.813 17 HB3 PRO 1 3HB PRO 1 3.705 -1.162 -7.417 18 HG2 PRO 1 2HG PRO 1 4.430 0.809 -9.551 19 HG3 PRO 1 3HG PRO 1 2.846 0.477 -8.825 20 HD2 PRO 1 2HD PRO 1 4.369 2.593 -8.094 21 HD3 PRO 1 3HD PRO 1 3.294 1.753 -6.958 22 H LEU 2 H LEU 2 8.013 -0.104 -6.339 23 HA LEU 2 HA LEU 2 9.340 0.245 -8.842 24 HB2 LEU 2 2HB LEU 2 11.352 0.293 -7.602 25 HB3 LEU 2 3HB LEU 2 10.132 1.117 -6.633 26 HG LEU 2 HG LEU 2 10.649 -1.766 -6.099 27 HD11 LEU 2 1HD1 LEU 2 12.892 -0.897 -6.249 28 HD12 LEU 2 2HD1 LEU 2 12.473 -1.146 -4.554 29 HD13 LEU 2 3HD1 LEU 2 12.463 0.481 -5.235 30 HD21 LEU 2 3HD2 LEU 2 10.332 -0.817 -3.739 31 HD22 LEU 2 1HD2 LEU 2 8.927 -0.865 -4.804 32 HD23 LEU 2 2HD2 LEU 2 9.787 0.654 -4.547 33 H PHE 3 H PHE 3 10.622 -1.190 -9.984 34 HA PHE 3 HA PHE 3 10.248 -4.029 -9.293 35 HB2 PHE 3 2HB PHE 3 10.472 -2.701 -11.999 36 HB3 PHE 3 3HB PHE 3 10.530 -4.445 -11.762 37 HD1 PHE 3 HD2 PHE 3 8.395 -1.457 -11.278 38 HD2 PHE 3 HD1 PHE 3 8.567 -5.699 -11.587 39 HE1 PHE 3 HE2 PHE 3 5.939 -1.546 -11.372 40 HE2 PHE 3 HE1 PHE 3 6.110 -5.795 -11.683 41 HZ PHE 3 HZ PHE 3 4.793 -3.717 -11.573 42 H ALA 4 H ALA 4 11.978 -5.481 -9.768 43 HA ALA 4 HA ALA 4 14.605 -4.194 -10.095 44 HB1 ALA 4 1HB ALA 4 13.809 -6.252 -8.050 45 HB2 ALA 4 2HB ALA 4 15.488 -5.901 -8.463 46 HB3 ALA 4 3HB ALA 4 14.468 -4.639 -7.774 47 H VAL 5 H VAL 5 16.249 -5.510 -11.019 48 HA VAL 5 HA VAL 5 15.218 -7.864 -12.467 49 HB VAL 5 HB VAL 5 15.578 -6.072 -14.046 50 HG11 VAL 5 1HG1 VAL 5 17.627 -4.894 -14.299 51 HG12 VAL 5 2HG1 VAL 5 17.210 -4.836 -12.585 52 HG13 VAL 5 3HG1 VAL 5 18.451 -5.952 -13.154 53 HG21 VAL 5 3HG2 VAL 5 16.717 -8.586 -14.211 54 HG22 VAL 5 1HG2 VAL 5 16.450 -7.470 -15.550 55 HG23 VAL 5 2HG2 VAL 5 18.010 -7.505 -14.729 56 H THR 6 H THR 6 16.238 -9.711 -12.076 57 HA THR 6 HA THR 6 18.408 -9.879 -10.268 58 HB THR 6 HB THR 6 18.402 -12.319 -11.534 59 HG1 THR 6 HG1 THR 6 16.667 -12.289 -12.760 60 HG21 THR 6 3HG2 THR 6 16.379 -12.526 -9.649 61 HG22 THR 6 1HG2 THR 6 17.332 -11.147 -9.101 62 HG23 THR 6 2HG2 THR 6 18.108 -12.712 -9.352 63 H LEU 7 H LEU 7 20.549 -9.917 -10.585 64 HA LEU 7 HA LEU 7 21.520 -9.750 -13.349 65 HB2 LEU 7 2HB LEU 7 22.942 -9.043 -10.787 66 HB3 LEU 7 3HB LEU 7 23.524 -8.746 -12.424 67 HG LEU 7 HG LEU 7 21.127 -7.440 -11.136 68 HD11 LEU 7 1HD1 LEU 7 23.978 -6.664 -11.449 69 HD12 LEU 7 2HD1 LEU 7 22.856 -6.349 -10.126 70 HD13 LEU 7 3HD1 LEU 7 22.746 -5.414 -11.617 71 HD21 LEU 7 3HD2 LEU 7 22.069 -6.104 -13.463 72 HD22 LEU 7 1HD2 LEU 7 20.490 -6.834 -13.171 73 HD23 LEU 7 2HD2 LEU 7 21.792 -7.799 -13.866 74 H TYR 8 H TYR 8 21.452 -11.798 -10.625 75 HA TYR 8 HA TYR 8 23.364 -13.602 -11.937 76 HB2 TYR 8 2HB TYR 8 23.238 -13.041 -8.967 77 HB3 TYR 8 3HB TYR 8 24.243 -14.270 -9.728 78 HD1 TYR 8 HD1 TYR 8 23.641 -10.600 -9.632 79 HD2 TYR 8 HD2 TYR 8 26.386 -13.734 -10.497 80 HE1 TYR 8 HE1 TYR 8 25.432 -8.941 -9.927 81 HE2 TYR 8 HE2 TYR 8 28.186 -12.083 -10.793 82 HH TYR 8 HH TYR 8 27.573 -8.605 -10.391 83 H GLU 9 H GLU 9 23.070 -15.859 -11.405 84 HA GLU 9 HA GLU 9 20.271 -16.525 -11.153 85 HB2 GLU 9 2HB GLU 9 21.586 -17.689 -12.820 86 HB3 GLU 9 3HB GLU 9 22.718 -18.240 -11.594 87 HG2 GLU 9 2HG GLU 9 21.518 -20.075 -11.348 88 HG3 GLU 9 3HG GLU 9 20.173 -19.096 -10.767 89 H PHE 10 H PHE 10 19.461 -16.475 -9.147 90 HA PHE 10 HA PHE 10 21.040 -17.308 -6.868 91 HB2 PHE 10 2HB PHE 10 19.351 -15.364 -6.926 92 HB3 PHE 10 3HB PHE 10 18.112 -16.610 -6.810 93 HD1 PHE 10 HD2 PHE 10 21.335 -15.734 -5.138 94 HD2 PHE 10 HD1 PHE 10 17.307 -17.044 -4.714 95 HE1 PHE 10 HE2 PHE 10 21.606 -15.768 -2.693 96 HE2 PHE 10 HE1 PHE 10 17.572 -17.079 -2.268 97 HZ PHE 10 HZ PHE 10 19.724 -16.442 -1.255 98 H LYS 11 H LYS 11 21.327 -19.444 -6.675 99 HA LYS 11 HA LYS 11 19.279 -21.331 -7.424 100 HB2 LYS 11 2HB LYS 11 22.040 -21.608 -6.252 101 HB3 LYS 11 3HB LYS 11 20.973 -22.991 -6.451 102 HG2 LYS 11 2HG LYS 11 21.244 -23.051 -8.687 103 HG3 LYS 11 3HG LYS 11 21.340 -21.295 -8.832 104 HD2 LYS 11 2HD LYS 11 23.618 -21.284 -8.134 105 HD3 LYS 11 3HD LYS 11 23.544 -22.983 -7.660 106 HE2 LYS 11 2HE LYS 11 24.519 -23.266 -9.684 107 HE3 LYS 11 3HE LYS 11 22.842 -23.226 -10.228 108 HZ1 LYS 11 3HZ LYS 11 23.198 -20.749 -10.503 109 HZ2 LYS 11 1HZ LYS 11 23.981 -21.753 -11.618 110 HZ3 LYS 11 2HZ LYS 11 24.853 -21.061 -10.345 111 H ALA 12 H ALA 12 17.539 -21.184 -6.083 112 HA ALA 12 HA ALA 12 17.498 -20.689 -3.366 113 HB1 ALA 12 1HB ALA 12 15.650 -21.875 -5.312 114 HB2 ALA 12 2HB ALA 12 15.371 -22.355 -3.637 115 HB3 ALA 12 3HB ALA 12 15.369 -20.647 -4.077 116 H GLU 13 H GLU 13 17.664 -21.898 -1.525 117 HA GLU 13 HA GLU 13 18.732 -24.617 -1.868 118 HB2 GLU 13 2HB GLU 13 19.601 -24.257 0.490 119 HB3 GLU 13 3HB GLU 13 20.342 -23.280 -0.770 120 HG2 GLU 13 2HG GLU 13 19.065 -21.361 -0.118 121 HG3 GLU 13 3HG GLU 13 18.135 -22.319 1.034 122 H ARG 14 H ARG 14 16.245 -22.721 -0.343 123 HA ARG 14 HA ARG 14 15.036 -25.207 0.666 124 HB2 ARG 14 2HB ARG 14 15.364 -22.572 2.071 125 HB3 ARG 14 3HB ARG 14 14.051 -23.661 2.499 126 HG2 ARG 14 2HG ARG 14 16.832 -24.720 2.413 127 HG3 ARG 14 3HG ARG 14 16.328 -23.727 3.782 128 HD2 ARG 14 2HD ARG 14 14.288 -25.309 3.878 129 HD3 ARG 14 3HD ARG 14 15.269 -26.380 2.879 130 HE ARG 14 HE ARG 14 16.892 -25.717 4.972 131 HH11 ARG 14 1HH1 ARG 14 13.725 -27.127 4.657 132 HH12 ARG 14 2HH1 ARG 14 13.857 -28.070 6.104 133 HH21 ARG 14 1HH2 ARG 14 17.079 -26.954 6.879 134 HH22 ARG 14 2HH2 ARG 14 15.766 -27.970 7.368 135 H ASP 15 H ASP 15 12.626 -24.549 1.384 136 HA ASP 15 HA ASP 15 11.260 -23.999 -1.024 137 HB2 ASP 15 2HB ASP 15 10.188 -23.991 1.806 138 HB3 ASP 15 3HB ASP 15 9.219 -24.082 0.337 139 H ASP 16 H ASP 16 12.056 -22.024 1.776 140 HA ASP 16 HA ASP 16 10.437 -19.806 1.158 141 HB2 ASP 16 2HB ASP 16 13.064 -19.906 2.659 142 HB3 ASP 16 3HB ASP 16 11.946 -18.544 2.658 143 H GLU 17 H GLU 17 13.640 -20.765 0.091 144 HA GLU 17 HA GLU 17 14.208 -18.273 -1.215 145 HB2 GLU 17 2HB GLU 17 15.525 -20.983 -1.468 146 HB3 GLU 17 3HB GLU 17 16.141 -19.495 -2.174 147 HG2 GLU 17 2HG GLU 17 15.619 -19.575 0.751 148 HG3 GLU 17 3HG GLU 17 17.043 -20.397 0.117 149 H LEU 18 H LEU 18 14.027 -17.751 -3.353 150 HA LEU 18 HA LEU 18 12.498 -19.640 -5.018 151 HB2 LEU 18 2HB LEU 18 11.466 -17.409 -4.317 152 HB3 LEU 18 3HB LEU 18 12.620 -16.667 -5.424 153 HG LEU 18 HG LEU 18 11.596 -18.181 -7.217 154 HD11 LEU 18 1HD1 LEU 18 10.270 -19.743 -6.238 155 HD12 LEU 18 2HD1 LEU 18 9.058 -18.490 -6.503 156 HD13 LEU 18 3HD1 LEU 18 9.798 -18.678 -4.913 157 HD21 LEU 18 3HD2 LEU 18 9.396 -16.537 -6.913 158 HD22 LEU 18 1HD2 LEU 18 10.894 -16.135 -7.752 159 HD23 LEU 18 2HD2 LEU 18 10.682 -15.680 -6.062 160 H ASP 19 H ASP 19 13.417 -20.378 -6.815 161 HA ASP 19 HA ASP 19 16.078 -19.614 -7.514 162 HB2 ASP 19 2HB ASP 19 15.902 -21.287 -9.265 163 HB3 ASP 19 3HB ASP 19 15.222 -21.926 -7.771 164 H VAL 20 H VAL 20 16.720 -18.061 -8.848 165 HA VAL 20 HA VAL 20 14.921 -17.158 -10.981 166 HB VAL 20 HB VAL 20 14.675 -15.623 -9.027 167 HG11 VAL 20 1HG1 VAL 20 16.422 -14.326 -8.207 168 HG12 VAL 20 2HG1 VAL 20 17.167 -15.911 -8.424 169 HG13 VAL 20 3HG1 VAL 20 17.441 -14.636 -9.612 170 HG21 VAL 20 3HG2 VAL 20 14.359 -13.863 -10.405 171 HG22 VAL 20 1HG2 VAL 20 15.998 -13.940 -11.052 172 HG23 VAL 20 2HG2 VAL 20 14.758 -15.038 -11.658 173 H SER 21 H SER 21 15.971 -16.129 -12.744 174 HA SER 21 HA SER 21 18.862 -16.688 -12.869 175 HB2 SER 21 2HB SER 21 16.662 -17.034 -14.861 176 HB3 SER 21 3HB SER 21 18.275 -16.639 -15.454 177 HG SER 21 HG SER 21 17.333 -18.957 -14.266 178 HA PRO 22 HA PRO 22 19.742 -12.483 -13.752 179 HB2 PRO 22 2HB PRO 22 21.709 -12.682 -15.613 180 HB3 PRO 22 3HB PRO 22 21.955 -13.081 -13.909 181 HG2 PRO 22 2HG PRO 22 21.433 -14.904 -16.225 182 HG3 PRO 22 3HG PRO 22 22.587 -15.091 -14.892 183 HD2 PRO 22 2HD PRO 22 20.204 -16.376 -14.947 184 HD3 PRO 22 3HD PRO 22 20.972 -15.853 -13.435 185 H GLY 23 H GLY 23 18.501 -11.094 -14.836 186 HA2 GLY 23 2HA GLY 23 18.084 -9.956 -16.937 187 HA3 GLY 23 3HA GLY 23 18.120 -11.525 -17.729 188 H GLU 24 H GLU 24 16.503 -11.855 -14.850 189 HA GLU 24 HA GLU 24 13.938 -11.881 -16.234 190 HB2 GLU 24 2HB GLU 24 14.986 -13.076 -13.702 191 HB3 GLU 24 3HB GLU 24 13.253 -12.845 -13.880 192 HG2 GLU 24 2HG GLU 24 14.846 -14.266 -15.977 193 HG3 GLU 24 3HG GLU 24 14.267 -15.105 -14.538 194 H ASN 25 H ASN 25 12.001 -11.099 -15.012 195 HA ASN 25 HA ASN 25 12.629 -8.536 -13.706 196 HB2 ASN 25 2HB ASN 25 10.119 -9.324 -15.203 197 HB3 ASN 25 3HB ASN 25 10.456 -7.742 -14.506 198 HD21 ASN 25 1HD2 ASN 25 11.375 -6.277 -15.758 199 HD22 ASN 25 2HD2 ASN 25 12.147 -6.586 -17.273 200 H LEU 26 H LEU 26 12.020 -8.235 -11.662 201 HA LEU 26 HA LEU 26 9.964 -10.012 -10.531 202 HB2 LEU 26 2HB LEU 26 12.464 -9.097 -9.119 203 HB3 LEU 26 3HB LEU 26 11.217 -10.158 -8.468 204 HG LEU 26 HG LEU 26 12.507 -11.113 -10.935 205 HD11 LEU 26 1HD1 LEU 26 14.603 -10.753 -10.275 206 HD12 LEU 26 2HD1 LEU 26 14.302 -11.950 -9.015 207 HD13 LEU 26 3HD1 LEU 26 14.094 -10.233 -8.668 208 HD21 LEU 26 3HD2 LEU 26 12.331 -13.219 -9.853 209 HD22 LEU 26 1HD2 LEU 26 10.835 -12.346 -9.519 210 HD23 LEU 26 2HD2 LEU 26 12.083 -12.464 -8.277 211 H SER 27 H SER 27 8.621 -9.127 -8.960 212 HA SER 27 HA SER 27 8.549 -6.204 -8.953 213 HB2 SER 27 2HB SER 27 6.559 -8.122 -9.231 214 HB3 SER 27 3HB SER 27 6.350 -7.540 -7.580 215 HG SER 27 HG SER 27 5.246 -6.356 -9.356 216 H ILE 28 H ILE 28 9.232 -5.076 -7.265 217 HA ILE 28 HA ILE 28 10.194 -6.333 -4.903 218 HB ILE 28 HB ILE 28 9.732 -3.407 -5.490 219 HG12 ILE 28 2HG1 ILE 28 11.372 -4.577 -6.960 220 HG13 ILE 28 3HG1 ILE 28 12.100 -3.317 -5.969 221 HG21 ILE 28 1HG2 ILE 28 10.717 -4.831 -3.101 222 HG22 ILE 28 2HG2 ILE 28 11.643 -3.418 -3.604 223 HG23 ILE 28 3HG2 ILE 28 9.924 -3.262 -3.243 224 HD11 ILE 28 3HD1 ILE 28 12.893 -5.034 -4.407 225 HD12 ILE 28 1HD1 ILE 28 12.206 -6.278 -5.450 226 HD13 ILE 28 2HD1 ILE 28 13.523 -5.262 -6.038 227 H CYS 29 H CYS 29 9.393 -6.306 -2.820 228 HA CYS 29 HA CYS 29 6.618 -5.373 -2.503 229 HB2 CYS 29 2HB CYS 29 7.754 -7.847 -1.196 230 HB3 CYS 29 3HB CYS 29 6.077 -7.316 -1.207 231 HG CYS 29 HG CYS 29 7.795 -9.025 -3.527 232 H ALA 30 H ALA 30 9.720 -6.025 -0.973 233 HA ALA 30 HA ALA 30 9.631 -3.775 0.686 234 HB1 ALA 30 1HB ALA 30 9.547 -5.554 2.800 235 HB2 ALA 30 2HB ALA 30 8.272 -4.432 2.324 236 HB3 ALA 30 3HB ALA 30 8.246 -6.096 1.739 237 H HIS 31 H HIS 31 11.341 -3.943 2.489 238 HA HIS 31 HA HIS 31 13.527 -5.706 1.599 239 HB2 HIS 31 2HB HIS 31 15.111 -3.966 1.843 240 HB3 HIS 31 3HB HIS 31 13.762 -3.244 0.970 241 HD1 HIS 31 HD1 HIS 31 15.997 -2.449 3.563 242 HD2 HIS 31 HD2 HIS 31 11.902 -1.964 3.057 243 HE1 HIS 31 HE1 HIS 31 15.330 -0.638 5.176 244 H TYR 32 H TYR 32 15.357 -5.612 3.379 245 HA TYR 32 HA TYR 32 14.260 -5.552 6.074 246 HB2 TYR 32 2HB TYR 32 13.886 -7.868 5.056 247 HB3 TYR 32 3HB TYR 32 15.635 -8.054 5.105 248 HD1 TYR 32 HD1 TYR 32 12.690 -7.351 7.268 249 HD2 TYR 32 HD2 TYR 32 16.686 -8.795 7.057 250 HE1 TYR 32 HE1 TYR 32 12.537 -8.098 9.607 251 HE2 TYR 32 HE2 TYR 32 16.544 -9.547 9.395 252 HH TYR 32 HH TYR 32 15.200 -9.850 11.153 253 H ASP 33 H ASP 33 15.676 -4.106 6.865 254 HA ASP 33 HA ASP 33 17.623 -3.203 7.618 255 HB2 ASP 33 2HB ASP 33 18.160 -6.118 7.550 256 HB3 ASP 33 3HB ASP 33 19.568 -5.067 7.675 257 H TYR 34 H TYR 34 17.036 -3.589 4.642 258 HA TYR 34 HA TYR 34 17.987 -2.988 2.666 259 HB2 TYR 34 2HB TYR 34 20.259 -1.937 4.362 260 HB3 TYR 34 3HB TYR 34 19.878 -1.472 2.708 261 HD1 TYR 34 HD1 TYR 34 18.772 -1.239 6.219 262 HD2 TYR 34 HD2 TYR 34 18.184 0.145 2.239 263 HE1 TYR 34 HE1 TYR 34 17.340 0.572 7.067 264 HE2 TYR 34 HE2 TYR 34 16.752 1.961 3.076 265 HH TYR 34 HH TYR 34 15.339 2.020 5.931 266 H GLU 35 H GLU 35 18.714 -5.551 4.135 267 HA GLU 35 HA GLU 35 21.118 -6.191 2.555 268 HB2 GLU 35 2HB GLU 35 21.234 -8.128 4.350 269 HB3 GLU 35 3HB GLU 35 21.917 -6.541 4.674 270 HG2 GLU 35 2HG GLU 35 19.865 -5.919 5.869 271 HG3 GLU 35 3HG GLU 35 19.224 -7.535 5.578 272 H TRP 36 H TRP 36 17.860 -6.629 2.751 273 HA TRP 36 HA TRP 36 17.969 -8.929 0.986 274 HB2 TRP 36 2HB TRP 36 16.382 -9.000 3.563 275 HB3 TRP 36 3HB TRP 36 16.293 -10.202 2.279 276 HD1 TRP 36 HD1 TRP 36 18.278 -9.263 5.323 277 HE1 TRP 36 HE1 TRP 36 20.179 -10.962 5.676 278 HE3 TRP 36 HE3 TRP 36 17.991 -11.741 0.860 279 HZ2 TRP 36 HZ2 TRP 36 21.396 -13.073 4.251 280 HZ3 TRP 36 HZ3 TRP 36 19.561 -13.587 0.433 281 HH2 TRP 36 HH2 TRP 36 21.227 -14.238 2.095 282 H PHE 37 H PHE 37 16.397 -8.879 -0.528 283 HA PHE 37 HA PHE 37 14.255 -6.885 -0.180 284 HB2 PHE 37 2HB PHE 37 16.230 -7.180 -2.278 285 HB3 PHE 37 3HB PHE 37 14.598 -7.280 -2.931 286 HD1 PHE 37 HD2 PHE 37 13.029 -5.433 -1.481 287 HD2 PHE 37 HD1 PHE 37 17.118 -5.100 -2.617 288 HE1 PHE 37 HE2 PHE 37 12.848 -2.981 -1.401 289 HE2 PHE 37 HE1 PHE 37 16.943 -2.647 -2.538 290 HZ PHE 37 HZ PHE 37 14.806 -1.584 -1.931 291 H ILE 38 H ILE 38 12.201 -7.401 -0.916 292 HA ILE 38 HA ILE 38 11.746 -10.268 -1.337 293 HB ILE 38 HB ILE 38 9.664 -8.181 -0.701 294 HG12 ILE 38 2HG1 ILE 38 11.292 -8.171 1.100 295 HG13 ILE 38 3HG1 ILE 38 9.829 -8.985 1.643 296 HG21 ILE 38 1HG2 ILE 38 8.216 -9.947 -0.259 297 HG22 ILE 38 2HG2 ILE 38 9.091 -10.487 -1.691 298 HG23 ILE 38 3HG2 ILE 38 9.530 -11.113 -0.102 299 HD11 ILE 38 3HD1 ILE 38 11.568 -10.935 0.541 300 HD12 ILE 38 1HD1 ILE 38 12.489 -9.934 1.664 301 HD13 ILE 38 2HD1 ILE 38 11.024 -10.751 2.209 302 H ALA 39 H ALA 39 12.063 -10.532 -3.517 303 HA ALA 39 HA ALA 39 10.363 -8.933 -5.313 304 HB1 ALA 39 1HB ALA 39 12.495 -10.605 -6.477 305 HB2 ALA 39 2HB ALA 39 11.979 -8.969 -6.889 306 HB3 ALA 39 3HB ALA 39 13.026 -9.240 -5.496 307 H LYS 40 H LYS 40 8.847 -9.904 -6.539 308 HA LYS 40 HA LYS 40 8.607 -12.830 -6.309 309 HB2 LYS 40 2HB LYS 40 6.157 -12.348 -6.901 310 HB3 LYS 40 3HB LYS 40 6.704 -11.915 -5.287 311 HG2 LYS 40 2HG LYS 40 6.961 -9.587 -6.007 312 HG3 LYS 40 3HG LYS 40 6.382 -10.030 -7.614 313 HD2 LYS 40 2HD LYS 40 4.303 -10.924 -6.405 314 HD3 LYS 40 3HD LYS 40 4.877 -9.998 -5.016 315 HE2 LYS 40 2HE LYS 40 4.624 -7.959 -6.121 316 HE3 LYS 40 3HE LYS 40 4.588 -8.719 -7.711 317 HZ1 LYS 40 3HZ LYS 40 2.390 -8.608 -7.563 318 HZ2 LYS 40 1HZ LYS 40 2.436 -8.158 -5.933 319 HZ3 LYS 40 2HZ LYS 40 2.459 -9.795 -6.359 320 HA PRO 41 HA PRO 41 8.982 -13.329 -10.653 321 HB2 PRO 41 2HB PRO 41 7.245 -15.361 -11.125 322 HB3 PRO 41 3HB PRO 41 8.791 -15.592 -10.299 323 HG2 PRO 41 2HG PRO 41 6.046 -15.310 -9.138 324 HG3 PRO 41 3HG PRO 41 7.341 -16.435 -8.689 325 HD2 PRO 41 2HD PRO 41 6.814 -14.183 -7.281 326 HD3 PRO 41 3HD PRO 41 8.451 -14.853 -7.433 327 H ILE 42 H ILE 42 8.250 -11.801 -11.996 328 HA ILE 42 HA ILE 42 5.557 -10.861 -11.988 329 HB ILE 42 HB ILE 42 7.713 -10.384 -14.048 330 HG12 ILE 42 2HG1 ILE 42 6.927 -8.760 -11.618 331 HG13 ILE 42 3HG1 ILE 42 8.410 -9.692 -11.797 332 HG21 ILE 42 1HG2 ILE 42 5.893 -8.218 -13.769 333 HG22 ILE 42 2HG2 ILE 42 6.201 -9.225 -15.182 334 HG23 ILE 42 3HG2 ILE 42 4.966 -9.697 -14.016 335 HD11 ILE 42 3HD1 ILE 42 7.708 -7.044 -12.820 336 HD12 ILE 42 1HD1 ILE 42 9.282 -7.735 -12.429 337 HD13 ILE 42 2HD1 ILE 42 8.524 -8.092 -13.981 338 H ASN 43 H ASN 43 7.386 -13.123 -13.955 339 HA ASN 43 HA ASN 43 5.183 -13.456 -15.824 340 HB2 ASN 43 2HB ASN 43 7.384 -13.489 -16.791 341 HB3 ASN 43 3HB ASN 43 7.922 -14.722 -15.655 342 HD21 ASN 43 1HD2 ASN 43 7.439 -16.841 -16.025 343 HD22 ASN 43 2HD2 ASN 43 6.705 -17.408 -17.483 344 H ARG 43 H ARG 43 7.082 -15.597 -13.690 345 HA ARG 43 HA ARG 43 5.283 -17.774 -13.904 346 HB2 ARG 43 2HB ARG 43 7.173 -17.300 -11.604 347 HB3 ARG 43 3HB ARG 43 6.598 -18.837 -12.237 348 HG2 ARG 43 2HG ARG 43 7.821 -18.245 -14.380 349 HG3 ARG 43 3HG ARG 43 8.588 -16.952 -13.455 350 HD2 ARG 43 2HD ARG 43 8.608 -19.715 -12.345 351 HD3 ARG 43 3HD ARG 43 9.701 -19.331 -13.674 352 HE ARG 43 HE ARG 43 9.889 -18.420 -10.950 353 HH11 ARG 43 1HH1 ARG 43 10.785 -17.803 -14.257 354 HH12 ARG 43 2HH1 ARG 43 12.179 -16.862 -13.841 355 HH21 ARG 43 1HH2 ARG 43 11.722 -17.184 -10.389 356 HH22 ARG 43 2HH2 ARG 43 12.712 -16.511 -11.640 357 H LEU 44 H LEU 44 3.787 -18.581 -12.402 358 HA LEU 44 HA LEU 44 2.640 -16.518 -10.652 359 HB2 LEU 44 2HB LEU 44 0.655 -18.197 -10.712 360 HB3 LEU 44 3HB LEU 44 0.947 -17.118 -12.075 361 HG LEU 44 HG LEU 44 1.917 -18.913 -13.353 362 HD11 LEU 44 1HD1 LEU 44 2.124 -21.162 -12.518 363 HD12 LEU 44 2HD1 LEU 44 1.434 -20.688 -10.966 364 HD13 LEU 44 3HD1 LEU 44 3.009 -20.064 -11.457 365 HD21 LEU 44 3HD2 LEU 44 -0.750 -18.774 -12.562 366 HD22 LEU 44 1HD2 LEU 44 -0.336 -20.486 -12.474 367 HD23 LEU 44 2HD2 LEU 44 -0.102 -19.598 -13.980 368 H GLY 45 H GLY 45 4.824 -18.729 -10.245 369 HA2 GLY 45 2HA GLY 45 3.990 -20.623 -8.416 370 HA3 GLY 45 3HA GLY 45 5.587 -19.889 -8.415 371 H GLY 46 H GLY 46 5.966 -18.035 -7.106 372 HA2 GLY 46 2HA GLY 46 4.034 -16.837 -5.451 373 HA3 GLY 46 3HA GLY 46 4.783 -18.156 -4.564 374 HA PRO 47 HA PRO 47 7.331 -14.141 -4.431 375 HB2 PRO 47 2HB PRO 47 6.771 -13.412 -1.877 376 HB3 PRO 47 3HB PRO 47 5.822 -12.861 -3.263 377 HG2 PRO 47 2HG PRO 47 5.243 -15.073 -1.331 378 HG3 PRO 47 3HG PRO 47 4.144 -13.847 -1.990 379 HD2 PRO 47 2HD PRO 47 4.239 -16.381 -2.941 380 HD3 PRO 47 3HD PRO 47 3.860 -14.987 -3.973 381 H GLY 48 H GLY 48 9.372 -14.096 -3.558 382 HA2 GLY 48 2HA GLY 48 10.009 -16.129 -1.519 383 HA3 GLY 48 3HA GLY 48 10.971 -16.006 -2.985 384 H LEU 49 H LEU 49 12.815 -15.644 -1.636 385 HA LEU 49 HA LEU 49 12.998 -12.849 -0.741 386 HB2 LEU 49 2HB LEU 49 12.853 -14.785 1.054 387 HB3 LEU 49 3HB LEU 49 14.567 -14.942 0.676 388 HG LEU 49 HG LEU 49 13.437 -12.280 1.446 389 HD11 LEU 49 1HD1 LEU 49 12.845 -14.206 3.094 390 HD12 LEU 49 2HD1 LEU 49 13.527 -12.701 3.708 391 HD13 LEU 49 3HD1 LEU 49 14.556 -14.119 3.513 392 HD21 LEU 49 3HD2 LEU 49 15.649 -12.150 0.669 393 HD22 LEU 49 1HD2 LEU 49 16.126 -13.616 1.527 394 HD23 LEU 49 2HD2 LEU 49 15.782 -12.139 2.429 395 H VAL 50 H VAL 50 14.594 -11.779 -1.695 396 HA VAL 50 HA VAL 50 16.991 -13.238 -2.553 397 HB VAL 50 HB VAL 50 15.607 -13.058 -4.544 398 HG11 VAL 50 1HG1 VAL 50 14.322 -11.060 -3.723 399 HG12 VAL 50 2HG1 VAL 50 15.695 -10.066 -4.214 400 HG13 VAL 50 3HG1 VAL 50 14.804 -10.998 -5.418 401 HG21 VAL 50 3HG2 VAL 50 17.963 -11.177 -4.503 402 HG22 VAL 50 1HG2 VAL 50 17.969 -12.895 -4.903 403 HG23 VAL 50 2HG2 VAL 50 17.173 -11.742 -5.975 404 HA PRO 51 HA PRO 51 18.965 -9.823 -0.551 405 HB2 PRO 51 2HB PRO 51 21.488 -10.319 -1.421 406 HB3 PRO 51 3HB PRO 51 20.704 -11.272 -0.155 407 HG2 PRO 51 2HG PRO 51 21.024 -11.889 -3.067 408 HG3 PRO 51 3HG PRO 51 21.227 -12.959 -1.667 409 HD2 PRO 51 2HD PRO 51 18.987 -12.960 -3.189 410 HD3 PRO 51 3HD PRO 51 18.959 -13.311 -1.449 411 H VAL 52 H VAL 52 19.966 -7.834 -1.053 412 HA VAL 52 HA VAL 52 19.245 -6.730 -3.564 413 HB VAL 52 HB VAL 52 21.177 -5.485 -1.617 414 HG11 VAL 52 1HG1 VAL 52 19.243 -3.727 -2.802 415 HG12 VAL 52 2HG1 VAL 52 21.004 -3.680 -2.901 416 HG13 VAL 52 3HG1 VAL 52 20.080 -4.640 -4.057 417 HG21 VAL 52 3HG2 VAL 52 19.550 -5.746 -0.084 418 HG22 VAL 52 1HG2 VAL 52 18.778 -4.416 -0.947 419 HG23 VAL 52 2HG2 VAL 52 18.317 -6.081 -1.300 420 H SER 53 H SER 53 22.065 -8.326 -2.418 421 HA SER 53 HA SER 53 23.887 -7.191 -4.323 422 HB2 SER 53 2HB SER 53 24.131 -9.694 -2.637 423 HB3 SER 53 3HB SER 53 25.442 -8.938 -3.542 424 HG SER 53 HG SER 53 25.034 -8.429 -1.149 425 H TYR 54 H TYR 54 21.331 -9.224 -4.681 426 HA TYR 54 HA TYR 54 22.534 -10.496 -7.050 427 HB2 TYR 54 2HB TYR 54 20.678 -11.645 -4.987 428 HB3 TYR 54 3HB TYR 54 20.705 -12.293 -6.623 429 HD1 TYR 54 HD1 TYR 54 22.895 -11.589 -3.699 430 HD2 TYR 54 HD2 TYR 54 22.312 -13.876 -7.239 431 HE1 TYR 54 HE1 TYR 54 24.826 -12.991 -3.104 432 HE2 TYR 54 HE2 TYR 54 24.241 -15.285 -6.654 433 HH TYR 54 HH TYR 54 26.542 -14.538 -4.715 434 H VAL 55 H VAL 55 20.897 -7.983 -6.524 435 HA VAL 55 HA VAL 55 19.102 -8.352 -8.780 436 HB VAL 55 HB VAL 55 17.153 -7.442 -7.692 437 HG11 VAL 55 1HG1 VAL 55 18.211 -9.634 -5.921 438 HG12 VAL 55 2HG1 VAL 55 16.530 -9.293 -6.335 439 HG13 VAL 55 3HG1 VAL 55 17.636 -9.904 -7.566 440 HG21 VAL 55 3HG2 VAL 55 17.687 -7.532 -4.959 441 HG22 VAL 55 1HG2 VAL 55 19.066 -6.691 -5.667 442 HG23 VAL 55 2HG2 VAL 55 17.431 -6.092 -5.944 443 H ARG 56 H ARG 56 18.334 -6.330 -9.672 444 HA ARG 56 HA ARG 56 19.953 -4.011 -8.846 445 HB2 ARG 56 2HB ARG 56 20.926 -4.747 -10.875 446 HB3 ARG 56 3HB ARG 56 19.357 -5.046 -11.609 447 HG2 ARG 56 2HG ARG 56 18.931 -2.730 -11.859 448 HG3 ARG 56 3HG ARG 56 20.305 -2.301 -10.838 449 HD2 ARG 56 2HD ARG 56 20.741 -1.984 -13.255 450 HD3 ARG 56 3HD ARG 56 21.851 -3.119 -12.489 451 HE ARG 56 HE ARG 56 19.948 -4.746 -13.464 452 HH11 ARG 56 1HH1 ARG 56 21.773 -2.151 -14.897 453 HH12 ARG 56 2HH1 ARG 56 21.741 -2.833 -16.489 454 HH21 ARG 56 1HH2 ARG 56 19.898 -5.655 -15.556 455 HH22 ARG 56 2HH2 ARG 56 20.673 -4.826 -16.863 456 H ILE 57 H ILE 57 18.620 -2.567 -7.977 457 HA ILE 57 HA ILE 57 15.840 -2.459 -8.438 458 HB ILE 57 HB ILE 57 17.612 -0.279 -7.328 459 HG12 ILE 57 2HG1 ILE 57 17.839 -2.427 -6.118 460 HG13 ILE 57 3HG1 ILE 57 17.076 -1.185 -5.131 461 HG21 ILE 57 1HG2 ILE 57 15.233 -0.018 -6.076 462 HG22 ILE 57 2HG2 ILE 57 15.690 0.876 -7.525 463 HG23 ILE 57 3HG2 ILE 57 14.705 -0.580 -7.662 464 HD11 ILE 57 3HD1 ILE 57 15.557 -3.301 -6.631 465 HD12 ILE 57 1HD1 ILE 57 16.053 -3.443 -4.945 466 HD13 ILE 57 2HD1 ILE 57 14.929 -2.172 -5.430 467 H ILE 58 H ILE 58 14.764 -1.678 -10.116 468 HA ILE 58 HA ILE 58 15.874 0.602 -11.593 469 HB ILE 58 HB ILE 58 14.990 -0.479 -13.715 470 HG12 ILE 58 2HG1 ILE 58 15.169 -2.979 -12.021 471 HG13 ILE 58 3HG1 ILE 58 13.665 -2.235 -12.550 472 HG21 ILE 58 1HG2 ILE 58 17.167 -2.250 -12.963 473 HG22 ILE 58 2HG2 ILE 58 17.116 -0.970 -14.175 474 HG23 ILE 58 3HG2 ILE 58 17.457 -0.576 -12.490 475 HD11 ILE 58 3HD1 ILE 58 14.204 -4.110 -13.958 476 HD12 ILE 58 1HD1 ILE 58 14.330 -2.615 -14.885 477 HD13 ILE 58 2HD1 ILE 58 15.790 -3.425 -14.314 478 H ASP 59 H ASP 59 14.143 1.419 -13.216 479 HA ASP 59 HA ASP 59 11.540 1.420 -11.834 480 HB2 ASP 59 2HB ASP 59 13.095 3.616 -13.156 481 HB3 ASP 59 3HB ASP 59 11.338 3.718 -13.072 482 H LEU 60 H LEU 60 9.849 0.695 -12.943 483 HA LEU 60 HA LEU 60 10.006 -0.505 -15.426 484 HB2 LEU 60 2HB LEU 60 8.024 -0.041 -13.495 485 HB3 LEU 60 3HB LEU 60 7.367 0.559 -15.016 486 HG LEU 60 HG LEU 60 6.739 -1.784 -14.505 487 HD11 LEU 60 1HD1 LEU 60 6.672 -2.272 -16.693 488 HD12 LEU 60 2HD1 LEU 60 8.417 -2.109 -16.890 489 HD13 LEU 60 3HD1 LEU 60 7.392 -0.674 -16.892 490 HD21 LEU 60 3HD2 LEU 60 8.220 -3.411 -14.064 491 HD22 LEU 60 1HD2 LEU 60 9.308 -2.081 -13.669 492 HD23 LEU 60 2HD2 LEU 60 9.373 -2.828 -15.265 493 H MET 61 H MET 61 9.463 2.841 -14.624 494 HA MET 61 HA MET 61 8.743 3.518 -17.363 495 HB2 MET 61 2HB MET 61 8.987 5.153 -14.839 496 HB3 MET 61 3HB MET 61 8.662 5.869 -16.412 497 HG2 MET 61 2HG MET 61 6.534 5.654 -15.689 498 HG3 MET 61 3HG MET 61 6.728 4.059 -16.414 499 HE1 MET 61 3HE MET 61 4.688 2.858 -14.723 500 HE2 MET 61 1HE MET 61 6.113 2.147 -15.481 501 HE3 MET 61 2HE MET 61 5.736 1.782 -13.798 502 H ASP 62 H ASP 62 11.488 3.546 -15.253 503 HA ASP 62 HA ASP 62 13.138 4.534 -17.457 504 HB2 ASP 62 2HB ASP 62 13.707 5.537 -14.688 505 HB3 ASP 62 3HB ASP 62 14.198 6.213 -16.239 506 HA PRO 63 HA PRO 63 14.837 0.745 -15.382 507 HB2 PRO 63 2HB PRO 63 15.341 -0.580 -17.697 508 HB3 PRO 63 3HB PRO 63 13.775 -0.638 -16.878 509 HG2 PRO 63 2HG PRO 63 14.629 1.022 -19.218 510 HG3 PRO 63 3HG PRO 63 13.112 0.139 -18.967 511 HD2 PRO 63 2HD PRO 63 13.323 2.811 -18.582 512 HD3 PRO 63 3HD PRO 63 12.225 1.792 -17.629 513 H ALA 64 H ALA 64 15.919 3.155 -17.508 514 HA ALA 64 HA ALA 64 18.683 2.165 -17.460 515 HB1 ALA 64 1HB ALA 64 19.144 3.823 -19.181 516 HB2 ALA 64 2HB ALA 64 17.793 2.793 -19.653 517 HB3 ALA 64 3HB ALA 64 17.491 4.427 -19.061 518 H LYS 65 H LYS 65 16.596 4.433 -16.002 519 HA LYS 65 HA LYS 65 18.547 6.401 -15.309 520 HB2 LYS 65 2HB LYS 65 15.962 6.613 -15.393 521 HB3 LYS 65 3HB LYS 65 16.008 5.933 -13.772 522 HG2 LYS 65 2HG LYS 65 17.615 7.802 -13.185 523 HG3 LYS 65 3HG LYS 65 17.170 8.530 -14.731 524 HD2 LYS 65 2HD LYS 65 15.194 7.767 -12.583 525 HD3 LYS 65 3HD LYS 65 15.869 9.386 -12.780 526 HE2 LYS 65 2HE LYS 65 14.735 8.216 -15.222 527 HE3 LYS 65 3HE LYS 65 13.567 8.507 -13.934 528 HZ1 LYS 65 3HZ LYS 65 14.179 10.363 -15.658 529 HZ2 LYS 65 1HZ LYS 65 15.461 10.641 -14.590 530 HZ3 LYS 65 2HZ LYS 65 13.865 10.748 -14.041 531 H TYR 66 H TYR 66 16.936 3.812 -13.466 532 HA TYR 66 HA TYR 66 18.900 4.131 -11.326 533 HB2 TYR 66 2HB TYR 66 16.339 2.543 -11.519 534 HB3 TYR 66 3HB TYR 66 17.431 2.447 -10.143 535 HD1 TYR 66 HD2 TYR 66 15.191 4.701 -12.030 536 HD2 TYR 66 HD1 TYR 66 17.448 4.132 -8.469 537 HE1 TYR 66 HE2 TYR 66 14.084 6.654 -11.024 538 HE2 TYR 66 HE1 TYR 66 16.346 6.083 -7.452 539 HH TYR 66 HH TYR 66 14.856 8.380 -9.026 540 H ALA 67 H ALA 67 19.435 2.910 -14.025 541 HA ALA 67 HA ALA 67 19.961 0.123 -13.410 542 HB1 ALA 67 1HB ALA 67 21.137 1.168 -15.865 543 HB2 ALA 67 2HB ALA 67 20.034 -0.187 -15.621 544 HB3 ALA 67 3HB ALA 67 19.401 1.455 -15.740 545 H SER 68 H SER 68 21.592 3.133 -13.254 546 HA SER 68 HA SER 68 24.246 1.950 -13.319 547 HB2 SER 68 2HB SER 68 24.928 4.366 -12.776 548 HB3 SER 68 3HB SER 68 24.176 4.078 -14.344 549 HG SER 68 HG SER 68 22.838 5.575 -13.730 550 H VAL 69 H VAL 69 21.832 2.746 -11.028 551 HA VAL 69 HA VAL 69 23.235 3.369 -8.738 552 HB VAL 69 HB VAL 69 20.738 3.256 -8.958 553 HG11 VAL 69 1HG1 VAL 69 19.564 1.299 -8.972 554 HG12 VAL 69 2HG1 VAL 69 21.015 0.772 -9.828 555 HG13 VAL 69 3HG1 VAL 69 20.821 0.410 -8.112 556 HG21 VAL 69 3HG2 VAL 69 20.663 3.410 -6.735 557 HG22 VAL 69 1HG2 VAL 69 21.104 1.715 -6.534 558 HG23 VAL 69 2HG2 VAL 69 22.361 2.935 -6.731 559 H ASP 70 H ASP 70 24.123 2.175 -7.038 560 HA ASP 70 HA ASP 70 25.031 -0.513 -7.807 561 HB2 ASP 70 2HB ASP 70 26.210 1.457 -5.837 562 HB3 ASP 70 3HB ASP 70 26.850 -0.152 -6.157 563 H THR 71 H THR 71 23.237 -1.671 -7.083 564 HA THR 71 HA THR 71 21.886 -1.422 -4.693 565 HB THR 71 HB THR 71 21.832 -4.114 -4.977 566 HG1 THR 71 HG1 THR 71 22.603 -4.709 -6.854 567 HG21 THR 71 3HG2 THR 71 19.934 -2.511 -5.102 568 HG22 THR 71 1HG2 THR 71 19.831 -3.809 -6.291 569 HG23 THR 71 2HG2 THR 71 20.355 -2.200 -6.786 570 H TYR 72 H TYR 72 25.024 -2.824 -5.300 571 HA TYR 72 HA TYR 72 25.330 -4.309 -2.941 572 HB2 TYR 72 2HB TYR 72 26.903 -4.655 -4.692 573 HB3 TYR 72 3HB TYR 72 27.331 -2.948 -4.744 574 HD1 TYR 72 HD1 TYR 72 27.323 -5.786 -2.305 575 HD2 TYR 72 HD2 TYR 72 29.322 -2.325 -3.765 576 HE1 TYR 72 HE1 TYR 72 29.183 -6.213 -0.753 577 HE2 TYR 72 HE2 TYR 72 31.188 -2.743 -2.218 578 HH TYR 72 HH TYR 72 31.826 -3.924 -0.380 579 H ASP 73 H ASP 73 26.237 -0.952 -3.681 580 HA ASP 73 HA ASP 73 27.309 -0.355 -1.145 581 HB2 ASP 73 2HB ASP 73 26.386 1.224 -3.493 582 HB3 ASP 73 3HB ASP 73 26.556 2.076 -1.960 583 H ARG 74 H ARG 74 26.242 -0.447 0.712 584 HA ARG 74 HA ARG 74 23.485 -0.534 1.036 585 HB2 ARG 74 2HB ARG 74 23.864 -0.377 3.360 586 HB3 ARG 74 3HB ARG 74 25.294 -1.168 2.711 587 HG2 ARG 74 2HG ARG 74 25.141 1.779 3.292 588 HG3 ARG 74 3HG ARG 74 25.738 0.578 4.440 589 HD2 ARG 74 2HD ARG 74 26.884 1.279 1.744 590 HD3 ARG 74 3HD ARG 74 27.624 1.528 3.325 591 HE ARG 74 HE ARG 74 27.247 -1.155 3.214 592 HH11 ARG 74 1HH1 ARG 74 28.783 1.155 1.111 593 HH12 ARG 74 2HH1 ARG 74 29.945 0.024 0.501 594 HH21 ARG 74 1HH2 ARG 74 28.771 -2.654 2.419 595 HH22 ARG 74 2HH2 ARG 74 29.937 -2.143 1.245 596 H GLU 75 H GLU 75 25.583 2.179 0.605 597 HA GLU 75 HA GLU 75 23.936 4.183 1.736 598 HB2 GLU 75 2HB GLU 75 26.311 4.093 -0.017 599 HB3 GLU 75 3HB GLU 75 25.312 5.531 -0.171 600 HG2 GLU 75 2HG GLU 75 25.473 5.768 2.331 601 HG3 GLU 75 3HG GLU 75 26.701 4.504 2.284 602 H GLN 76 H GLN 76 24.419 3.198 -1.656 603 HA GLN 76 HA GLN 76 22.482 4.884 -2.765 604 HB2 GLN 76 2HB GLN 76 23.327 2.171 -3.794 605 HB3 GLN 76 3HB GLN 76 22.591 3.465 -4.731 606 HG2 GLN 76 2HG GLN 76 24.960 4.410 -3.411 607 HG3 GLN 76 3HG GLN 76 25.310 2.963 -4.355 608 HE21 GLN 76 1HE2 GLN 76 25.797 3.280 -6.399 609 HE22 GLN 76 2HE2 GLN 76 25.361 4.653 -7.351 610 H VAL 77 H VAL 77 22.213 1.397 -2.055 611 HA VAL 77 HA VAL 77 19.540 1.058 -2.652 612 HB VAL 77 HB VAL 77 21.329 -0.674 -1.886 613 HG11 VAL 77 1HG1 VAL 77 21.585 0.352 0.367 614 HG12 VAL 77 2HG1 VAL 77 19.945 -0.176 0.745 615 HG13 VAL 77 3HG1 VAL 77 21.200 -1.368 0.405 616 HG21 VAL 77 3HG2 VAL 77 19.225 -2.014 -0.852 617 HG22 VAL 77 1HG2 VAL 77 18.392 -0.695 -1.674 618 HG23 VAL 77 2HG2 VAL 77 19.473 -1.755 -2.579 619 H MET 78 H MET 78 21.003 2.462 0.201 620 HA MET 78 HA MET 78 18.690 2.432 1.840 621 HB2 MET 78 2HB MET 78 21.366 3.664 1.919 622 HB3 MET 78 3HB MET 78 20.116 4.550 2.783 623 HG2 MET 78 2HG MET 78 19.560 2.364 3.932 624 HG3 MET 78 3HG MET 78 21.060 1.741 3.249 625 HE1 MET 78 3HE MET 78 23.508 3.355 3.725 626 HE2 MET 78 1HE MET 78 23.768 2.964 5.426 627 HE3 MET 78 2HE MET 78 23.110 1.747 4.332 628 H LYS 79 H LYS 79 20.188 5.035 -0.080 629 HA LYS 79 HA LYS 79 18.290 7.007 0.399 630 HB2 LYS 79 2HB LYS 79 19.951 6.524 -2.081 631 HB3 LYS 79 3HB LYS 79 19.063 8.005 -1.749 632 HG2 LYS 79 2HG LYS 79 20.521 8.681 -0.122 633 HG3 LYS 79 3HG LYS 79 21.012 7.033 0.276 634 HD2 LYS 79 2HD LYS 79 22.373 6.882 -1.671 635 HD3 LYS 79 3HD LYS 79 21.706 8.378 -2.329 636 HE2 LYS 79 2HE LYS 79 23.094 8.411 0.316 637 HE3 LYS 79 3HE LYS 79 24.047 8.373 -1.167 638 HZ1 LYS 79 3HZ LYS 79 21.914 10.333 -1.117 639 HZ2 LYS 79 1HZ LYS 79 23.509 10.479 -1.664 640 HZ3 LYS 79 2HZ LYS 79 23.165 10.613 -0.013 641 H ILE 80 H ILE 80 18.300 4.401 -1.973 642 HA ILE 80 HA ILE 80 16.040 5.267 -3.438 643 HB ILE 80 HB ILE 80 17.154 2.480 -3.095 644 HG12 ILE 80 2HG1 ILE 80 17.461 4.175 -5.545 645 HG13 ILE 80 3HG1 ILE 80 18.519 4.456 -4.167 646 HG21 ILE 80 1HG2 ILE 80 14.945 2.197 -3.847 647 HG22 ILE 80 2HG2 ILE 80 15.048 3.585 -4.929 648 HG23 ILE 80 3HG2 ILE 80 15.940 2.109 -5.300 649 HD11 ILE 80 3HD1 ILE 80 18.388 1.654 -4.783 650 HD12 ILE 80 1HD1 ILE 80 18.849 2.590 -6.204 651 HD13 ILE 80 2HD1 ILE 80 19.784 2.729 -4.715 652 H ILE 81 H ILE 81 16.352 2.717 -0.961 653 HA ILE 81 HA ILE 81 13.623 2.129 -0.764 654 HB ILE 81 HB ILE 81 15.775 1.870 1.339 655 HG12 ILE 81 2HG1 ILE 81 14.598 -0.246 -0.468 656 HG13 ILE 81 3HG1 ILE 81 16.082 0.626 -0.836 657 HG21 ILE 81 1HG2 ILE 81 14.151 1.344 2.761 658 HG22 ILE 81 2HG2 ILE 81 12.933 1.465 1.492 659 HG23 ILE 81 3HG2 ILE 81 13.790 -0.055 1.750 660 HD11 ILE 81 3HD1 ILE 81 16.032 -0.590 1.822 661 HD12 ILE 81 1HD1 ILE 81 15.942 -1.739 0.487 662 HD13 ILE 81 2HD1 ILE 81 17.288 -0.603 0.584 663 H ASP 82 H ASP 82 15.597 4.549 0.858 664 HA ASP 82 HA ASP 82 13.600 5.349 2.725 665 HB2 ASP 82 2HB ASP 82 16.193 5.754 2.726 666 HB3 ASP 82 3HB ASP 82 15.771 7.198 1.810 667 H GLU 83 H GLU 83 14.795 6.809 -0.297 668 HA GLU 83 HA GLU 83 13.003 8.959 -0.357 669 HB2 GLU 83 2HB GLU 83 14.577 7.520 -2.469 670 HB3 GLU 83 3HB GLU 83 13.444 8.788 -2.916 671 HG2 GLU 83 2HG GLU 83 14.688 10.443 -1.922 672 HG3 GLU 83 3HG GLU 83 15.480 9.328 -0.810 673 H PHE 84 H PHE 84 12.805 5.793 -1.975 674 HA PHE 84 HA PHE 84 10.215 6.257 -3.051 675 HB2 PHE 84 2HB PHE 84 11.902 3.789 -2.687 676 HB3 PHE 84 3HB PHE 84 10.266 3.698 -3.331 677 HD1 PHE 84 HD1 PHE 84 13.328 5.768 -3.871 678 HD2 PHE 84 HD2 PHE 84 10.103 3.602 -5.609 679 HE1 PHE 84 HE1 PHE 84 14.190 6.293 -6.115 680 HE2 PHE 84 HE2 PHE 84 10.959 4.123 -7.856 681 HZ PHE 84 HZ PHE 84 13.006 5.469 -8.111 682 H LYS 85 H LYS 85 11.266 5.606 0.068 683 HA LYS 85 HA LYS 85 10.222 5.058 2.013 684 HB2 LYS 85 2HB LYS 85 7.885 5.954 0.339 685 HB3 LYS 85 3HB LYS 85 7.680 5.431 2.006 686 HG2 LYS 85 2HG LYS 85 9.628 7.586 1.273 687 HG3 LYS 85 3HG LYS 85 7.920 7.933 1.550 688 HD2 LYS 85 2HD LYS 85 8.045 7.443 3.790 689 HD3 LYS 85 3HD LYS 85 9.403 6.335 3.582 690 HE2 LYS 85 2HE LYS 85 10.954 8.069 3.459 691 HE3 LYS 85 3HE LYS 85 9.724 9.270 3.073 692 HZ1 LYS 85 3HZ LYS 85 10.463 8.138 5.674 693 HZ2 LYS 85 1HZ LYS 85 8.858 8.619 5.435 694 HZ3 LYS 85 2HZ LYS 85 10.113 9.739 5.256 695 H ILE 86 H ILE 86 10.956 2.875 0.628 696 HA ILE 86 HA ILE 86 8.764 1.062 0.215 697 HB ILE 86 HB ILE 86 11.662 0.294 0.492 698 HG12 ILE 86 2HG1 ILE 86 10.224 1.287 -1.979 699 HG13 ILE 86 3HG1 ILE 86 11.497 2.143 -1.115 700 HG21 ILE 86 1HG2 ILE 86 9.816 -0.990 -1.431 701 HG22 ILE 86 2HG2 ILE 86 11.098 -1.692 -0.445 702 HG23 ILE 86 3HG2 ILE 86 9.538 -1.307 0.281 703 HD11 ILE 86 3HD1 ILE 86 11.837 -0.523 -2.465 704 HD12 ILE 86 1HD1 ILE 86 12.280 1.033 -3.167 705 HD13 ILE 86 2HD1 ILE 86 13.098 0.455 -1.715 706 HA PRO 87 HA PRO 87 8.386 -0.095 4.487 707 HB2 PRO 87 2HB PRO 87 6.607 -2.109 4.095 708 HB3 PRO 87 3HB PRO 87 6.153 -0.401 4.039 709 HG2 PRO 87 2HG PRO 87 6.729 -2.283 1.784 710 HG3 PRO 87 3HG PRO 87 5.434 -1.081 1.935 711 HD2 PRO 87 2HD PRO 87 7.677 -0.632 0.486 712 HD3 PRO 87 3HD PRO 87 6.814 0.666 1.337 713 H THR 88 H THR 88 8.877 -1.896 5.839 714 HA THR 88 HA THR 88 10.891 -3.646 4.696 715 HB THR 88 HB THR 88 10.474 -4.275 7.429 716 HG1 THR 88 HG1 THR 88 9.780 -2.445 8.218 717 HG21 THR 88 3HG2 THR 88 12.644 -4.428 6.605 718 HG22 THR 88 1HG2 THR 88 12.709 -2.965 7.586 719 HG23 THR 88 2HG2 THR 88 12.569 -2.845 5.832 720 H VAL 89 H VAL 89 10.919 -5.961 5.629 721 HA VAL 89 HA VAL 89 8.856 -7.432 4.533 722 HB VAL 89 HB VAL 89 10.674 -8.259 6.800 723 HG11 VAL 89 1HG1 VAL 89 9.243 -10.002 6.874 724 HG12 VAL 89 2HG1 VAL 89 8.610 -9.689 5.256 725 HG13 VAL 89 3HG1 VAL 89 10.146 -10.533 5.455 726 HG21 VAL 89 3HG2 VAL 89 12.054 -9.253 5.042 727 HG22 VAL 89 1HG2 VAL 89 10.956 -8.618 3.818 728 HG23 VAL 89 2HG2 VAL 89 11.894 -7.511 4.820 729 H GLU 90 H GLU 90 9.362 -6.674 7.978 730 HA GLU 90 HA GLU 90 7.160 -7.947 9.042 731 HB2 GLU 90 2HB GLU 90 8.534 -5.392 9.858 732 HB3 GLU 90 3HB GLU 90 7.232 -6.101 10.802 733 HG2 GLU 90 2HG GLU 90 8.563 -8.169 11.017 734 HG3 GLU 90 3HG GLU 90 9.883 -7.372 10.163 735 H GLN 91 H GLN 91 7.336 -4.581 7.890 736 HA GLN 91 HA GLN 91 4.670 -3.903 8.353 737 HB2 GLN 91 2HB GLN 91 6.348 -2.863 6.071 738 HB3 GLN 91 3HB GLN 91 5.021 -2.044 6.885 739 HG2 GLN 91 2HG GLN 91 7.798 -2.559 7.872 740 HG3 GLN 91 3HG GLN 91 6.936 -1.028 7.726 741 HE21 GLN 91 1HE2 GLN 91 8.282 -2.491 9.997 742 HE22 GLN 91 2HE2 GLN 91 7.105 -2.485 11.262 743 H TRP 92 H TRP 92 6.199 -5.410 5.547 744 HA TRP 92 HA TRP 92 3.938 -5.363 3.862 745 HB2 TRP 92 2HB TRP 92 6.270 -5.771 3.090 746 HB3 TRP 92 3HB TRP 92 6.213 -7.358 3.852 747 HD1 TRP 92 HD1 TRP 92 4.013 -5.464 1.256 748 HE1 TRP 92 HE1 TRP 92 3.370 -7.136 -0.591 749 HE3 TRP 92 HE3 TRP 92 6.327 -9.634 3.096 750 HZ2 TRP 92 HZ2 TRP 92 3.787 -9.863 -1.189 751 HZ3 TRP 92 HZ3 TRP 92 6.156 -11.735 1.826 752 HH2 TRP 92 HH2 TRP 92 4.911 -11.845 -0.271 753 H LYS 93 H LYS 93 5.120 -7.735 6.199 754 HA LYS 93 HA LYS 93 3.273 -9.776 5.604 755 HB2 LYS 93 2HB LYS 93 4.624 -9.166 8.241 756 HB3 LYS 93 3HB LYS 93 3.858 -10.688 7.805 757 HG2 LYS 93 2HG LYS 93 5.985 -9.701 6.005 758 HG3 LYS 93 3HG LYS 93 6.479 -10.273 7.600 759 HD2 LYS 93 2HD LYS 93 6.487 -12.308 6.659 760 HD3 LYS 93 3HD LYS 93 4.730 -12.221 6.802 761 HE2 LYS 93 2HE LYS 93 5.364 -10.836 4.456 762 HE3 LYS 93 3HE LYS 93 6.381 -12.276 4.440 763 HZ1 LYS 93 3HZ LYS 93 3.691 -12.102 3.796 764 HZ2 LYS 93 1HZ LYS 93 3.767 -12.960 5.252 765 HZ3 LYS 93 2HZ LYS 93 4.634 -13.502 3.905 766 H ASP 94 H ASP 94 3.225 -7.296 8.163 767 HA ASP 94 HA ASP 94 0.731 -7.962 9.238 768 HB2 ASP 94 2HB ASP 94 2.193 -6.507 10.462 769 HB3 ASP 94 3HB ASP 94 2.211 -5.330 9.152 770 H GLN 95 H GLN 95 1.590 -5.689 6.658 771 HA GLN 95 HA GLN 95 -0.951 -4.606 6.231 772 HB2 GLN 95 2HB GLN 95 1.526 -4.876 4.598 773 HB3 GLN 95 3HB GLN 95 0.042 -4.417 3.773 774 HG2 GLN 95 2HG GLN 95 1.054 -2.968 6.198 775 HG3 GLN 95 3HG GLN 95 1.543 -2.541 4.559 776 HE21 GLN 95 1HE2 GLN 95 -0.507 -2.474 3.045 777 HE22 GLN 95 2HE2 GLN 95 -1.789 -1.484 3.646 778 H THR 96 H THR 96 0.634 -7.375 4.663 779 HA THR 96 HA THR 96 -1.539 -8.026 2.976 780 HB THR 96 HB THR 96 -0.405 -10.328 2.912 781 HG1 THR 96 HG1 THR 96 1.815 -9.047 4.064 782 HG21 THR 96 3HG2 THR 96 1.545 -9.415 1.623 783 HG22 THR 96 1HG2 THR 96 1.071 -7.805 2.163 784 HG23 THR 96 2HG2 THR 96 -0.020 -8.752 1.152 785 H ARG 97 H ARG 97 -0.616 -9.076 6.216 786 HA ARG 97 HA ARG 97 -2.454 -11.172 6.500 787 HB2 ARG 97 2HB ARG 97 -1.035 -9.377 8.440 788 HB3 ARG 97 3HB ARG 97 -2.245 -10.518 9.014 789 HG2 ARG 97 2HG ARG 97 -0.724 -12.128 7.456 790 HG3 ARG 97 3HG ARG 97 0.483 -10.983 8.046 791 HD2 ARG 97 2HD ARG 97 -1.453 -12.477 9.809 792 HD3 ARG 97 3HD ARG 97 0.197 -13.002 9.480 793 HE ARG 97 HE ARG 97 0.059 -10.324 10.484 794 HH11 ARG 97 1HH1 ARG 97 0.093 -13.689 11.376 795 HH12 ARG 97 2HH1 ARG 97 0.722 -13.397 12.963 796 HH21 ARG 97 1HH2 ARG 97 0.887 -9.926 12.572 797 HH22 ARG 97 2HH2 ARG 97 1.173 -11.256 13.643 798 H ARG 98 H ARG 98 -2.717 -7.815 7.683 799 HA ARG 98 HA ARG 98 -5.390 -8.029 8.527 800 HB2 ARG 98 2HB ARG 98 -3.792 -5.603 7.694 801 HB3 ARG 98 3HB ARG 98 -5.368 -5.533 8.471 802 HG2 ARG 98 2HG ARG 98 -4.169 -7.022 10.280 803 HG3 ARG 98 3HG ARG 98 -2.723 -6.270 9.602 804 HD2 ARG 98 2HD ARG 98 -3.513 -4.969 11.478 805 HD3 ARG 98 3HD ARG 98 -3.730 -4.054 9.986 806 HE ARG 98 HE ARG 98 -6.073 -5.517 10.675 807 HH11 ARG 98 1HH1 ARG 98 -4.259 -2.640 11.418 808 HH12 ARG 98 2HH1 ARG 98 -5.640 -1.758 11.981 809 HH21 ARG 98 1HH2 ARG 98 -7.899 -4.366 11.413 810 HH22 ARG 98 2HH2 ARG 98 -7.709 -2.741 11.978 811 H TYR 99 H TYR 99 -3.959 -7.057 5.454 812 HA TYR 99 HA TYR 99 -6.261 -6.078 4.205 813 HB2 TYR 99 2HB TYR 99 -4.113 -5.697 3.204 814 HB3 TYR 99 3HB TYR 99 -3.812 -7.425 3.058 815 HD1 TYR 99 HD1 TYR 99 -6.773 -5.340 2.143 816 HD2 TYR 99 HD2 TYR 99 -3.684 -7.943 0.808 817 HE1 TYR 99 HE1 TYR 99 -7.736 -5.311 -0.121 818 HE2 TYR 99 HE2 TYR 99 -4.637 -7.920 -1.460 819 HH TYR 99 HH TYR 99 -7.363 -7.355 -2.303 820 H LYS 100 H LYS 100 -4.942 -9.363 4.356 821 HA LYS 100 HA LYS 100 -7.078 -10.464 2.768 822 HB2 LYS 100 2HB LYS 100 -4.664 -11.526 4.152 823 HB3 LYS 100 3HB LYS 100 -5.971 -12.653 3.811 824 HG2 LYS 100 2HG LYS 100 -4.871 -10.888 1.659 825 HG3 LYS 100 3HG LYS 100 -4.069 -12.398 2.099 826 HD2 LYS 100 2HD LYS 100 -6.424 -13.443 1.814 827 HD3 LYS 100 3HD LYS 100 -6.784 -11.973 0.906 828 HE2 LYS 100 2HE LYS 100 -6.085 -13.566 -0.689 829 HE3 LYS 100 3HE LYS 100 -4.719 -12.475 -0.466 830 HZ1 LYS 100 3HZ LYS 100 -3.858 -14.654 -0.457 831 HZ2 LYS 100 1HZ LYS 100 -5.043 -15.215 0.613 832 HZ3 LYS 100 2HZ LYS 100 -3.845 -14.153 1.159 833 H GLU 101 H GLU 101 -6.458 -9.892 6.124 834 HA GLU 101 HA GLU 101 -8.438 -11.750 7.084 835 HB2 GLU 101 2HB GLU 101 -6.799 -9.591 8.394 836 HB3 GLU 101 3HB GLU 101 -8.055 -10.458 9.266 837 HG2 GLU 101 2HG GLU 101 -5.968 -12.015 7.830 838 HG3 GLU 101 3HG GLU 101 -5.559 -11.235 9.357 839 H SER 102 H SER 102 -9.978 -10.586 8.857 840 HA SER 102 HA SER 102 -11.889 -9.392 9.171 841 HB2 SER 102 2HB SER 102 -10.150 -7.495 8.827 842 HB3 SER 102 3HB SER 102 -10.895 -7.312 7.239 843 HG SER 102 HG SER 102 -11.784 -6.475 9.640 844 H SER 103 H SER 103 -11.866 -11.386 7.175 845 HA SER 103 HA SER 103 -13.264 -10.368 4.861 846 HB2 SER 103 2HB SER 103 -13.331 -12.686 4.121 847 HB3 SER 103 3HB SER 103 -11.712 -12.302 4.703 848 HG SER 103 HG SER 103 -13.068 -14.317 5.449 849 H ILE 104 H ILE 104 -15.196 -12.218 4.363 850 HA ILE 104 HA ILE 104 -17.300 -11.336 6.119 851 HB ILE 104 HB ILE 104 -17.568 -13.356 3.901 852 HG12 ILE 104 2HG1 ILE 104 -17.977 -10.401 3.532 853 HG13 ILE 104 3HG1 ILE 104 -16.391 -11.125 3.293 854 HG21 ILE 104 1HG2 ILE 104 -19.439 -11.577 5.411 855 HG22 ILE 104 2HG2 ILE 104 -19.844 -12.128 3.787 856 HG23 ILE 104 3HG2 ILE 104 -19.567 -13.302 5.072 857 HD11 ILE 104 3HD1 ILE 104 -16.979 -12.082 1.350 858 HD12 ILE 104 1HD1 ILE 104 -18.615 -12.447 1.898 859 HD13 ILE 104 2HD1 ILE 104 -18.211 -10.820 1.347 860 H GLN 105 H GLN 105 -18.842 -12.800 7.123 861 HA GLN 105 HA GLN 105 -17.742 -14.574 8.903 862 HB2 GLN 105 2HB GLN 105 -19.911 -15.161 9.521 863 HB3 GLN 105 3HB GLN 105 -20.120 -13.568 8.807 864 HG2 GLN 105 2HG GLN 105 -21.822 -14.641 7.775 865 HG3 GLN 105 3HG GLN 105 -20.536 -15.007 6.626 866 HE21 GLN 105 1HE2 GLN 105 -21.553 -16.335 9.759 867 HE22 GLN 105 2HE2 GLN 105 -21.634 -17.977 9.229 868 H ILE 106 H ILE 106 -18.156 -16.949 9.089 869 HA ILE 106 HA ILE 106 -17.780 -18.262 6.476 870 HB ILE 106 HB ILE 106 -16.664 -19.262 9.091 871 HG12 ILE 106 2HG1 ILE 106 -15.617 -17.124 8.628 872 HG13 ILE 106 3HG1 ILE 106 -14.472 -18.415 8.278 873 HG21 ILE 106 1HG2 ILE 106 -16.553 -21.098 7.782 874 HG22 ILE 106 2HG2 ILE 106 -16.632 -20.168 6.286 875 HG23 ILE 106 3HG2 ILE 106 -15.107 -20.301 7.162 876 HD11 ILE 106 3HD1 ILE 106 -15.874 -16.564 6.420 877 HD12 ILE 106 1HD1 ILE 106 -14.179 -17.048 6.470 878 HD13 ILE 106 2HD1 ILE 106 -15.397 -18.162 5.848 879 H GLY 107 H GLY 107 -18.668 -20.350 6.198 880 HA2 GLY 107 2HA GLY 107 -20.997 -20.830 7.924 881 HA3 GLY 107 3HA GLY 107 -20.799 -21.423 6.282 882 H ASN 108 H ASN 108 -21.028 -23.577 6.563 883 HA ASN 108 HA ASN 108 -19.815 -24.972 8.758 884 HB2 ASN 108 2HB ASN 108 -21.892 -25.827 7.906 885 HB3 ASN 108 3HB ASN 108 -21.242 -25.931 6.273 886 HD21 ASN 108 1HD2 ASN 108 -21.501 -27.436 9.343 887 HD22 ASN 108 2HD2 ASN 108 -20.678 -28.901 8.941 888 H GLY 109 H GLY 109 -17.852 -25.864 8.854 889 HA2 GLY 109 2HA GLY 109 -16.382 -26.257 6.324 890 HA3 GLY 109 3HA GLY 109 -15.622 -25.496 7.714 891 H HIS 110 H HIS 110 -15.631 -26.839 9.749 892 HA HIS 110 HA HIS 110 -14.294 -29.251 9.303 893 HB2 HIS 110 2HB HIS 110 -15.658 -28.190 11.782 894 HB3 HIS 110 3HB HIS 110 -14.656 -29.638 11.767 895 HD1 HIS 110 HD1 HIS 110 -12.392 -29.160 12.603 896 HD2 HIS 110 HD2 HIS 110 -13.976 -25.921 10.538 897 HE1 HIS 110 HE1 HIS 110 -10.615 -27.382 12.676 898 H GLY 111 H GLY 111 -15.327 -30.798 8.139 899 HA2 GLY 111 2HA GLY 111 -18.074 -31.516 8.736 900 HA3 GLY 111 3HA GLY 111 -17.059 -32.214 7.482 901 H GLN 112 H GLN 112 -15.296 -33.670 8.249 902 HA GLN 112 HA GLN 112 -15.521 -34.842 10.851 903 HB2 GLN 112 2HB GLN 112 -17.452 -35.769 9.323 904 HB3 GLN 112 3HB GLN 112 -16.165 -36.759 8.648 905 HG2 GLN 112 2HG GLN 112 -15.678 -37.338 11.137 906 HG3 GLN 112 3HG GLN 112 -17.332 -36.782 11.391 907 HE21 GLN 112 1HE2 GLN 112 -16.957 -39.270 12.057 908 HE22 GLN 112 2HE2 GLN 112 -17.572 -40.374 10.880 909 H SER 113 H SER 113 -13.518 -35.381 11.378 910 HA SER 113 HA SER 113 -11.522 -35.754 9.306 911 HB2 SER 113 2HB SER 113 -11.225 -35.736 12.320 912 HB3 SER 113 3HB SER 113 -9.903 -35.714 11.153 913 HG SER 113 HG SER 113 -10.125 -33.635 11.168 914 H GLN 114 H GLN 114 -9.819 -37.513 9.788 915 HA GLN 114 HA GLN 114 -11.268 -40.036 10.212 916 HB2 GLN 114 2HB GLN 114 -9.330 -41.041 8.934 917 HB3 GLN 114 3HB GLN 114 -10.380 -39.972 8.013 918 HG2 GLN 114 2HG GLN 114 -7.948 -38.837 9.293 919 HG3 GLN 114 3HG GLN 114 -7.773 -39.806 7.831 920 HE21 GLN 114 1HE2 GLN 114 -9.068 -39.143 5.964 921 HE22 GLN 114 2HE2 GLN 114 -9.366 -37.459 5.719 922 H GLY 115 H GLY 115 -8.600 -38.099 11.294 923 HA2 GLY 115 2HA GLY 115 -7.264 -38.291 13.155 924 HA3 GLY 115 3HA GLY 115 -8.326 -39.581 13.697 925 H LEU 116 H LEU 116 -5.956 -39.095 11.073 926 HA LEU 116 HA LEU 116 -4.799 -41.708 11.793 927 HB2 LEU 116 2HB LEU 116 -4.940 -40.400 9.081 928 HB3 LEU 116 3HB LEU 116 -4.123 -41.920 9.437 929 HG LEU 116 HG LEU 116 -7.091 -41.397 9.585 930 HD11 LEU 116 1HD1 LEU 116 -7.234 -42.167 7.506 931 HD12 LEU 116 2HD1 LEU 116 -6.179 -43.534 7.864 932 HD13 LEU 116 3HD1 LEU 116 -5.483 -41.981 7.401 933 HD21 LEU 116 3HD2 LEU 116 -7.143 -43.914 9.925 934 HD22 LEU 116 1HD2 LEU 116 -6.632 -42.938 11.303 935 HD23 LEU 116 2HD2 LEU 116 -5.431 -43.789 10.332 936 H GLU 117 H GLU 117 -4.073 -38.519 10.406 937 HA GLU 117 HA GLU 117 -1.243 -38.891 11.043 938 HB2 GLU 117 2HB GLU 117 -2.109 -37.975 8.798 939 HB3 GLU 117 3HB GLU 117 -2.437 -36.489 9.680 940 HG2 GLU 117 2HG GLU 117 -0.136 -36.190 10.193 941 HG3 GLU 117 3HG GLU 117 0.267 -37.797 9.592 942 H1 GLY -9 H GLY -9 7.779 -10.831 11.331 943 HA2 GLY -9 2HA GLY -9 6.449 -12.089 9.579 944 HA3 GLY -9 3HA GLY -9 8.090 -11.690 9.093 945 H LYS -8 H LYS -8 6.753 -13.777 7.910 946 HA LYS -8 HA LYS -8 7.493 -16.260 9.181 947 HB2 LYS -8 2HB LYS -8 6.493 -17.337 7.278 948 HB3 LYS -8 3HB LYS -8 5.446 -16.013 7.775 949 HG2 LYS -8 2HG LYS -8 6.197 -14.650 5.961 950 HG3 LYS -8 3HG LYS -8 7.440 -15.827 5.528 951 HD2 LYS -8 2HD LYS -8 5.756 -16.265 3.990 952 HD3 LYS -8 3HD LYS -8 5.455 -17.464 5.250 953 HE2 LYS -8 2HE LYS -8 4.107 -14.865 5.598 954 HE3 LYS -8 3HE LYS -8 3.561 -15.833 4.230 955 HZ1 LYS -8 3HZ LYS -8 3.842 -17.420 6.574 956 HZ2 LYS -8 1HZ LYS -8 2.486 -17.198 5.587 957 HZ3 LYS -8 2HZ LYS -8 2.797 -16.118 6.851 958 H PHE -7 H PHE -7 8.779 -14.130 6.736 959 HA PHE -7 HA PHE -7 10.684 -15.998 5.700 960 HB2 PHE -7 2HB PHE -7 10.337 -13.017 5.435 961 HB3 PHE -7 3HB PHE -7 11.715 -13.856 4.731 962 HD1 PHE -7 HD2 PHE -7 11.352 -15.552 2.962 963 HD2 PHE -7 HD1 PHE -7 8.195 -13.108 4.438 964 HE1 PHE -7 HE2 PHE -7 10.005 -16.098 0.977 965 HE2 PHE -7 HE1 PHE -7 6.843 -13.651 2.455 966 HZ PHE -7 HZ PHE -7 7.748 -15.147 0.721 967 H ILE -6 H ILE -6 11.398 -12.871 7.231 968 HA ILE -6 HA ILE -6 13.121 -12.208 8.569 969 HB ILE -6 HB ILE -6 12.879 -14.913 9.873 970 HG12 ILE -6 2HG1 ILE -6 10.627 -14.055 9.622 971 HG13 ILE -6 3HG1 ILE -6 11.122 -13.882 11.302 972 HG21 ILE -6 1HG2 ILE -6 14.249 -12.442 10.477 973 HG22 ILE -6 2HG2 ILE -6 13.154 -12.908 11.777 974 HG23 ILE -6 3HG2 ILE -6 14.402 -14.028 11.233 975 HD11 ILE -6 3HD1 ILE -6 11.851 -11.492 10.058 976 HD12 ILE -6 1HD1 ILE -6 10.247 -11.886 9.441 977 HD13 ILE -6 2HD1 ILE -6 10.517 -11.760 11.179 978 HA PRO -5 HA PRO -5 16.255 -14.593 6.135 979 HB2 PRO -5 2HB PRO -5 17.493 -12.388 5.147 980 HB3 PRO -5 3HB PRO -5 16.082 -13.123 4.377 981 HG2 PRO -5 2HG PRO -5 16.226 -10.741 6.184 982 HG3 PRO -5 3HG PRO -5 15.288 -10.961 4.696 983 HD2 PRO -5 2HD PRO -5 14.191 -11.204 7.159 984 HD3 PRO -5 3HD PRO -5 13.632 -12.153 5.767 985 H SER -4 H SER -4 17.216 -15.261 8.104 986 HA SER -4 HA SER -4 18.891 -13.368 9.542 987 HB2 SER -4 2HB SER -4 17.625 -14.912 10.900 988 HB3 SER -4 3HB SER -4 18.274 -16.292 10.015 989 HG SER -4 HG SER -4 19.822 -14.475 11.553 990 H ARG -3 H ARG -3 19.266 -14.965 6.769 991 HA ARG -3 HA ARG -3 21.593 -16.440 6.884 992 HB2 ARG -3 2HB ARG -3 20.139 -14.953 4.820 993 HB3 ARG -3 3HB ARG -3 21.864 -15.086 4.505 994 HG2 ARG -3 2HG ARG -3 20.565 -16.892 3.467 995 HG3 ARG -3 3HG ARG -3 21.745 -17.492 4.635 996 HD2 ARG -3 2HD ARG -3 20.159 -18.302 6.006 997 HD3 ARG -3 3HD ARG -3 19.100 -16.914 5.760 998 HE ARG -3 HE ARG -3 19.053 -19.412 4.328 999 HH11 ARG -3 1HH1 ARG -3 18.175 -16.044 4.273 1000 HH12 ARG -3 2HH1 ARG -3 16.897 -16.261 3.125 1001 HH21 ARG -3 1HH2 ARG -3 17.372 -19.711 2.815 1002 HH22 ARG -3 2HH2 ARG -3 16.440 -18.348 2.297 1003 HA PRO -2 HA PRO -2 24.958 -13.757 7.731 1004 HB2 PRO -2 2HB PRO -2 26.864 -14.611 5.996 1005 HB3 PRO -2 3HB PRO -2 26.358 -15.550 7.405 1006 HG2 PRO -2 2HG PRO -2 25.535 -15.840 4.542 1007 HG3 PRO -2 3HG PRO -2 25.951 -17.099 5.719 1008 HD2 PRO -2 2HD PRO -2 23.391 -16.476 5.095 1009 HD3 PRO -2 3HD PRO -2 23.871 -17.036 6.710 1010 H ALA -1 H ALA -1 23.599 -13.799 4.569 1011 HA ALA -1 HA ALA -1 23.412 -12.213 2.947 1012 HB1 ALA -1 1HB ALA -1 23.450 -9.962 3.550 1013 HB2 ALA -1 2HB ALA -1 23.047 -10.790 5.054 1014 HB3 ALA -1 3HB ALA -1 24.691 -10.214 4.778 1015 HA PRO 0 HA PRO 0 27.849 -12.854 1.848 1016 HB2 PRO 0 2HB PRO 0 27.313 -13.952 -0.576 1017 HB3 PRO 0 3HB PRO 0 27.351 -14.895 0.919 1018 HG2 PRO 0 2HG PRO 0 24.997 -13.792 -0.566 1019 HG3 PRO 0 3HG PRO 0 25.200 -15.386 0.184 1020 HD2 PRO 0 2HD PRO 0 23.814 -13.385 1.369 1021 HD3 PRO 0 3HD PRO 0 24.727 -14.592 2.296 1022 H LYS 1 H LYS 1 29.111 -11.756 0.313 1023 HA LYS 1 HA LYS 1 27.790 -9.432 -0.859 1024 HB2 LYS 1 2HB LYS 1 30.616 -10.121 -0.152 1025 HB3 LYS 1 3HB LYS 1 30.311 -8.865 -1.344 1026 HG2 LYS 1 2HG LYS 1 30.535 -7.733 0.687 1027 HG3 LYS 1 3HG LYS 1 28.795 -7.798 0.396 1028 HD2 LYS 1 2HD LYS 1 28.468 -9.450 2.018 1029 HD3 LYS 1 3HD LYS 1 30.176 -9.893 2.041 1030 HE2 LYS 1 2HE LYS 1 29.497 -8.629 4.045 1031 HE3 LYS 1 3HE LYS 1 30.742 -7.800 3.111 1032 HZ1 LYS 1 3HZ LYS 1 29.261 -6.209 2.387 1033 HZ2 LYS 1 1HZ LYS 1 28.719 -6.480 3.967 1034 HZ3 LYS 1 2HZ LYS 1 27.900 -7.175 2.661 1035 HA PRO 2 HA PRO 2 28.040 -10.741 -5.040 1036 HB2 PRO 2 2HB PRO 2 28.735 -8.451 -6.321 1037 HB3 PRO 2 3HB PRO 2 27.131 -8.714 -5.627 1038 HG2 PRO 2 2HG PRO 2 29.456 -7.198 -4.504 1039 HG3 PRO 2 3HG PRO 2 27.737 -6.762 -4.519 1040 HD2 PRO 2 2HD PRO 2 28.958 -7.800 -2.336 1041 HD3 PRO 2 3HD PRO 2 27.251 -8.108 -2.712 1042 HA PRO 3 HA PRO 3 32.133 -11.740 -6.298 1043 HB2 PRO 3 2HB PRO 3 31.957 -11.657 -9.005 1044 HB3 PRO 3 3HB PRO 3 31.213 -12.931 -8.033 1045 HG2 PRO 3 2HG PRO 3 29.966 -10.484 -9.224 1046 HG3 PRO 3 3HG PRO 3 29.343 -12.144 -9.170 1047 HD2 PRO 3 2HD PRO 3 28.509 -10.218 -7.458 1048 HD3 PRO 3 3HD PRO 3 28.605 -11.930 -6.997 1049 H SER 4 H SER 4 30.742 -8.789 -7.581 1050 HA SER 4 HA SER 4 33.430 -7.745 -8.146 1051 HB2 SER 4 2HB SER 4 31.840 -7.572 -10.002 1052 HB3 SER 4 3HB SER 4 30.716 -6.685 -8.972 1053 HG SER 4 HG SER 4 31.827 -5.156 -10.085 1054 H SER 5 H SER 5 34.181 -7.073 -6.191 1055 HA SER 5 HA SER 5 32.493 -5.280 -4.596 1056 HB2 SER 5 2HB SER 5 34.290 -5.623 -2.844 1057 HB3 SER 5 3HB SER 5 33.383 -7.071 -3.282 1058 HG SER 5 HG SER 5 35.140 -7.927 -4.070 1059 H ALA 6 H ALA 6 33.207 -3.243 -3.952 1060 HA ALA 6 HA ALA 6 35.136 -2.027 -5.766 1061 HB1 ALA 6 1HB ALA 6 33.456 -0.537 -5.744 1062 HB2 ALA 6 2HB ALA 6 32.853 -1.085 -4.179 1063 HB3 ALA 6 3HB ALA 6 34.218 0.029 -4.257 Start of MODEL 3 1 H1 MET -2 H MET -2 -0.619 -7.446 -4.904 2 HA MET -2 HA MET -2 1.705 -5.962 -5.714 3 HB2 MET -2 2HB MET -2 3.364 -7.402 -4.674 4 HB3 MET -2 3HB MET -2 2.357 -6.656 -3.440 5 HG2 MET -2 2HG MET -2 1.242 -8.648 -2.974 6 HG3 MET -2 3HG MET -2 1.758 -9.395 -4.484 7 HE1 MET -2 3HE MET -2 4.163 -9.313 -5.097 8 HE2 MET -2 1HE MET -2 5.496 -9.016 -3.980 9 HE3 MET -2 2HE MET -2 4.942 -10.664 -4.272 10 H ALA -1 H ALA -1 3.120 -7.249 -7.146 11 HA ALA -1 HA ALA -1 1.560 -9.330 -8.527 12 HB1 ALA -1 1HB ALA -1 2.976 -7.009 -9.476 13 HB2 ALA -1 2HB ALA -1 3.590 -8.475 -10.241 14 HB3 ALA -1 3HB ALA -1 1.873 -8.082 -10.338 15 HA PRO 1 HA PRO 1 4.640 -12.377 -7.832 16 HB2 PRO 1 2HB PRO 1 4.693 -13.703 -10.200 17 HB3 PRO 1 3HB PRO 1 3.348 -13.826 -9.061 18 HG2 PRO 1 2HG PRO 1 3.591 -12.154 -11.532 19 HG3 PRO 1 3HG PRO 1 2.209 -13.106 -10.956 20 HD2 PRO 1 2HD PRO 1 2.368 -10.423 -10.628 21 HD3 PRO 1 3HD PRO 1 1.554 -11.481 -9.458 22 H LEU 2 H LEU 2 6.522 -11.139 -7.581 23 HA LEU 2 HA LEU 2 8.113 -10.670 -10.008 24 HB2 LEU 2 2HB LEU 2 9.337 -9.043 -8.798 25 HB3 LEU 2 3HB LEU 2 7.628 -8.752 -8.480 26 HG LEU 2 HG LEU 2 8.440 -10.394 -6.393 27 HD11 LEU 2 1HD1 LEU 2 10.602 -8.449 -7.142 28 HD12 LEU 2 2HD1 LEU 2 10.746 -10.167 -6.770 29 HD13 LEU 2 3HD1 LEU 2 10.373 -9.016 -5.487 30 HD21 LEU 2 3HD2 LEU 2 6.884 -8.627 -6.099 31 HD22 LEU 2 1HD2 LEU 2 8.058 -7.416 -6.614 32 HD23 LEU 2 2HD2 LEU 2 8.273 -8.254 -5.077 33 H PHE 3 H PHE 3 10.080 -11.600 -10.291 34 HA PHE 3 HA PHE 3 10.979 -13.466 -8.194 35 HB2 PHE 3 2HB PHE 3 11.047 -13.748 -11.198 36 HB3 PHE 3 3HB PHE 3 11.980 -14.782 -10.121 37 HD1 PHE 3 HD1 PHE 3 8.481 -13.584 -10.598 38 HD2 PHE 3 HD2 PHE 3 11.056 -16.777 -9.461 39 HE1 PHE 3 HE1 PHE 3 6.529 -15.059 -10.334 40 HE2 PHE 3 HE2 PHE 3 9.109 -18.257 -9.196 41 HZ PHE 3 HZ PHE 3 6.842 -17.399 -9.634 42 H ALA 4 H ALA 4 13.239 -13.761 -7.940 43 HA ALA 4 HA ALA 4 14.863 -11.561 -9.045 44 HB1 ALA 4 1HB ALA 4 15.160 -10.899 -6.942 45 HB2 ALA 4 2HB ALA 4 14.393 -12.354 -6.304 46 HB3 ALA 4 3HB ALA 4 16.112 -12.364 -6.699 47 H VAL 5 H VAL 5 17.214 -12.029 -9.113 48 HA VAL 5 HA VAL 5 17.807 -14.888 -9.457 49 HB VAL 5 HB VAL 5 17.404 -14.065 -11.687 50 HG11 VAL 5 1HG1 VAL 5 17.816 -11.655 -11.085 51 HG12 VAL 5 2HG1 VAL 5 19.541 -11.990 -11.252 52 HG13 VAL 5 3HG1 VAL 5 18.468 -12.171 -12.640 53 HG21 VAL 5 3HG2 VAL 5 20.326 -14.006 -11.835 54 HG22 VAL 5 1HG2 VAL 5 19.679 -15.345 -10.886 55 HG23 VAL 5 2HG2 VAL 5 19.175 -15.127 -12.562 56 H THR 6 H THR 6 19.468 -15.429 -8.222 57 HA THR 6 HA THR 6 21.112 -13.537 -6.907 58 HB THR 6 HB THR 6 22.508 -15.905 -6.719 59 HG1 THR 6 HG1 THR 6 20.830 -16.950 -7.938 60 HG21 THR 6 3HG2 THR 6 22.114 -15.325 -4.604 61 HG22 THR 6 1HG2 THR 6 20.492 -16.001 -4.753 62 HG23 THR 6 2HG2 THR 6 20.772 -14.294 -5.101 63 H LEU 7 H LEU 7 23.160 -12.838 -7.305 64 HA LEU 7 HA LEU 7 24.280 -13.533 -9.932 65 HB2 LEU 7 2HB LEU 7 24.941 -11.146 -8.220 66 HB3 LEU 7 3HB LEU 7 25.406 -11.419 -9.898 67 HG LEU 7 HG LEU 7 22.508 -11.254 -9.207 68 HD11 LEU 7 1HD1 LEU 7 23.140 -8.695 -9.945 69 HD12 LEU 7 2HD1 LEU 7 24.456 -9.113 -8.849 70 HD13 LEU 7 3HD1 LEU 7 22.783 -9.231 -8.303 71 HD21 LEU 7 3HD2 LEU 7 23.798 -11.712 -11.519 72 HD22 LEU 7 1HD2 LEU 7 23.697 -9.952 -11.572 73 HD23 LEU 7 2HD2 LEU 7 22.227 -10.915 -11.422 74 H TYR 8 H TYR 8 24.798 -13.796 -6.569 75 HA TYR 8 HA TYR 8 27.430 -14.980 -7.070 76 HB2 TYR 8 2HB TYR 8 26.851 -13.030 -4.831 77 HB3 TYR 8 3HB TYR 8 28.360 -13.906 -5.064 78 HD1 TYR 8 HD1 TYR 8 26.126 -11.389 -6.640 79 HD2 TYR 8 HD2 TYR 8 30.045 -13.033 -6.445 80 HE1 TYR 8 HE1 TYR 8 26.956 -9.563 -8.064 81 HE2 TYR 8 HE2 TYR 8 30.886 -11.211 -7.866 82 HH TYR 8 HH TYR 8 28.761 -9.009 -9.480 83 H GLU 9 H GLU 9 28.174 -16.327 -5.220 84 HA GLU 9 HA GLU 9 25.994 -17.975 -4.306 85 HB2 GLU 9 2HB GLU 9 28.091 -18.980 -5.099 86 HB3 GLU 9 3HB GLU 9 28.965 -18.194 -3.792 87 HG2 GLU 9 2HG GLU 9 28.691 -20.213 -2.830 88 HG3 GLU 9 3HG GLU 9 27.160 -19.492 -2.336 89 H PHE 10 H PHE 10 24.865 -17.469 -2.558 90 HA PHE 10 HA PHE 10 26.142 -15.953 -0.403 91 HB2 PHE 10 2HB PHE 10 23.940 -15.218 -1.429 92 HB3 PHE 10 3HB PHE 10 23.211 -16.628 -0.668 93 HD1 PHE 10 HD1 PHE 10 25.585 -13.948 0.399 94 HD2 PHE 10 HD2 PHE 10 22.019 -16.125 1.215 95 HE1 PHE 10 HE1 PHE 10 25.280 -12.663 2.475 96 HE2 PHE 10 HE2 PHE 10 21.708 -14.843 3.292 97 HZ PHE 10 HZ PHE 10 23.339 -13.108 3.924 98 H LYS 11 H LYS 11 27.048 -17.133 1.142 99 HA LYS 11 HA LYS 11 26.166 -19.824 1.705 100 HB2 LYS 11 2HB LYS 11 28.232 -18.201 3.193 101 HB3 LYS 11 3HB LYS 11 28.048 -19.950 3.195 102 HG2 LYS 11 2HG LYS 11 29.681 -19.895 1.669 103 HG3 LYS 11 3HG LYS 11 28.385 -19.470 0.549 104 HD2 LYS 11 2HD LYS 11 28.943 -17.214 0.564 105 HD3 LYS 11 3HD LYS 11 29.818 -17.340 2.092 106 HE2 LYS 11 2HE LYS 11 30.813 -18.884 -0.251 107 HE3 LYS 11 3HE LYS 11 31.084 -17.143 -0.218 108 HZ1 LYS 11 3HZ LYS 11 32.464 -19.169 1.175 109 HZ2 LYS 11 1HZ LYS 11 31.759 -18.112 2.293 110 HZ3 LYS 11 2HZ LYS 11 32.803 -17.513 1.104 111 H ALA 12 H ALA 12 24.623 -20.329 3.102 112 HA ALA 12 HA ALA 12 23.444 -18.362 4.815 113 HB1 ALA 12 1HB ALA 12 22.019 -20.280 5.569 114 HB2 ALA 12 2HB ALA 12 21.994 -19.973 3.832 115 HB3 ALA 12 3HB ALA 12 22.944 -21.312 4.477 116 H GLU 13 H GLU 13 23.197 -18.561 7.127 117 HA GLU 13 HA GLU 13 25.425 -19.994 8.417 118 HB2 GLU 13 2HB GLU 13 25.496 -18.116 10.069 119 HB3 GLU 13 3HB GLU 13 25.987 -17.666 8.442 120 HG2 GLU 13 2HG GLU 13 23.819 -16.659 8.038 121 HG3 GLU 13 3HG GLU 13 23.273 -17.158 9.638 122 H ARG 14 H ARG 14 22.138 -18.763 8.704 123 HA ARG 14 HA ARG 14 21.667 -20.732 10.840 124 HB2 ARG 14 2HB ARG 14 20.581 -17.916 10.676 125 HB3 ARG 14 3HB ARG 14 20.022 -19.129 11.820 126 HG2 ARG 14 2HG ARG 14 22.884 -18.226 11.659 127 HG3 ARG 14 3HG ARG 14 21.683 -17.464 12.704 128 HD2 ARG 14 2HD ARG 14 21.348 -19.501 13.913 129 HD3 ARG 14 3HD ARG 14 22.339 -20.404 12.768 130 HE ARG 14 HE ARG 14 23.878 -18.340 13.893 131 HH11 ARG 14 1HH1 ARG 14 22.394 -21.366 14.765 132 HH12 ARG 14 2HH1 ARG 14 23.553 -21.728 16.001 133 HH21 ARG 14 1HH2 ARG 14 25.410 -18.805 15.517 134 HH22 ARG 14 2HH2 ARG 14 25.268 -20.270 16.429 135 H ASP 15 H ASP 15 19.110 -20.859 11.145 136 HA ASP 15 HA ASP 15 18.094 -22.154 8.905 137 HB2 ASP 15 2HB ASP 15 17.303 -22.317 11.327 138 HB3 ASP 15 3HB ASP 15 16.362 -20.862 11.009 139 H ASP 16 H ASP 16 17.524 -18.846 10.044 140 HA ASP 16 HA ASP 16 15.593 -18.066 8.213 141 HB2 ASP 16 2HB ASP 16 17.773 -16.538 9.619 142 HB3 ASP 16 3HB ASP 16 16.653 -15.736 8.522 143 H GLU 17 H GLU 17 19.131 -17.748 7.927 144 HA GLU 17 HA GLU 17 19.153 -16.639 5.355 145 HB2 GLU 17 2HB GLU 17 21.055 -17.213 7.223 146 HB3 GLU 17 3HB GLU 17 21.398 -18.431 6.003 147 HG2 GLU 17 2HG GLU 17 22.756 -16.592 5.479 148 HG3 GLU 17 3HG GLU 17 21.431 -16.556 4.317 149 H LEU 18 H LEU 18 19.489 -17.545 3.312 150 HA LEU 18 HA LEU 18 19.013 -20.441 3.099 151 HB2 LEU 18 2HB LEU 18 16.982 -19.026 2.618 152 HB3 LEU 18 3HB LEU 18 17.857 -18.387 1.228 153 HG LEU 18 HG LEU 18 18.015 -21.107 0.849 154 HD11 LEU 18 1HD1 LEU 18 15.143 -20.875 1.278 155 HD12 LEU 18 2HD1 LEU 18 16.077 -20.848 2.773 156 HD13 LEU 18 3HD1 LEU 18 16.245 -22.200 1.653 157 HD21 LEU 18 3HD2 LEU 18 16.621 -20.727 -1.015 158 HD22 LEU 18 1HD2 LEU 18 17.473 -19.208 -0.740 159 HD23 LEU 18 2HD2 LEU 18 15.796 -19.383 -0.224 160 H ASP 19 H ASP 19 20.597 -21.422 2.047 161 HA ASP 19 HA ASP 19 22.674 -20.023 0.731 162 HB2 ASP 19 2HB ASP 19 23.530 -22.237 0.134 163 HB3 ASP 19 3HB ASP 19 23.023 -22.199 1.820 164 H VAL 20 H VAL 20 23.060 -19.611 -1.385 165 HA VAL 20 HA VAL 20 21.417 -20.798 -3.457 166 HB VAL 20 HB VAL 20 20.011 -18.932 -2.778 167 HG11 VAL 20 1HG1 VAL 20 20.742 -16.653 -2.823 168 HG12 VAL 20 2HG1 VAL 20 21.864 -17.567 -1.813 169 HG13 VAL 20 3HG1 VAL 20 22.320 -17.118 -3.457 170 HG21 VAL 20 3HG2 VAL 20 20.177 -19.549 -5.171 171 HG22 VAL 20 1HG2 VAL 20 19.760 -17.854 -4.921 172 HG23 VAL 20 2HG2 VAL 20 21.404 -18.300 -5.378 173 H SER 21 H SER 21 22.320 -20.655 -5.506 174 HA SER 21 HA SER 21 25.093 -19.690 -5.548 175 HB2 SER 21 2HB SER 21 23.643 -21.898 -6.935 176 HB3 SER 21 3HB SER 21 24.999 -21.145 -7.773 177 HG SER 21 HG SER 21 25.302 -23.036 -6.185 178 HA PRO 22 HA PRO 22 24.303 -16.541 -8.497 179 HB2 PRO 22 2HB PRO 22 26.461 -16.717 -10.135 180 HB3 PRO 22 3HB PRO 22 26.557 -16.094 -8.483 181 HG2 PRO 22 2HG PRO 22 27.236 -18.818 -9.523 182 HG3 PRO 22 3HG PRO 22 28.120 -17.812 -8.361 183 HD2 PRO 22 2HD PRO 22 26.527 -19.864 -7.597 184 HD3 PRO 22 3HD PRO 22 26.741 -18.404 -6.611 185 H GLY 23 H GLY 23 22.714 -16.664 -9.954 186 HA2 GLY 23 2HA GLY 23 22.178 -16.948 -12.302 187 HA3 GLY 23 3HA GLY 23 23.103 -18.441 -12.276 188 H GLU 24 H GLU 24 21.357 -18.235 -9.456 189 HA GLU 24 HA GLU 24 19.418 -20.167 -10.459 190 HB2 GLU 24 2HB GLU 24 20.445 -19.409 -7.757 191 HB3 GLU 24 3HB GLU 24 18.872 -20.185 -7.879 192 HG2 GLU 24 2HG GLU 24 21.368 -21.337 -9.089 193 HG3 GLU 24 3HG GLU 24 20.822 -21.708 -7.455 194 H ASN 25 H ASN 25 17.158 -20.016 -9.884 195 HA ASN 25 HA ASN 25 16.238 -17.226 -9.862 196 HB2 ASN 25 2HB ASN 25 14.758 -19.726 -10.713 197 HB3 ASN 25 3HB ASN 25 14.155 -18.076 -10.839 198 HD21 ASN 25 1HD2 ASN 25 14.266 -17.294 -12.801 199 HD22 ASN 25 2HD2 ASN 25 15.477 -17.653 -13.981 200 H LEU 26 H LEU 26 14.990 -16.455 -8.259 201 HA LEU 26 HA LEU 26 13.866 -18.350 -6.316 202 HB2 LEU 26 2HB LEU 26 15.328 -15.813 -5.601 203 HB3 LEU 26 3HB LEU 26 14.571 -16.937 -4.473 204 HG LEU 26 HG LEU 26 16.292 -18.614 -5.652 205 HD11 LEU 26 1HD1 LEU 26 18.057 -16.245 -5.492 206 HD12 LEU 26 2HD1 LEU 26 17.049 -16.400 -6.931 207 HD13 LEU 26 3HD1 LEU 26 18.176 -17.687 -6.501 208 HD21 LEU 26 3HD2 LEU 26 16.407 -16.872 -3.271 209 HD22 LEU 26 1HD2 LEU 26 17.919 -17.640 -3.754 210 HD23 LEU 26 2HD2 LEU 26 16.501 -18.629 -3.402 211 H SER 27 H SER 27 12.007 -17.641 -5.221 212 HA SER 27 HA SER 27 10.602 -15.464 -6.595 213 HB2 SER 27 2HB SER 27 9.700 -17.915 -6.314 214 HB3 SER 27 3HB SER 27 9.252 -17.356 -4.702 215 HG SER 27 HG SER 27 8.218 -15.544 -5.884 216 H ILE 28 H ILE 28 10.690 -13.560 -5.615 217 HA ILE 28 HA ILE 28 11.247 -13.300 -2.812 218 HB ILE 28 HB ILE 28 10.419 -11.151 -4.764 219 HG12 ILE 28 2HG1 ILE 28 13.203 -11.987 -3.928 220 HG13 ILE 28 3HG1 ILE 28 12.454 -12.408 -5.465 221 HG21 ILE 28 1HG2 ILE 28 10.221 -10.047 -2.799 222 HG22 ILE 28 2HG2 ILE 28 11.285 -11.161 -1.941 223 HG23 ILE 28 3HG2 ILE 28 11.970 -9.905 -2.972 224 HD11 ILE 28 3HD1 ILE 28 12.423 -9.550 -4.884 225 HD12 ILE 28 1HD1 ILE 28 14.039 -10.242 -5.019 226 HD13 ILE 28 2HD1 ILE 28 12.893 -10.410 -6.349 227 H CYS 29 H CYS 29 9.909 -12.341 -1.233 228 HA CYS 29 HA CYS 29 7.033 -12.361 -1.866 229 HB2 CYS 29 2HB CYS 29 8.244 -13.268 0.750 230 HB3 CYS 29 3HB CYS 29 6.552 -13.359 0.277 231 HG CYS 29 HG CYS 29 8.954 -15.550 -0.186 232 H ALA 30 H ALA 30 9.630 -11.035 0.100 233 HA ALA 30 HA ALA 30 8.275 -8.498 0.250 234 HB1 ALA 30 1HB ALA 30 7.269 -8.843 2.206 235 HB2 ALA 30 2HB ALA 30 8.133 -10.358 2.470 236 HB3 ALA 30 3HB ALA 30 8.877 -8.826 2.930 237 H HIS 31 H HIS 31 9.660 -7.030 1.857 238 HA HIS 31 HA HIS 31 12.507 -7.655 1.479 239 HB2 HIS 31 2HB HIS 31 12.991 -5.477 0.647 240 HB3 HIS 31 3HB HIS 31 11.626 -6.074 -0.292 241 HD1 HIS 31 HD1 HIS 31 12.671 -3.050 0.948 242 HD2 HIS 31 HD2 HIS 31 9.107 -5.140 1.386 243 HE1 HIS 31 HE1 HIS 31 10.954 -1.325 1.580 244 H TYR 32 H TYR 32 13.820 -5.798 2.675 245 HA TYR 32 HA TYR 32 12.522 -5.163 5.226 246 HB2 TYR 32 2HB TYR 32 13.825 -7.310 5.421 247 HB3 TYR 32 3HB TYR 32 15.280 -6.387 5.061 248 HD1 TYR 32 HD1 TYR 32 12.546 -6.821 7.514 249 HD2 TYR 32 HD2 TYR 32 16.356 -5.094 6.735 250 HE1 TYR 32 HE1 TYR 32 12.777 -6.268 9.899 251 HE2 TYR 32 HE2 TYR 32 16.597 -4.537 9.118 252 HH TYR 32 HH TYR 32 14.108 -4.490 11.256 253 H ASP 33 H ASP 33 12.510 -2.990 4.945 254 HA ASP 33 HA ASP 33 13.261 -0.850 4.727 255 HB2 ASP 33 2HB ASP 33 14.448 -1.594 6.811 256 HB3 ASP 33 3HB ASP 33 15.852 -1.964 5.814 257 H TYR 34 H TYR 34 13.700 -2.747 2.490 258 HA TYR 34 HA TYR 34 14.609 -2.722 0.405 259 HB2 TYR 34 2HB TYR 34 15.722 -0.003 1.101 260 HB3 TYR 34 3HB TYR 34 15.370 -0.640 -0.501 261 HD1 TYR 34 HD1 TYR 34 13.916 0.751 2.569 262 HD2 TYR 34 HD2 TYR 34 13.113 -0.664 -1.362 263 HE1 TYR 34 HE1 TYR 34 11.667 1.742 2.678 264 HE2 TYR 34 HE2 TYR 34 10.863 0.324 -1.265 265 HH TYR 34 HH TYR 34 9.250 0.994 1.105 266 H GLU 35 H GLU 35 16.141 -3.636 2.785 267 HA GLU 35 HA GLU 35 18.866 -3.351 1.701 268 HB2 GLU 35 2HB GLU 35 18.298 -4.283 4.495 269 HB3 GLU 35 3HB GLU 35 19.756 -3.543 3.851 270 HG2 GLU 35 2HG GLU 35 17.131 -2.148 4.320 271 HG3 GLU 35 3HG GLU 35 18.566 -2.031 5.337 272 H TRP 36 H TRP 36 16.516 -5.605 3.065 273 HA TRP 36 HA TRP 36 18.065 -7.813 1.876 274 HB2 TRP 36 2HB TRP 36 16.354 -7.919 4.371 275 HB3 TRP 36 3HB TRP 36 17.225 -9.274 3.660 276 HD1 TRP 36 HD1 TRP 36 17.745 -6.167 5.791 277 HE1 TRP 36 HE1 TRP 36 20.128 -6.209 6.763 278 HE3 TRP 36 HE3 TRP 36 19.626 -10.124 3.156 279 HZ2 TRP 36 HZ2 TRP 36 22.493 -7.719 6.453 280 HZ3 TRP 36 HZ3 TRP 36 21.958 -10.803 3.552 281 HH2 TRP 36 HH2 TRP 36 23.360 -9.624 5.166 282 H PHE 37 H PHE 37 16.827 -9.611 1.076 283 HA PHE 37 HA PHE 37 14.020 -8.958 0.478 284 HB2 PHE 37 2HB PHE 37 16.246 -9.541 -1.372 285 HB3 PHE 37 3HB PHE 37 14.745 -10.398 -1.710 286 HD1 PHE 37 HD1 PHE 37 12.619 -8.653 -1.281 287 HD2 PHE 37 HD2 PHE 37 16.522 -7.692 -2.682 288 HE1 PHE 37 HE1 PHE 37 11.724 -6.647 -2.389 289 HE2 PHE 37 HE2 PHE 37 15.633 -5.684 -3.792 290 HZ PHE 37 HZ PHE 37 13.231 -5.159 -3.646 291 H ILE 38 H ILE 38 12.601 -10.541 0.868 292 HA ILE 38 HA ILE 38 13.623 -13.092 1.836 293 HB ILE 38 HB ILE 38 10.740 -12.222 1.780 294 HG12 ILE 38 2HG1 ILE 38 12.080 -10.510 2.939 295 HG13 ILE 38 3HG1 ILE 38 11.044 -11.387 4.059 296 HG21 ILE 38 1HG2 ILE 38 12.101 -14.577 2.610 297 HG22 ILE 38 2HG2 ILE 38 11.426 -13.789 4.034 298 HG23 ILE 38 3HG2 ILE 38 10.377 -14.215 2.683 299 HD11 ILE 38 3HD1 ILE 38 12.864 -12.601 4.936 300 HD12 ILE 38 1HD1 ILE 38 13.933 -12.080 3.633 301 HD13 ILE 38 2HD1 ILE 38 13.384 -10.919 4.843 302 H ALA 39 H ALA 39 14.201 -14.235 0.017 303 HA ALA 39 HA ALA 39 12.023 -14.854 -1.872 304 HB1 ALA 39 1HB ALA 39 14.999 -14.849 -2.358 305 HB2 ALA 39 2HB ALA 39 13.780 -15.366 -3.524 306 HB3 ALA 39 3HB ALA 39 13.827 -13.688 -2.982 307 H LYS 40 H LYS 40 11.967 -17.030 -2.721 308 HA LYS 40 HA LYS 40 13.190 -19.011 -0.914 309 HB2 LYS 40 2HB LYS 40 11.097 -20.399 -1.447 310 HB3 LYS 40 3HB LYS 40 10.920 -19.057 -0.325 311 HG2 LYS 40 2HG LYS 40 10.007 -17.672 -2.115 312 HG3 LYS 40 3HG LYS 40 10.192 -19.014 -3.247 313 HD2 LYS 40 2HD LYS 40 8.766 -20.277 -1.403 314 HD3 LYS 40 3HD LYS 40 8.230 -18.634 -1.044 315 HE2 LYS 40 2HE LYS 40 6.697 -19.550 -2.616 316 HE3 LYS 40 3HE LYS 40 7.693 -18.380 -3.480 317 HZ1 LYS 40 3HZ LYS 40 8.601 -19.970 -4.755 318 HZ2 LYS 40 1HZ LYS 40 7.229 -20.866 -4.333 319 HZ3 LYS 40 2HZ LYS 40 8.682 -21.103 -3.501 320 HA PRO 41 HA PRO 41 14.787 -21.090 -4.434 321 HB2 PRO 41 2HB PRO 41 14.611 -23.688 -3.667 322 HB3 PRO 41 3HB PRO 41 15.784 -22.561 -2.977 323 HG2 PRO 41 2HG PRO 41 13.150 -23.461 -1.877 324 HG3 PRO 41 3HG PRO 41 14.699 -23.252 -1.040 325 HD2 PRO 41 2HD PRO 41 12.715 -21.414 -0.913 326 HD3 PRO 41 3HD PRO 41 14.433 -20.970 -0.852 327 H ILE 42 H ILE 42 13.911 -21.462 -6.365 328 HA ILE 42 HA ILE 42 11.148 -22.303 -6.575 329 HB ILE 42 HB ILE 42 13.102 -21.656 -8.785 330 HG12 ILE 42 2HG1 ILE 42 10.998 -19.882 -7.529 331 HG13 ILE 42 3HG1 ILE 42 12.722 -19.777 -7.187 332 HG21 ILE 42 1HG2 ILE 42 11.482 -22.119 -10.238 333 HG22 ILE 42 2HG2 ILE 42 10.611 -22.872 -8.904 334 HG23 ILE 42 3HG2 ILE 42 10.300 -21.187 -9.320 335 HD11 ILE 42 3HD1 ILE 42 12.745 -18.248 -8.804 336 HD12 ILE 42 1HD1 ILE 42 12.673 -19.621 -9.908 337 HD13 ILE 42 2HD1 ILE 42 11.193 -18.774 -9.455 338 H ASN 43 H ASN 43 14.333 -23.505 -7.569 339 HA ASN 43 HA ASN 43 13.149 -25.985 -8.536 340 HB2 ASN 43 2HB ASN 43 16.067 -25.193 -8.447 341 HB3 ASN 43 3HB ASN 43 15.361 -26.524 -9.358 342 HD21 ASN 43 1HD2 ASN 43 13.433 -25.699 -10.775 343 HD22 ASN 43 2HD2 ASN 43 13.809 -24.324 -11.752 344 H ARG 43 H ARG 43 15.497 -24.926 -6.086 345 HA ARG 43 HA ARG 43 15.923 -27.491 -4.976 346 HB2 ARG 43 2HB ARG 43 16.201 -24.886 -3.485 347 HB3 ARG 43 3HB ARG 43 17.086 -26.383 -3.225 348 HG2 ARG 43 2HG ARG 43 17.765 -25.868 -5.780 349 HG3 ARG 43 3HG ARG 43 17.539 -24.227 -5.171 350 HD2 ARG 43 2HD ARG 43 19.845 -24.895 -4.885 351 HD3 ARG 43 3HD ARG 43 19.070 -24.734 -3.310 352 HE ARG 43 HE ARG 43 18.837 -27.395 -4.071 353 HH11 ARG 43 1HH1 ARG 43 21.362 -25.121 -3.315 354 HH12 ARG 43 2HH1 ARG 43 22.451 -26.329 -2.718 355 HH21 ARG 43 1HH2 ARG 43 20.262 -28.995 -3.288 356 HH22 ARG 43 2HH2 ARG 43 21.824 -28.532 -2.704 357 H LEU 44 H LEU 44 15.546 -27.348 -2.301 358 HA LEU 44 HA LEU 44 12.650 -26.963 -1.952 359 HB2 LEU 44 2HB LEU 44 14.303 -29.381 -1.514 360 HB3 LEU 44 3HB LEU 44 13.058 -29.034 -0.315 361 HG LEU 44 HG LEU 44 12.568 -29.388 -3.272 362 HD11 LEU 44 1HD1 LEU 44 13.121 -31.519 -2.537 363 HD12 LEU 44 2HD1 LEU 44 11.368 -31.477 -2.359 364 HD13 LEU 44 3HD1 LEU 44 12.402 -31.266 -0.946 365 HD21 LEU 44 3HD2 LEU 44 10.968 -28.342 -1.104 366 HD22 LEU 44 1HD2 LEU 44 10.223 -29.768 -1.828 367 HD23 LEU 44 2HD2 LEU 44 10.634 -28.380 -2.836 368 H GLY 45 H GLY 45 12.195 -25.662 -0.308 369 HA2 GLY 45 2HA GLY 45 13.321 -25.857 2.259 370 HA3 GLY 45 3HA GLY 45 14.146 -24.571 1.392 371 H GLY 46 H GLY 46 12.833 -22.803 0.546 372 HA2 GLY 46 2HA GLY 46 10.349 -22.066 0.637 373 HA3 GLY 46 3HA GLY 46 10.592 -22.254 2.367 374 HA PRO 47 HA PRO 47 11.543 -17.860 1.237 375 HB2 PRO 47 2HB PRO 47 10.123 -16.780 3.283 376 HB3 PRO 47 3HB PRO 47 9.399 -17.193 1.724 377 HG2 PRO 47 2HG PRO 47 9.366 -18.728 4.294 378 HG3 PRO 47 3HG PRO 47 8.047 -18.445 3.143 379 HD2 PRO 47 2HD PRO 47 9.440 -20.765 3.220 380 HD3 PRO 47 3HD PRO 47 8.768 -20.105 1.715 381 H GLY 48 H GLY 48 13.307 -16.865 2.016 382 HA2 GLY 48 2HA GLY 48 14.051 -17.312 4.830 383 HA3 GLY 48 3HA GLY 48 15.227 -17.613 3.559 384 H LEU 49 H LEU 49 16.640 -16.028 3.323 385 HA LEU 49 HA LEU 49 15.792 -13.289 3.117 386 HB2 LEU 49 2HB LEU 49 16.379 -14.160 5.651 387 HB3 LEU 49 3HB LEU 49 17.915 -13.483 5.115 388 HG LEU 49 HG LEU 49 15.701 -11.698 4.552 389 HD11 LEU 49 1HD1 LEU 49 16.216 -12.282 7.460 390 HD12 LEU 49 2HD1 LEU 49 14.812 -12.878 6.575 391 HD13 LEU 49 3HD1 LEU 49 15.057 -11.143 6.772 392 HD21 LEU 49 3HD2 LEU 49 17.153 -10.102 5.657 393 HD22 LEU 49 1HD2 LEU 49 18.084 -11.095 4.535 394 HD23 LEU 49 2HD2 LEU 49 18.165 -11.411 6.269 395 H VAL 50 H VAL 50 17.007 -12.348 1.617 396 HA VAL 50 HA VAL 50 19.810 -13.170 1.319 397 HB VAL 50 HB VAL 50 19.681 -13.451 -1.012 398 HG11 VAL 50 1HG1 VAL 50 18.440 -15.162 0.599 399 HG12 VAL 50 2HG1 VAL 50 17.061 -14.700 -0.400 400 HG13 VAL 50 3HG1 VAL 50 18.502 -15.391 -1.148 401 HG21 VAL 50 3HG2 VAL 50 18.425 -11.805 -1.956 402 HG22 VAL 50 1HG2 VAL 50 17.251 -13.118 -2.047 403 HG23 VAL 50 2HG2 VAL 50 17.148 -11.932 -0.746 404 HA PRO 51 HA PRO 51 20.480 -8.811 1.191 405 HB2 PRO 51 2HB PRO 51 22.996 -8.834 0.171 406 HB3 PRO 51 3HB PRO 51 22.632 -9.284 1.842 407 HG2 PRO 51 2HG PRO 51 23.103 -11.043 -0.535 408 HG3 PRO 51 3HG PRO 51 23.704 -11.219 1.124 409 HD2 PRO 51 2HD PRO 51 21.590 -12.626 0.184 410 HD3 PRO 51 3HD PRO 51 21.723 -12.121 1.881 411 H VAL 52 H VAL 52 19.836 -7.329 -0.234 412 HA VAL 52 HA VAL 52 19.181 -7.883 -2.885 413 HB VAL 52 HB VAL 52 19.828 -5.144 -1.792 414 HG11 VAL 52 1HG1 VAL 52 18.624 -6.165 -4.262 415 HG12 VAL 52 2HG1 VAL 52 17.707 -4.879 -3.476 416 HG13 VAL 52 3HG1 VAL 52 19.391 -4.613 -3.929 417 HG21 VAL 52 3HG2 VAL 52 18.136 -5.376 -0.371 418 HG22 VAL 52 1HG2 VAL 52 17.053 -5.602 -1.745 419 HG23 VAL 52 2HG2 VAL 52 17.804 -7.000 -0.975 420 H SER 53 H SER 53 22.208 -7.061 -1.475 421 HA SER 53 HA SER 53 23.436 -6.013 -3.835 422 HB2 SER 53 2HB SER 53 25.576 -6.624 -2.444 423 HB3 SER 53 3HB SER 53 24.531 -5.307 -1.912 424 HG SER 53 HG SER 53 25.236 -7.341 -0.494 425 H TYR 54 H TYR 54 22.420 -9.064 -3.036 426 HA TYR 54 HA TYR 54 24.423 -10.310 -4.803 427 HB2 TYR 54 2HB TYR 54 22.965 -11.459 -2.424 428 HB3 TYR 54 3HB TYR 54 23.812 -12.460 -3.597 429 HD1 TYR 54 HD1 TYR 54 24.475 -9.409 -1.531 430 HD2 TYR 54 HD2 TYR 54 25.955 -13.098 -3.050 431 HE1 TYR 54 HE1 TYR 54 26.574 -9.069 -0.295 432 HE2 TYR 54 HE2 TYR 54 28.058 -12.769 -1.818 433 HH TYR 54 HH TYR 54 28.867 -9.785 -0.330 434 H VAL 55 H VAL 55 21.077 -9.790 -4.100 435 HA VAL 55 HA VAL 55 20.286 -11.596 -6.282 436 HB VAL 55 HB VAL 55 18.963 -10.715 -3.797 437 HG11 VAL 55 1HG1 VAL 55 17.468 -9.590 -5.241 438 HG12 VAL 55 2HG1 VAL 55 17.478 -10.915 -6.406 439 HG13 VAL 55 3HG1 VAL 55 16.695 -11.123 -4.839 440 HG21 VAL 55 3HG2 VAL 55 19.600 -12.982 -3.935 441 HG22 VAL 55 1HG2 VAL 55 17.852 -12.969 -4.165 442 HG23 VAL 55 2HG2 VAL 55 18.923 -13.156 -5.554 443 H ARG 56 H ARG 56 19.252 -10.849 -8.070 444 HA ARG 56 HA ARG 56 18.979 -7.926 -8.299 445 HB2 ARG 56 2HB ARG 56 20.593 -8.587 -9.870 446 HB3 ARG 56 3HB ARG 56 19.710 -10.046 -10.298 447 HG2 ARG 56 2HG ARG 56 18.042 -8.752 -11.458 448 HG3 ARG 56 3HG ARG 56 18.803 -7.248 -10.935 449 HD2 ARG 56 2HD ARG 56 19.376 -7.819 -13.255 450 HD3 ARG 56 3HD ARG 56 20.795 -7.780 -12.210 451 HE ARG 56 HE ARG 56 20.125 -10.380 -12.160 452 HH11 ARG 56 1HH1 ARG 56 20.537 -8.122 -14.778 453 HH12 ARG 56 2HH1 ARG 56 21.055 -9.327 -15.909 454 HH21 ARG 56 1HH2 ARG 56 20.807 -11.976 -13.640 455 HH22 ARG 56 2HH2 ARG 56 21.208 -11.519 -15.261 456 H ILE 57 H ILE 57 16.995 -7.137 -8.489 457 HA ILE 57 HA ILE 57 14.713 -8.832 -8.622 458 HB ILE 57 HB ILE 57 14.750 -5.844 -9.032 459 HG12 ILE 57 2HG1 ILE 57 15.973 -6.472 -6.973 460 HG13 ILE 57 3HG1 ILE 57 14.475 -5.616 -6.623 461 HG21 ILE 57 1HG2 ILE 57 12.676 -7.873 -8.726 462 HG22 ILE 57 2HG2 ILE 57 12.499 -6.512 -7.621 463 HG23 ILE 57 3HG2 ILE 57 12.573 -6.230 -9.360 464 HD11 ILE 57 3HD1 ILE 57 15.240 -7.855 -5.373 465 HD12 ILE 57 1HD1 ILE 57 13.553 -7.389 -5.593 466 HD13 ILE 57 2HD1 ILE 57 14.297 -8.553 -6.690 467 H ILE 58 H ILE 58 13.596 -9.529 -10.327 468 HA ILE 58 HA ILE 58 13.737 -8.088 -12.860 469 HB ILE 58 HB ILE 58 14.084 -10.292 -14.070 470 HG12 ILE 58 2HG1 ILE 58 15.209 -11.146 -11.397 471 HG13 ILE 58 3HG1 ILE 58 13.663 -11.696 -12.034 472 HG21 ILE 58 1HG2 ILE 58 15.824 -8.376 -13.344 473 HG22 ILE 58 2HG2 ILE 58 16.584 -9.779 -12.594 474 HG23 ILE 58 3HG2 ILE 58 16.265 -9.770 -14.329 475 HD11 ILE 58 3HD1 ILE 58 15.265 -13.384 -12.469 476 HD12 ILE 58 1HD1 ILE 58 14.903 -12.600 -14.006 477 HD13 ILE 58 2HD1 ILE 58 16.400 -12.220 -13.153 478 H ASP 59 H ASP 59 12.273 -9.286 -14.521 479 HA ASP 59 HA ASP 59 9.839 -10.166 -13.109 480 HB2 ASP 59 2HB ASP 59 9.812 -7.882 -14.284 481 HB3 ASP 59 3HB ASP 59 9.840 -8.794 -15.791 482 H LEU 60 H LEU 60 9.005 -12.080 -13.659 483 HA LEU 60 HA LEU 60 10.382 -13.904 -15.257 484 HB2 LEU 60 2HB LEU 60 7.905 -13.830 -13.759 485 HB3 LEU 60 3HB LEU 60 7.749 -14.789 -15.230 486 HG LEU 60 HG LEU 60 9.747 -15.230 -13.012 487 HD11 LEU 60 1HD1 LEU 60 7.215 -15.841 -12.787 488 HD12 LEU 60 2HD1 LEU 60 8.458 -16.990 -12.295 489 HD13 LEU 60 3HD1 LEU 60 7.652 -17.178 -13.852 490 HD21 LEU 60 3HD2 LEU 60 10.092 -17.396 -14.357 491 HD22 LEU 60 1HD2 LEU 60 10.866 -15.919 -14.933 492 HD23 LEU 60 2HD2 LEU 60 9.389 -16.499 -15.704 493 H MET 61 H MET 61 8.103 -11.466 -16.104 494 HA MET 61 HA MET 61 7.519 -12.644 -18.698 495 HB2 MET 61 2HB MET 61 6.704 -9.920 -17.687 496 HB3 MET 61 3HB MET 61 5.990 -10.828 -19.014 497 HG2 MET 61 2HG MET 61 5.935 -11.728 -16.146 498 HG3 MET 61 3HG MET 61 4.650 -10.800 -16.916 499 HE1 MET 61 3HE MET 61 6.509 -14.600 -17.539 500 HE2 MET 61 1HE MET 61 6.165 -13.826 -15.992 501 HE3 MET 61 2HE MET 61 5.110 -15.105 -16.592 502 H ASP 62 H ASP 62 9.579 -10.234 -17.280 503 HA ASP 62 HA ASP 62 10.994 -9.950 -19.793 504 HB2 ASP 62 2HB ASP 62 9.086 -8.140 -19.504 505 HB3 ASP 62 3HB ASP 62 10.276 -7.376 -18.455 506 HA PRO 63 HA PRO 63 13.659 -10.052 -16.004 507 HB2 PRO 63 2HB PRO 63 15.399 -11.881 -17.003 508 HB3 PRO 63 3HB PRO 63 13.906 -12.331 -16.171 509 HG2 PRO 63 2HG PRO 63 14.468 -12.187 -19.108 510 HG3 PRO 63 3HG PRO 63 13.587 -13.427 -18.197 511 HD2 PRO 63 2HD PRO 63 12.330 -11.486 -19.606 512 HD3 PRO 63 3HD PRO 63 11.655 -12.173 -18.115 513 H ALA 64 H ALA 64 13.968 -9.195 -19.267 514 HA ALA 64 HA ALA 64 16.745 -8.326 -19.006 515 HB1 ALA 64 1HB ALA 64 15.016 -7.924 -21.425 516 HB2 ALA 64 2HB ALA 64 16.774 -8.030 -21.325 517 HB3 ALA 64 3HB ALA 64 15.789 -9.472 -21.083 518 H LYS 65 H LYS 65 13.601 -7.111 -18.610 519 HA LYS 65 HA LYS 65 14.138 -4.382 -19.304 520 HB2 LYS 65 2HB LYS 65 11.856 -5.617 -19.181 521 HB3 LYS 65 3HB LYS 65 11.932 -5.254 -17.462 522 HG2 LYS 65 2HG LYS 65 12.250 -2.834 -18.120 523 HG3 LYS 65 3HG LYS 65 11.817 -3.324 -19.759 524 HD2 LYS 65 2HD LYS 65 10.065 -3.988 -17.414 525 HD3 LYS 65 3HD LYS 65 9.956 -2.426 -18.229 526 HE2 LYS 65 2HE LYS 65 9.913 -4.146 -20.338 527 HE3 LYS 65 3HE LYS 65 9.074 -5.086 -19.105 528 HZ1 LYS 65 3HZ LYS 65 7.740 -3.490 -20.606 529 HZ2 LYS 65 1HZ LYS 65 8.322 -2.279 -19.577 530 HZ3 LYS 65 2HZ LYS 65 7.389 -3.544 -18.952 531 H TYR 66 H TYR 66 13.710 -6.105 -16.215 532 HA TYR 66 HA TYR 66 14.837 -3.808 -14.800 533 HB2 TYR 66 2HB TYR 66 13.510 -6.329 -13.787 534 HB3 TYR 66 3HB TYR 66 14.149 -5.059 -12.749 535 HD1 TYR 66 HD2 TYR 66 11.649 -5.717 -15.418 536 HD2 TYR 66 HD1 TYR 66 12.842 -3.188 -12.212 537 HE1 TYR 66 HE2 TYR 66 9.504 -4.523 -15.569 538 HE2 TYR 66 HE1 TYR 66 10.700 -1.988 -12.353 539 HH TYR 66 HH TYR 66 8.757 -1.982 -14.850 540 H ALA 67 H ALA 67 16.385 -5.738 -16.503 541 HA ALA 67 HA ALA 67 18.071 -7.122 -14.585 542 HB1 ALA 67 1HB ALA 67 17.434 -7.477 -17.308 543 HB2 ALA 67 2HB ALA 67 19.165 -7.150 -17.223 544 HB3 ALA 67 3HB ALA 67 18.472 -8.478 -16.293 545 H SER 68 H SER 68 17.958 -4.095 -16.160 546 HA SER 68 HA SER 68 20.820 -3.621 -15.940 547 HB2 SER 68 2HB SER 68 20.193 -1.341 -16.848 548 HB3 SER 68 3HB SER 68 19.813 -2.701 -17.905 549 HG SER 68 HG SER 68 17.675 -2.537 -17.328 550 H VAL 69 H VAL 69 17.913 -3.037 -14.179 551 HA VAL 69 HA VAL 69 18.517 -0.782 -12.694 552 HB VAL 69 HB VAL 69 16.354 -2.042 -12.631 553 HG11 VAL 69 1HG1 VAL 69 17.718 -4.235 -12.117 554 HG12 VAL 69 2HG1 VAL 69 17.448 -3.738 -10.445 555 HG13 VAL 69 3HG1 VAL 69 16.074 -4.020 -11.515 556 HG21 VAL 69 3HG2 VAL 69 16.074 -1.716 -10.087 557 HG22 VAL 69 1HG2 VAL 69 17.740 -1.141 -10.133 558 HG23 VAL 69 2HG2 VAL 69 16.496 -0.317 -11.074 559 H ASP 70 H ASP 70 19.717 -0.341 -10.907 560 HA ASP 70 HA ASP 70 21.702 -2.347 -10.153 561 HB2 ASP 70 2HB ASP 70 21.539 0.602 -9.494 562 HB3 ASP 70 3HB ASP 70 22.873 -0.466 -9.066 563 H THR 71 H THR 71 20.544 -3.706 -8.800 564 HA THR 71 HA THR 71 18.770 -3.040 -6.799 565 HB THR 71 HB THR 71 20.150 -5.166 -5.690 566 HG1 THR 71 HG1 THR 71 20.130 -5.647 -8.477 567 HG21 THR 71 3HG2 THR 71 17.670 -4.796 -6.324 568 HG22 THR 71 1HG2 THR 71 18.305 -6.441 -6.329 569 HG23 THR 71 2HG2 THR 71 18.106 -5.568 -7.848 570 H TYR 72 H TYR 72 22.252 -2.807 -6.804 571 HA TYR 72 HA TYR 72 22.737 -2.626 -4.060 572 HB2 TYR 72 2HB TYR 72 24.588 -2.861 -5.556 573 HB3 TYR 72 3HB TYR 72 24.162 -1.385 -6.415 574 HD1 TYR 72 HD2 TYR 72 24.441 -2.030 -2.753 575 HD2 TYR 72 HD1 TYR 72 25.968 0.051 -6.135 576 HE1 TYR 72 HE2 TYR 72 25.936 -0.747 -1.281 577 HE2 TYR 72 HE1 TYR 72 27.469 1.339 -4.673 578 HH TYR 72 HH TYR 72 27.118 1.724 -1.559 579 H ASP 73 H ASP 73 22.036 -0.062 -6.418 580 HA ASP 73 HA ASP 73 22.154 2.080 -4.591 581 HB2 ASP 73 2HB ASP 73 21.003 1.690 -7.321 582 HB3 ASP 73 3HB ASP 73 20.552 3.130 -6.413 583 H ARG 74 H ARG 74 20.925 2.255 -2.838 584 HA ARG 74 HA ARG 74 18.535 0.930 -2.344 585 HB2 ARG 74 2HB ARG 74 18.335 2.249 -0.397 586 HB3 ARG 74 3HB ARG 74 20.064 2.105 -0.681 587 HG2 ARG 74 2HG ARG 74 18.426 4.471 -1.554 588 HG3 ARG 74 3HG ARG 74 19.282 4.380 -0.013 589 HD2 ARG 74 2HD ARG 74 20.462 4.313 -2.783 590 HD3 ARG 74 3HD ARG 74 20.673 5.559 -1.554 591 HE ARG 74 HE ARG 74 21.624 3.282 -0.389 592 HH11 ARG 74 1HH1 ARG 74 22.312 5.020 -3.326 593 HH12 ARG 74 2HH1 ARG 74 23.976 4.538 -3.375 594 HH21 ARG 74 1HH2 ARG 74 23.813 2.641 -0.443 595 HH22 ARG 74 2HH2 ARG 74 24.828 3.184 -1.735 596 H GLU 75 H GLU 75 19.138 3.827 -4.129 597 HA GLU 75 HA GLU 75 16.555 4.972 -3.981 598 HB2 GLU 75 2HB GLU 75 18.982 5.353 -5.618 599 HB3 GLU 75 3HB GLU 75 17.476 5.838 -6.383 600 HG2 GLU 75 2HG GLU 75 16.994 7.198 -4.325 601 HG3 GLU 75 3HG GLU 75 18.647 6.859 -3.813 602 H GLN 76 H GLN 76 18.095 3.044 -6.557 603 HA GLN 76 HA GLN 76 15.845 2.823 -8.197 604 HB2 GLN 76 2HB GLN 76 18.046 0.777 -7.888 605 HB3 GLN 76 3HB GLN 76 16.994 0.988 -9.281 606 HG2 GLN 76 2HG GLN 76 18.266 3.468 -8.760 607 HG3 GLN 76 3HG GLN 76 19.494 2.204 -8.745 608 HE21 GLN 76 1HE2 GLN 76 20.377 1.804 -10.631 609 HE22 GLN 76 2HE2 GLN 76 19.636 2.022 -12.176 610 H VAL 77 H VAL 77 17.136 0.385 -5.931 611 HA VAL 77 HA VAL 77 15.119 -1.483 -6.132 612 HB VAL 77 HB VAL 77 17.330 -1.521 -4.749 613 HG11 VAL 77 1HG1 VAL 77 16.607 0.333 -3.254 614 HG12 VAL 77 2HG1 VAL 77 15.380 -0.745 -2.585 615 HG13 VAL 77 3HG1 VAL 77 17.091 -1.129 -2.396 616 HG21 VAL 77 3HG2 VAL 77 16.492 -3.590 -4.636 617 HG22 VAL 77 1HG2 VAL 77 15.822 -3.109 -3.076 618 HG23 VAL 77 2HG2 VAL 77 14.833 -3.001 -4.532 619 H MET 78 H MET 78 15.143 1.546 -4.387 620 HA MET 78 HA MET 78 12.860 1.051 -2.779 621 HB2 MET 78 2HB MET 78 14.556 3.360 -3.453 622 HB3 MET 78 3HB MET 78 12.892 3.765 -3.054 623 HG2 MET 78 2HG MET 78 13.195 2.379 -0.964 624 HG3 MET 78 3HG MET 78 14.915 2.355 -1.346 625 HE1 MET 78 3HE MET 78 16.237 4.959 -1.796 626 HE2 MET 78 1HE MET 78 16.270 5.552 -0.135 627 HE3 MET 78 2HE MET 78 16.461 3.829 -0.460 628 H LYS 79 H LYS 79 13.282 2.862 -5.817 629 HA LYS 79 HA LYS 79 10.625 3.590 -6.205 630 HB2 LYS 79 2HB LYS 79 12.775 2.968 -8.236 631 HB3 LYS 79 3HB LYS 79 11.232 3.714 -8.634 632 HG2 LYS 79 2HG LYS 79 11.797 5.714 -7.703 633 HG3 LYS 79 3HG LYS 79 12.884 4.983 -6.519 634 HD2 LYS 79 2HD LYS 79 14.536 4.574 -8.249 635 HD3 LYS 79 3HD LYS 79 13.439 5.208 -9.478 636 HE2 LYS 79 2HE LYS 79 13.450 7.325 -7.912 637 HE3 LYS 79 3HE LYS 79 14.988 6.648 -7.379 638 HZ1 LYS 79 3HZ LYS 79 15.355 6.495 -9.967 639 HZ2 LYS 79 1HZ LYS 79 15.699 7.910 -9.107 640 HZ3 LYS 79 2HZ LYS 79 14.252 7.777 -9.972 641 H ILE 80 H ILE 80 12.334 0.652 -7.210 642 HA ILE 80 HA ILE 80 10.209 -0.501 -8.653 643 HB ILE 80 HB ILE 80 12.652 -1.642 -7.338 644 HG12 ILE 80 2HG1 ILE 80 12.666 -2.362 -9.972 645 HG13 ILE 80 3HG1 ILE 80 11.788 -0.837 -10.038 646 HG21 ILE 80 1HG2 ILE 80 11.119 -3.403 -7.013 647 HG22 ILE 80 2HG2 ILE 80 10.382 -3.157 -8.595 648 HG23 ILE 80 3HG2 ILE 80 12.013 -3.816 -8.475 649 HD11 ILE 80 3HD1 ILE 80 14.322 -0.787 -10.336 650 HD12 ILE 80 1HD1 ILE 80 13.598 0.374 -9.223 651 HD13 ILE 80 2HD1 ILE 80 14.400 -1.067 -8.596 652 H ILE 81 H ILE 81 11.346 -1.202 -5.343 653 HA ILE 81 HA ILE 81 9.335 -2.983 -4.631 654 HB ILE 81 HB ILE 81 10.910 -1.063 -2.921 655 HG12 ILE 81 2HG1 ILE 81 11.143 -4.055 -3.301 656 HG13 ILE 81 3HG1 ILE 81 12.157 -2.862 -4.106 657 HG21 ILE 81 1HG2 ILE 81 10.069 -3.083 -1.260 658 HG22 ILE 81 2HG2 ILE 81 9.401 -1.453 -1.322 659 HG23 ILE 81 3HG2 ILE 81 8.639 -2.753 -2.237 660 HD11 ILE 81 3HD1 ILE 81 12.684 -4.113 -1.715 661 HD12 ILE 81 1HD1 ILE 81 13.484 -2.671 -2.339 662 HD13 ILE 81 2HD1 ILE 81 12.121 -2.513 -1.231 663 H ASP 82 H ASP 82 9.378 0.536 -4.545 664 HA ASP 82 HA ASP 82 6.922 0.820 -3.131 665 HB2 ASP 82 2HB ASP 82 8.628 2.604 -3.219 666 HB3 ASP 82 3HB ASP 82 8.325 2.794 -4.944 667 H GLU 83 H GLU 83 7.778 1.178 -6.571 668 HA GLU 83 HA GLU 83 5.204 1.701 -7.520 669 HB2 GLU 83 2HB GLU 83 7.659 0.522 -8.788 670 HB3 GLU 83 3HB GLU 83 6.157 0.653 -9.693 671 HG2 GLU 83 2HG GLU 83 6.379 3.160 -8.686 672 HG3 GLU 83 3HG GLU 83 8.073 2.723 -8.901 673 H PHE 84 H PHE 84 6.946 -1.399 -7.339 674 HA PHE 84 HA PHE 84 4.776 -2.956 -8.284 675 HB2 PHE 84 2HB PHE 84 7.337 -3.590 -6.848 676 HB3 PHE 84 3HB PHE 84 6.137 -4.846 -7.130 677 HD1 PHE 84 HD1 PHE 84 7.664 -2.076 -9.117 678 HD2 PHE 84 HD2 PHE 84 6.589 -6.189 -8.922 679 HE1 PHE 84 HE1 PHE 84 8.557 -2.413 -11.384 680 HE2 PHE 84 HE2 PHE 84 7.482 -6.534 -11.188 681 HZ PHE 84 HZ PHE 84 8.468 -4.645 -12.423 682 H LYS 85 H LYS 85 5.359 -1.444 -5.314 683 HA LYS 85 HA LYS 85 4.275 -1.444 -3.314 684 HB2 LYS 85 2HB LYS 85 2.167 -3.042 -4.778 685 HB3 LYS 85 3HB LYS 85 1.950 -2.170 -3.267 686 HG2 LYS 85 2HG LYS 85 2.836 -0.716 -5.720 687 HG3 LYS 85 3HG LYS 85 1.134 -1.117 -5.485 688 HD2 LYS 85 2HD LYS 85 1.533 -0.062 -3.118 689 HD3 LYS 85 3HD LYS 85 2.887 0.730 -3.927 690 HE2 LYS 85 2HE LYS 85 1.532 2.004 -5.242 691 HE3 LYS 85 3HE LYS 85 0.255 0.789 -5.293 692 HZ1 LYS 85 3HZ LYS 85 0.178 1.463 -2.728 693 HZ2 LYS 85 1HZ LYS 85 -0.747 2.237 -3.913 694 HZ3 LYS 85 2HZ LYS 85 0.700 2.933 -3.383 695 H ILE 86 H ILE 86 6.251 -3.198 -3.316 696 HA ILE 86 HA ILE 86 5.361 -5.854 -2.627 697 HB ILE 86 HB ILE 86 8.115 -4.677 -2.257 698 HG12 ILE 86 2HG1 ILE 86 6.980 -6.166 -4.634 699 HG13 ILE 86 3HG1 ILE 86 7.371 -4.450 -4.594 700 HG21 ILE 86 1HG2 ILE 86 7.397 -7.556 -2.709 701 HG22 ILE 86 2HG2 ILE 86 8.897 -6.878 -2.079 702 HG23 ILE 86 3HG2 ILE 86 7.435 -6.848 -1.095 703 HD11 ILE 86 3HD1 ILE 86 9.377 -6.649 -4.175 704 HD12 ILE 86 1HD1 ILE 86 9.068 -5.860 -5.721 705 HD13 ILE 86 2HD1 ILE 86 9.700 -4.926 -4.365 706 HA PRO 87 HA PRO 87 4.646 -4.978 1.653 707 HB2 PRO 87 2HB PRO 87 4.480 -7.551 2.501 708 HB3 PRO 87 3HB PRO 87 3.185 -6.751 1.602 709 HG2 PRO 87 2HG PRO 87 5.295 -8.631 0.615 710 HG3 PRO 87 3HG PRO 87 3.568 -8.581 0.220 711 HD2 PRO 87 2HD PRO 87 5.467 -7.563 -1.420 712 HD3 PRO 87 3HD PRO 87 3.836 -6.871 -1.302 713 H THR 88 H THR 88 5.725 -5.083 3.642 714 HA THR 88 HA THR 88 8.567 -5.666 3.427 715 HB THR 88 HB THR 88 7.468 -4.682 5.995 716 HG1 THR 88 HG1 THR 88 6.486 -3.021 5.146 717 HG21 THR 88 3HG2 THR 88 9.400 -3.037 5.571 718 HG22 THR 88 1HG2 THR 88 9.824 -4.096 4.226 719 HG23 THR 88 2HG2 THR 88 9.807 -4.726 5.873 720 H VAL 89 H VAL 89 9.655 -6.693 5.337 721 HA VAL 89 HA VAL 89 8.872 -9.313 5.679 722 HB VAL 89 HB VAL 89 10.524 -7.644 7.580 723 HG11 VAL 89 1HG1 VAL 89 9.565 -10.323 7.804 724 HG12 VAL 89 2HG1 VAL 89 11.317 -10.352 7.594 725 HG13 VAL 89 3HG1 VAL 89 10.600 -9.420 8.909 726 HG21 VAL 89 3HG2 VAL 89 11.880 -7.572 5.785 727 HG22 VAL 89 1HG2 VAL 89 12.260 -9.235 6.233 728 HG23 VAL 89 2HG2 VAL 89 11.059 -8.911 4.983 729 H GLU 90 H GLU 90 8.560 -6.725 8.120 730 HA GLU 90 HA GLU 90 7.165 -8.123 10.038 731 HB2 GLU 90 2HB GLU 90 6.855 -5.218 9.260 732 HB3 GLU 90 3HB GLU 90 6.246 -5.924 10.751 733 HG2 GLU 90 2HG GLU 90 8.180 -5.370 11.674 734 HG3 GLU 90 3HG GLU 90 8.910 -6.656 10.715 735 H GLN 91 H GLN 91 5.789 -6.215 7.365 736 HA GLN 91 HA GLN 91 3.100 -6.696 7.904 737 HB2 GLN 91 2HB GLN 91 4.276 -6.423 5.139 738 HB3 GLN 91 3HB GLN 91 2.651 -5.996 5.660 739 HG2 GLN 91 2HG GLN 91 5.232 -4.590 6.218 740 HG3 GLN 91 3HG GLN 91 3.761 -3.960 5.480 741 HE21 GLN 91 1HE2 GLN 91 5.559 -3.639 8.087 742 HE22 GLN 91 2HE2 GLN 91 4.362 -3.306 9.287 743 H TRP 92 H TRP 92 5.413 -8.577 6.004 744 HA TRP 92 HA TRP 92 3.565 -10.474 5.023 745 HB2 TRP 92 2HB TRP 92 5.819 -10.133 4.063 746 HB3 TRP 92 3HB TRP 92 6.530 -10.815 5.524 747 HD1 TRP 92 HD1 TRP 92 3.892 -12.009 2.919 748 HE1 TRP 92 HE1 TRP 92 4.361 -14.488 2.412 749 HE3 TRP 92 HE3 TRP 92 7.864 -12.741 6.053 750 HZ2 TRP 92 HZ2 TRP 92 6.174 -16.490 3.233 751 HZ3 TRP 92 HZ3 TRP 92 8.909 -14.968 6.133 752 HH2 TRP 92 HH2 TRP 92 8.079 -16.802 4.752 753 H LYS 93 H LYS 93 5.484 -10.304 7.968 754 HA LYS 93 HA LYS 93 5.003 -12.941 8.860 755 HB2 LYS 93 2HB LYS 93 5.601 -10.453 10.472 756 HB3 LYS 93 3HB LYS 93 5.709 -12.104 11.068 757 HG2 LYS 93 2HG LYS 93 7.278 -11.374 8.653 758 HG3 LYS 93 3HG LYS 93 7.832 -10.800 10.228 759 HD2 LYS 93 2HD LYS 93 8.783 -12.787 10.541 760 HD3 LYS 93 3HD LYS 93 7.166 -13.494 10.599 761 HE2 LYS 93 2HE LYS 93 8.225 -14.729 8.941 762 HE3 LYS 93 3HE LYS 93 7.329 -13.518 8.026 763 HZ1 LYS 93 3HZ LYS 93 9.221 -12.441 7.416 764 HZ2 LYS 93 1HZ LYS 93 9.847 -14.008 7.546 765 HZ3 LYS 93 2HZ LYS 93 10.082 -12.897 8.799 766 H ASP 94 H ASP 94 3.421 -9.857 9.671 767 HA ASP 94 HA ASP 94 1.504 -10.926 11.421 768 HB2 ASP 94 2HB ASP 94 1.775 -8.393 9.870 769 HB3 ASP 94 3HB ASP 94 0.201 -8.774 10.563 770 H GLN 95 H GLN 95 1.374 -10.284 7.936 771 HA GLN 95 HA GLN 95 -1.305 -10.987 7.527 772 HB2 GLN 95 2HB GLN 95 1.109 -10.993 5.733 773 HB3 GLN 95 3HB GLN 95 -0.464 -11.520 5.149 774 HG2 GLN 95 2HG GLN 95 -0.104 -8.852 6.458 775 HG3 GLN 95 3HG GLN 95 0.234 -9.093 4.745 776 HE21 GLN 95 1HE2 GLN 95 -1.667 -7.313 5.498 777 HE22 GLN 95 2HE2 GLN 95 -3.237 -7.908 5.092 778 H THR 96 H THR 96 1.645 -12.954 7.295 779 HA THR 96 HA THR 96 0.341 -15.352 6.565 780 HB THR 96 HB THR 96 2.457 -16.464 7.383 781 HG1 THR 96 HG1 THR 96 3.595 -13.909 7.621 782 HG21 THR 96 3HG2 THR 96 3.870 -15.481 5.620 783 HG22 THR 96 1HG2 THR 96 2.745 -14.131 5.486 784 HG23 THR 96 2HG2 THR 96 2.220 -15.761 5.065 785 H ARG 97 H ARG 97 1.478 -14.135 9.707 786 HA ARG 97 HA ARG 97 0.834 -16.315 11.286 787 HB2 ARG 97 2HB ARG 97 0.856 -13.361 11.867 788 HB3 ARG 97 3HB ARG 97 0.475 -14.543 13.111 789 HG2 ARG 97 2HG ARG 97 2.981 -14.841 11.523 790 HG3 ARG 97 3HG ARG 97 2.906 -13.660 12.833 791 HD2 ARG 97 2HD ARG 97 2.236 -16.586 13.119 792 HD3 ARG 97 3HD ARG 97 3.795 -15.873 13.529 793 HE ARG 97 HE ARG 97 2.026 -14.402 14.964 794 HH11 ARG 97 1HH1 ARG 97 2.634 -17.816 14.653 795 HH12 ARG 97 2HH1 ARG 97 2.131 -18.185 16.269 796 HH21 ARG 97 1HH2 ARG 97 1.361 -14.875 17.094 797 HH22 ARG 97 2HH2 ARG 97 1.407 -16.512 17.656 798 H ARG 98 H ARG 98 -1.216 -13.510 10.502 799 HA ARG 98 HA ARG 98 -3.499 -14.512 11.865 800 HB2 ARG 98 2HB ARG 98 -3.231 -12.401 9.718 801 HB3 ARG 98 3HB ARG 98 -4.717 -12.734 10.597 802 HG2 ARG 98 2HG ARG 98 -3.214 -12.317 12.697 803 HG3 ARG 98 3HG ARG 98 -2.205 -11.448 11.538 804 HD2 ARG 98 2HD ARG 98 -3.848 -9.874 11.094 805 HD3 ARG 98 3HD ARG 98 -5.146 -10.925 11.658 806 HE ARG 98 HE ARG 98 -3.611 -9.102 13.228 807 HH11 ARG 98 1HH1 ARG 98 -5.336 -12.124 13.316 808 HH12 ARG 98 2HH1 ARG 98 -5.675 -12.031 15.012 809 HH21 ARG 98 1HH2 ARG 98 -4.050 -8.968 15.462 810 HH22 ARG 98 2HH2 ARG 98 -4.943 -10.235 16.232 811 H TYR 99 H TYR 99 -2.278 -14.813 8.599 812 HA TYR 99 HA TYR 99 -4.629 -15.791 7.386 813 HB2 TYR 99 2HB TYR 99 -2.858 -14.999 5.985 814 HB3 TYR 99 3HB TYR 99 -1.711 -16.134 6.690 815 HD1 TYR 99 HD1 TYR 99 -5.105 -16.396 5.128 816 HD2 TYR 99 HD2 TYR 99 -1.094 -17.810 5.244 817 HE1 TYR 99 HE1 TYR 99 -5.632 -18.019 3.357 818 HE2 TYR 99 HE2 TYR 99 -1.610 -19.436 3.472 819 HH TYR 99 HH TYR 99 -4.799 -19.526 1.932 820 H LYS 100 H LYS 100 -2.000 -17.368 9.116 821 HA LYS 100 HA LYS 100 -3.050 -20.015 8.589 822 HB2 LYS 100 2HB LYS 100 -0.722 -18.988 10.204 823 HB3 LYS 100 3HB LYS 100 -1.193 -20.682 10.213 824 HG2 LYS 100 2HG LYS 100 -0.942 -20.633 7.700 825 HG3 LYS 100 3HG LYS 100 -0.182 -19.053 7.901 826 HD2 LYS 100 2HD LYS 100 1.691 -19.926 8.879 827 HD3 LYS 100 3HD LYS 100 0.823 -21.303 9.563 828 HE2 LYS 100 2HE LYS 100 0.553 -22.017 7.073 829 HE3 LYS 100 3HE LYS 100 1.909 -20.923 6.802 830 HZ1 LYS 100 3HZ LYS 100 2.206 -23.481 7.428 831 HZ2 LYS 100 1HZ LYS 100 2.209 -22.818 8.985 832 HZ3 LYS 100 2HZ LYS 100 3.340 -22.296 7.841 833 H GLU 101 H GLU 101 -3.260 -17.587 11.048 834 HA GLU 101 HA GLU 101 -4.205 -19.362 13.106 835 HB2 GLU 101 2HB GLU 101 -3.985 -16.376 12.847 836 HB3 GLU 101 3HB GLU 101 -4.845 -17.106 14.195 837 HG2 GLU 101 2HG GLU 101 -2.048 -17.935 13.553 838 HG3 GLU 101 3HG GLU 101 -2.364 -16.467 14.474 839 H SER 102 H SER 102 -6.355 -18.391 14.236 840 HA SER 102 HA SER 102 -8.423 -18.584 12.153 841 HB2 SER 102 2HB SER 102 -8.925 -19.069 15.078 842 HB3 SER 102 3HB SER 102 -9.816 -19.682 13.685 843 HG SER 102 HG SER 102 -7.918 -20.935 13.191 844 H SER 103 H SER 103 -9.139 -16.624 11.617 845 HA SER 103 HA SER 103 -10.371 -14.963 13.614 846 HB2 SER 103 2HB SER 103 -8.218 -13.625 11.994 847 HB3 SER 103 3HB SER 103 -9.027 -13.043 13.448 848 HG SER 103 HG SER 103 -7.720 -14.204 14.661 849 H ILE 104 H ILE 104 -10.966 -12.737 12.388 850 HA ILE 104 HA ILE 104 -12.270 -13.604 9.902 851 HB ILE 104 HB ILE 104 -13.009 -11.116 11.406 852 HG12 ILE 104 2HG1 ILE 104 -13.056 -12.888 13.073 853 HG13 ILE 104 3HG1 ILE 104 -14.702 -12.449 12.630 854 HG21 ILE 104 1HG2 ILE 104 -14.090 -12.719 9.209 855 HG22 ILE 104 2HG2 ILE 104 -15.284 -12.244 10.416 856 HG23 ILE 104 3HG2 ILE 104 -14.324 -11.014 9.594 857 HD11 ILE 104 3HD1 ILE 104 -14.238 -14.467 10.898 858 HD12 ILE 104 1HD1 ILE 104 -13.256 -14.973 12.272 859 HD13 ILE 104 2HD1 ILE 104 -14.979 -14.664 12.486 860 H GLN 105 H GLN 105 -12.537 -11.971 8.195 861 HA GLN 105 HA GLN 105 -10.037 -10.767 7.550 862 HB2 GLN 105 2HB GLN 105 -12.609 -10.176 6.115 863 HB3 GLN 105 3HB GLN 105 -10.979 -10.256 5.462 864 HG2 GLN 105 2HG GLN 105 -11.365 -12.791 6.433 865 HG3 GLN 105 3HG GLN 105 -12.959 -12.356 5.818 866 HE21 GLN 105 1HE2 GLN 105 -12.868 -13.791 4.116 867 HE22 GLN 105 2HE2 GLN 105 -11.832 -13.560 2.753 868 H ILE 106 H ILE 106 -10.605 -8.397 6.337 869 HA ILE 106 HA ILE 106 -11.807 -6.676 8.379 870 HB ILE 106 HB ILE 106 -9.078 -6.138 7.204 871 HG12 ILE 106 2HG1 ILE 106 -9.093 -8.027 8.828 872 HG13 ILE 106 3HG1 ILE 106 -8.169 -6.639 9.391 873 HG21 ILE 106 1HG2 ILE 106 -9.093 -4.400 9.078 874 HG22 ILE 106 2HG2 ILE 106 -10.078 -4.071 7.653 875 HG23 ILE 106 3HG2 ILE 106 -10.837 -4.658 9.133 876 HD11 ILE 106 3HD1 ILE 106 -9.713 -6.105 11.014 877 HD12 ILE 106 1HD1 ILE 106 -11.023 -6.955 10.195 878 HD13 ILE 106 2HD1 ILE 106 -9.756 -7.868 11.016 879 H GLY 107 H GLY 107 -13.496 -6.125 7.038 880 HA2 GLY 107 2HA GLY 107 -12.741 -4.525 4.674 881 HA3 GLY 107 3HA GLY 107 -14.077 -5.665 4.615 882 H ASN 108 H ASN 108 -13.328 -2.484 4.937 883 HA ASN 108 HA ASN 108 -15.811 -1.926 6.424 884 HB2 ASN 108 2HB ASN 108 -13.466 -1.197 7.372 885 HB3 ASN 108 3HB ASN 108 -13.626 0.109 6.201 886 HD21 ASN 108 1HD2 ASN 108 -14.456 -1.012 9.267 887 HD22 ASN 108 2HD2 ASN 108 -15.598 0.216 9.681 888 H GLY 109 H GLY 109 -17.351 -0.822 5.384 889 HA2 GLY 109 2HA GLY 109 -16.609 0.809 3.057 890 HA3 GLY 109 3HA GLY 109 -17.801 -0.465 2.847 891 H HIS 110 H HIS 110 -17.422 2.762 3.383 892 HA HIS 110 HA HIS 110 -20.180 2.993 4.354 893 HB2 HIS 110 2HB HIS 110 -18.348 3.402 6.158 894 HB3 HIS 110 3HB HIS 110 -18.090 4.925 5.312 895 HD1 HIS 110 HD1 HIS 110 -19.266 6.742 6.482 896 HD2 HIS 110 HD2 HIS 110 -21.423 3.193 6.606 897 HE1 HIS 110 HE1 HIS 110 -21.384 7.285 7.726 898 H GLY 111 H GLY 111 -19.872 3.145 1.778 899 HA2 GLY 111 2HA GLY 111 -20.040 6.026 1.207 900 HA3 GLY 111 3HA GLY 111 -19.031 5.006 0.193 901 H GLN 112 H GLN 112 -20.338 5.662 -1.601 902 HA GLN 112 HA GLN 112 -22.650 3.933 -1.935 903 HB2 GLN 112 2HB GLN 112 -23.253 6.369 -1.092 904 HB3 GLN 112 3HB GLN 112 -23.019 6.769 -2.788 905 HG2 GLN 112 2HG GLN 112 -24.618 4.681 -3.111 906 HG3 GLN 112 3HG GLN 112 -25.130 5.148 -1.490 907 HE21 GLN 112 1HE2 GLN 112 -27.054 5.307 -3.198 908 HE22 GLN 112 2HE2 GLN 112 -27.364 6.923 -3.726 909 H SER 113 H SER 113 -22.066 2.818 -3.677 910 HA SER 113 HA SER 113 -20.268 3.728 -5.647 911 HB2 SER 113 2HB SER 113 -22.237 1.575 -6.292 912 HB3 SER 113 3HB SER 113 -20.505 1.646 -6.616 913 HG SER 113 HG SER 113 -21.262 0.169 -4.891 914 H GLN 114 H GLN 114 -20.552 4.681 -7.597 915 HA GLN 114 HA GLN 114 -23.037 6.030 -8.076 916 HB2 GLN 114 2HB GLN 114 -20.418 5.925 -9.561 917 HB3 GLN 114 3HB GLN 114 -21.808 6.809 -10.176 918 HG2 GLN 114 2HG GLN 114 -20.536 7.295 -7.494 919 HG3 GLN 114 3HG GLN 114 -20.174 8.212 -8.955 920 HE21 GLN 114 1HE2 GLN 114 -20.949 9.747 -7.049 921 HE22 GLN 114 2HE2 GLN 114 -22.602 10.229 -7.183 922 H GLY 115 H GLY 115 -24.073 6.001 -10.261 923 HA2 GLY 115 2HA GLY 115 -23.911 3.371 -11.566 924 HA3 GLY 115 3HA GLY 115 -25.467 3.937 -10.975 925 H LEU 116 H LEU 116 -22.767 5.328 -12.850 926 HA LEU 116 HA LEU 116 -24.768 6.322 -14.772 927 HB2 LEU 116 2HB LEU 116 -22.792 7.948 -15.322 928 HB3 LEU 116 3HB LEU 116 -23.882 8.266 -13.973 929 HG LEU 116 HG LEU 116 -22.169 7.248 -12.458 930 HD11 LEU 116 1HD1 LEU 116 -20.870 5.891 -13.854 931 HD12 LEU 116 2HD1 LEU 116 -19.822 7.253 -13.458 932 HD13 LEU 116 3HD1 LEU 116 -20.621 7.183 -15.028 933 HD21 LEU 116 3HD2 LEU 116 -22.414 9.679 -12.752 934 HD22 LEU 116 1HD2 LEU 116 -21.242 9.624 -14.069 935 HD23 LEU 116 2HD2 LEU 116 -20.744 9.209 -12.428 936 H GLU 117 H GLU 117 -23.792 6.708 -17.000 937 HA GLU 117 HA GLU 117 -22.195 4.346 -17.716 938 HB2 GLU 117 2HB GLU 117 -23.122 4.706 -20.012 939 HB3 GLU 117 3HB GLU 117 -24.334 4.330 -18.796 940 HG2 GLU 117 2HG GLU 117 -24.994 6.637 -18.664 941 HG3 GLU 117 3HG GLU 117 -23.692 7.108 -19.755 942 H1 GLY -9 H GLY -9 9.323 -10.502 11.934 943 HA2 GLY -9 2HA GLY -9 9.821 -9.727 14.388 944 HA3 GLY -9 3HA GLY -9 8.304 -10.565 14.680 945 H LYS -8 H LYS -8 9.128 -12.472 12.433 946 HA LYS -8 HA LYS -8 10.379 -14.396 14.167 947 HB2 LYS -8 2HB LYS -8 9.474 -14.507 11.290 948 HB3 LYS -8 3HB LYS -8 10.233 -15.867 12.107 949 HG2 LYS -8 2HG LYS -8 8.435 -16.037 13.660 950 HG3 LYS -8 3HG LYS -8 7.729 -14.521 13.093 951 HD2 LYS -8 2HD LYS -8 6.510 -16.421 12.187 952 HD3 LYS -8 3HD LYS -8 7.332 -15.543 10.895 953 HE2 LYS -8 2HE LYS -8 8.957 -17.203 10.645 954 HE3 LYS -8 3HE LYS -8 8.606 -17.912 12.220 955 HZ1 LYS -8 3HZ LYS -8 6.255 -18.088 10.821 956 HZ2 LYS -8 1HZ LYS -8 7.334 -19.352 11.138 957 HZ3 LYS -8 2HZ LYS -8 7.444 -18.491 9.687 958 H PHE -7 H PHE -7 11.231 -13.341 10.865 959 HA PHE -7 HA PHE -7 13.910 -14.247 11.083 960 HB2 PHE -7 2HB PHE -7 12.430 -12.535 9.108 961 HB3 PHE -7 3HB PHE -7 14.175 -12.730 8.987 962 HD1 PHE -7 HD1 PHE -7 11.040 -14.719 9.238 963 HD2 PHE -7 HD2 PHE -7 15.044 -14.514 7.808 964 HE1 PHE -7 HE1 PHE -7 10.713 -16.837 8.028 965 HE2 PHE -7 HE2 PHE -7 14.723 -16.631 6.596 966 HZ PHE -7 HZ PHE -7 12.556 -17.795 6.704 967 H ILE -6 H ILE -6 12.857 -10.895 10.506 968 HA ILE -6 HA ILE -6 13.792 -8.901 11.100 969 HB ILE -6 HB ILE -6 14.451 -10.258 13.710 970 HG12 ILE -6 2HG1 ILE -6 12.146 -10.795 13.158 971 HG13 ILE -6 3HG1 ILE -6 12.176 -9.588 14.439 972 HG21 ILE -6 1HG2 ILE -6 14.875 -7.672 12.823 973 HG22 ILE -6 2HG2 ILE -6 13.405 -7.556 13.789 974 HG23 ILE -6 3HG2 ILE -6 14.876 -8.219 14.500 975 HD11 ILE -6 3HD1 ILE -6 10.977 -9.469 11.827 976 HD12 ILE -6 1HD1 ILE -6 10.764 -8.404 13.216 977 HD13 ILE -6 2HD1 ILE -6 12.084 -8.121 12.082 978 HA PRO -5 HA PRO -5 18.100 -10.399 10.231 979 HB2 PRO -5 2HB PRO -5 18.428 -8.877 8.008 980 HB3 PRO -5 3HB PRO -5 17.691 -10.483 7.972 981 HG2 PRO -5 2HG PRO -5 16.374 -7.794 7.978 982 HG3 PRO -5 3HG PRO -5 15.981 -9.230 7.015 983 HD2 PRO -5 2HD PRO -5 14.589 -8.536 9.232 984 HD3 PRO -5 3HD PRO -5 14.825 -10.226 8.743 985 H SER -4 H SER -4 19.700 -9.427 11.293 986 HA SER -4 HA SER -4 19.711 -6.483 11.440 987 HB2 SER -4 2HB SER -4 21.105 -7.331 13.677 988 HB3 SER -4 3HB SER -4 19.441 -6.747 13.660 989 HG SER -4 HG SER -4 19.418 -8.735 14.631 990 H ARG -3 H ARG -3 21.146 -8.773 9.857 991 HA ARG -3 HA ARG -3 23.840 -8.841 10.442 992 HB2 ARG -3 2HB ARG -3 22.182 -9.307 8.080 993 HB3 ARG -3 3HB ARG -3 23.807 -8.765 7.682 994 HG2 ARG -3 2HG ARG -3 23.801 -11.146 7.709 995 HG3 ARG -3 3HG ARG -3 24.698 -10.587 9.123 996 HD2 ARG -3 2HD ARG -3 21.783 -11.112 9.406 997 HD3 ARG -3 3HD ARG -3 22.875 -12.491 9.300 998 HE ARG -3 HE ARG -3 22.547 -10.726 11.522 999 HH11 ARG -3 1HH1 ARG -3 24.820 -12.776 9.862 1000 HH12 ARG -3 2HH1 ARG -3 25.790 -13.060 11.269 1001 HH21 ARG -3 1HH2 ARG -3 23.817 -11.093 13.382 1002 HH22 ARG -3 2HH2 ARG -3 25.218 -12.103 13.271 1003 HA PRO -2 HA PRO -2 25.594 -4.910 9.601 1004 HB2 PRO -2 2HB PRO -2 27.892 -5.536 8.299 1005 HB3 PRO -2 3HB PRO -2 27.655 -5.832 10.025 1006 HG2 PRO -2 2HG PRO -2 27.421 -7.736 7.727 1007 HG3 PRO -2 3HG PRO -2 28.176 -7.983 9.312 1008 HD2 PRO -2 2HD PRO -2 25.703 -8.910 8.716 1009 HD3 PRO -2 3HD PRO -2 26.158 -8.387 10.350 1010 H ALA -1 H ALA -1 24.665 -6.940 7.025 1011 HA ALA -1 HA ALA -1 24.109 -6.572 4.848 1012 HB1 ALA -1 1HB ALA -1 23.832 -3.860 4.520 1013 HB2 ALA -1 2HB ALA -1 22.574 -4.966 5.075 1014 HB3 ALA -1 3HB ALA -1 23.549 -4.078 6.247 1015 HA PRO 0 HA PRO 0 28.466 -5.500 3.770 1016 HB2 PRO 0 2HB PRO 0 28.832 -7.668 2.177 1017 HB3 PRO 0 3HB PRO 0 29.074 -7.710 3.927 1018 HG2 PRO 0 2HG PRO 0 26.714 -8.610 2.320 1019 HG3 PRO 0 3HG PRO 0 27.501 -9.407 3.695 1020 HD2 PRO 0 2HD PRO 0 25.211 -7.984 3.950 1021 HD3 PRO 0 3HD PRO 0 26.426 -8.077 5.241 1022 H LYS 1 H LYS 1 29.154 -4.478 1.942 1023 HA LYS 1 HA LYS 1 27.171 -3.866 -0.057 1024 HB2 LYS 1 2HB LYS 1 29.896 -2.881 0.635 1025 HB3 LYS 1 3HB LYS 1 29.325 -2.619 -1.008 1026 HG2 LYS 1 2HG LYS 1 27.266 -1.570 0.005 1027 HG3 LYS 1 3HG LYS 1 28.116 -1.615 1.552 1028 HD2 LYS 1 2HD LYS 1 29.369 -0.367 -0.871 1029 HD3 LYS 1 3HD LYS 1 28.242 0.539 0.142 1030 HE2 LYS 1 2HE LYS 1 29.676 0.037 2.100 1031 HE3 LYS 1 3HE LYS 1 30.825 -0.750 1.019 1032 HZ1 LYS 1 3HZ LYS 1 31.183 1.703 1.677 1033 HZ2 LYS 1 1HZ LYS 1 30.000 2.030 0.513 1034 HZ3 LYS 1 2HZ LYS 1 31.429 1.242 0.068 1035 HA PRO 2 HA PRO 2 28.354 -6.623 -3.257 1036 HB2 PRO 2 2HB PRO 2 28.192 -5.062 -5.473 1037 HB3 PRO 2 3HB PRO 2 26.769 -5.619 -4.584 1038 HG2 PRO 2 2HG PRO 2 28.159 -2.970 -4.466 1039 HG3 PRO 2 3HG PRO 2 26.421 -3.321 -4.507 1040 HD2 PRO 2 2HD PRO 2 27.730 -2.708 -2.217 1041 HD3 PRO 2 3HD PRO 2 26.339 -3.811 -2.256 1042 HA PRO 3 HA PRO 3 32.612 -6.316 -4.311 1043 HB2 PRO 3 2HB PRO 3 32.702 -7.550 -6.728 1044 HB3 PRO 3 3HB PRO 3 32.443 -8.422 -5.213 1045 HG2 PRO 3 2HG PRO 3 30.441 -7.531 -7.252 1046 HG3 PRO 3 3HG PRO 3 30.545 -9.075 -6.387 1047 HD2 PRO 3 2HD PRO 3 28.826 -7.113 -5.663 1048 HD3 PRO 3 3HD PRO 3 29.560 -8.221 -4.486 1049 H SER 4 H SER 4 32.946 -4.098 -4.565 1050 HA SER 4 HA SER 4 32.718 -3.082 -7.322 1051 HB2 SER 4 2HB SER 4 32.947 -1.296 -4.915 1052 HB3 SER 4 3HB SER 4 32.283 -0.929 -6.507 1053 HG SER 4 HG SER 4 30.614 -1.208 -5.011 1054 H SER 5 H SER 5 34.674 -2.762 -4.362 1055 HA SER 5 HA SER 5 37.069 -2.613 -6.052 1056 HB2 SER 5 2HB SER 5 36.921 -0.888 -3.610 1057 HB3 SER 5 3HB SER 5 37.894 -0.684 -5.067 1058 HG SER 5 HG SER 5 35.083 -0.327 -4.864 1059 H ALA 6 H ALA 6 38.339 -4.246 -5.507 1060 HA ALA 6 HA ALA 6 38.082 -5.594 -2.983 1061 HB1 ALA 6 1HB ALA 6 39.740 -6.010 -5.436 1062 HB2 ALA 6 2HB ALA 6 40.113 -6.885 -3.950 1063 HB3 ALA 6 3HB ALA 6 38.531 -7.068 -4.707 Start of MODEL 4 1 H1 MET -2 H MET -2 0.159 -2.615 -8.600 2 HA MET -2 HA MET -2 2.783 -1.877 -7.516 3 HB2 MET -2 2HB MET -2 1.152 -3.645 -6.469 4 HB3 MET -2 3HB MET -2 1.812 -4.702 -7.709 5 HG2 MET -2 2HG MET -2 4.071 -3.619 -6.641 6 HG3 MET -2 3HG MET -2 3.013 -3.722 -5.235 7 HE1 MET -2 3HE MET -2 5.708 -4.911 -5.716 8 HE2 MET -2 1HE MET -2 5.724 -6.657 -5.460 9 HE3 MET -2 2HE MET -2 5.712 -6.006 -7.100 10 H ALA -1 H ALA -1 3.910 -1.302 -9.348 11 HA ALA -1 HA ALA -1 3.887 -2.500 -11.832 12 HB1 ALA -1 1HB ALA -1 6.563 -1.740 -11.313 13 HB2 ALA -1 2HB ALA -1 5.324 -0.853 -12.201 14 HB3 ALA -1 3HB ALA -1 5.512 -0.606 -10.465 15 HA PRO 1 HA PRO 1 5.873 -6.403 -11.552 16 HB2 PRO 1 2HB PRO 1 7.386 -6.454 -13.805 17 HB3 PRO 1 3HB PRO 1 5.624 -6.587 -13.828 18 HG2 PRO 1 2HG PRO 1 7.350 -4.196 -14.343 19 HG3 PRO 1 3HG PRO 1 5.909 -4.746 -15.220 20 HD2 PRO 1 2HD PRO 1 5.830 -2.744 -13.399 21 HD3 PRO 1 3HD PRO 1 4.465 -3.848 -13.664 22 H LEU 2 H LEU 2 7.449 -7.004 -10.216 23 HA LEU 2 HA LEU 2 9.983 -5.510 -10.251 24 HB2 LEU 2 2HB LEU 2 8.354 -5.860 -8.156 25 HB3 LEU 2 3HB LEU 2 9.334 -7.315 -7.998 26 HG LEU 2 HG LEU 2 10.359 -5.749 -6.598 27 HD11 LEU 2 1HD1 LEU 2 12.005 -5.210 -9.016 28 HD12 LEU 2 2HD1 LEU 2 11.779 -6.881 -8.501 29 HD13 LEU 2 3HD1 LEU 2 12.499 -5.708 -7.398 30 HD21 LEU 2 3HD2 LEU 2 10.885 -3.456 -7.262 31 HD22 LEU 2 1HD2 LEU 2 9.154 -3.774 -7.369 32 HD23 LEU 2 2HD2 LEU 2 10.135 -3.736 -8.834 33 H PHE 3 H PHE 3 11.657 -6.510 -11.132 34 HA PHE 3 HA PHE 3 11.928 -9.410 -10.798 35 HB2 PHE 3 2HB PHE 3 12.097 -7.903 -13.410 36 HB3 PHE 3 3HB PHE 3 12.749 -9.524 -13.193 37 HD1 PHE 3 HD2 PHE 3 9.659 -7.518 -13.216 38 HD2 PHE 3 HD1 PHE 3 11.343 -11.427 -13.185 39 HE1 PHE 3 HE2 PHE 3 7.448 -8.470 -13.723 40 HE2 PHE 3 HE1 PHE 3 9.134 -12.386 -13.694 41 HZ PHE 3 HZ PHE 3 7.183 -10.907 -13.962 42 H ALA 4 H ALA 4 13.993 -10.124 -10.513 43 HA ALA 4 HA ALA 4 16.159 -8.146 -10.758 44 HB1 ALA 4 1HB ALA 4 15.372 -9.760 -8.381 45 HB2 ALA 4 2HB ALA 4 17.080 -9.407 -8.647 46 HB3 ALA 4 3HB ALA 4 15.923 -8.087 -8.479 47 H VAL 5 H VAL 5 18.305 -9.079 -10.938 48 HA VAL 5 HA VAL 5 18.276 -11.835 -11.984 49 HB VAL 5 HB VAL 5 18.488 -10.253 -13.835 50 HG11 VAL 5 1HG1 VAL 5 19.677 -8.549 -12.243 51 HG12 VAL 5 2HG1 VAL 5 21.143 -9.337 -12.830 52 HG13 VAL 5 3HG1 VAL 5 20.040 -8.562 -13.968 53 HG21 VAL 5 3HG2 VAL 5 20.310 -12.341 -13.194 54 HG22 VAL 5 1HG2 VAL 5 19.753 -11.812 -14.782 55 HG23 VAL 5 2HG2 VAL 5 21.190 -11.084 -14.063 56 H THR 6 H THR 6 19.692 -13.184 -11.083 57 HA THR 6 HA THR 6 21.376 -12.315 -8.950 58 HB THR 6 HB THR 6 22.232 -14.858 -9.470 59 HG1 THR 6 HG1 THR 6 20.729 -15.025 -11.224 60 HG21 THR 6 3HG2 THR 6 20.559 -13.528 -7.604 61 HG22 THR 6 1HG2 THR 6 21.439 -15.042 -7.398 62 HG23 THR 6 2HG2 THR 6 19.788 -15.059 -8.019 63 H LEU 7 H LEU 7 23.434 -11.687 -9.003 64 HA LEU 7 HA LEU 7 24.900 -11.941 -11.531 65 HB2 LEU 7 2HB LEU 7 25.498 -10.197 -9.147 66 HB3 LEU 7 3HB LEU 7 26.320 -10.158 -10.705 67 HG LEU 7 HG LEU 7 23.400 -9.501 -10.357 68 HD11 LEU 7 1HD1 LEU 7 24.866 -7.179 -10.924 69 HD12 LEU 7 2HD1 LEU 7 25.696 -7.970 -9.585 70 HD13 LEU 7 3HD1 LEU 7 23.985 -7.568 -9.446 71 HD21 LEU 7 3HD2 LEU 7 23.841 -10.058 -12.601 72 HD22 LEU 7 1HD2 LEU 7 25.389 -9.213 -12.592 73 HD23 LEU 7 2HD2 LEU 7 23.883 -8.295 -12.541 74 H TYR 8 H TYR 8 24.808 -13.125 -8.329 75 HA TYR 8 HA TYR 8 27.355 -14.519 -8.780 76 HB2 TYR 8 2HB TYR 8 26.520 -13.500 -6.065 77 HB3 TYR 8 3HB TYR 8 28.077 -14.172 -6.536 78 HD1 TYR 8 HD2 TYR 8 25.876 -11.226 -6.809 79 HD2 TYR 8 HD1 TYR 8 29.753 -12.810 -7.557 80 HE1 TYR 8 HE2 TYR 8 26.706 -8.959 -7.275 81 HE2 TYR 8 HE1 TYR 8 30.594 -10.547 -8.024 82 HH TYR 8 HH TYR 8 29.804 -8.383 -8.657 83 H GLU 9 H GLU 9 27.580 -16.491 -7.463 84 HA GLU 9 HA GLU 9 25.100 -17.967 -7.467 85 HB2 GLU 9 2HB GLU 9 27.139 -19.003 -8.332 86 HB3 GLU 9 3HB GLU 9 27.913 -18.823 -6.764 87 HG2 GLU 9 2HG GLU 9 27.228 -20.895 -6.358 88 HG3 GLU 9 3HG GLU 9 25.622 -20.200 -6.152 89 H PHE 10 H PHE 10 23.777 -17.620 -5.792 90 HA PHE 10 HA PHE 10 24.834 -17.193 -3.124 91 HB2 PHE 10 2HB PHE 10 22.897 -15.881 -4.030 92 HB3 PHE 10 3HB PHE 10 21.945 -17.362 -3.995 93 HD1 PHE 10 HD2 PHE 10 24.231 -15.567 -1.648 94 HD2 PHE 10 HD1 PHE 10 20.483 -17.494 -2.245 95 HE1 PHE 10 HE2 PHE 10 23.633 -15.122 0.696 96 HE2 PHE 10 HE1 PHE 10 19.878 -17.051 0.098 97 HZ PHE 10 HZ PHE 10 21.454 -15.865 1.573 98 H LYS 11 H LYS 11 25.088 -18.731 -1.651 99 HA LYS 11 HA LYS 11 23.876 -21.362 -2.155 100 HB2 LYS 11 2HB LYS 11 26.238 -20.630 -0.413 101 HB3 LYS 11 3HB LYS 11 25.631 -22.259 -0.683 102 HG2 LYS 11 2HG LYS 11 27.286 -22.279 -2.216 103 HG3 LYS 11 3HG LYS 11 26.037 -21.542 -3.221 104 HD2 LYS 11 2HD LYS 11 27.767 -20.078 -3.573 105 HD3 LYS 11 3HD LYS 11 26.985 -19.314 -2.187 106 HE2 LYS 11 2HE LYS 11 29.158 -21.325 -1.768 107 HE3 LYS 11 3HE LYS 11 29.564 -19.663 -2.191 108 HZ1 LYS 11 3HZ LYS 11 29.476 -19.369 0.017 109 HZ2 LYS 11 1HZ LYS 11 28.516 -20.736 0.285 110 HZ3 LYS 11 2HZ LYS 11 27.802 -19.288 -0.219 111 H ALA 12 H ALA 12 21.970 -21.463 -1.125 112 HA ALA 12 HA ALA 12 21.173 -20.072 1.131 113 HB1 ALA 12 1HB ALA 12 20.239 -22.513 -0.256 114 HB2 ALA 12 2HB ALA 12 19.650 -22.249 1.385 115 HB3 ALA 12 3HB ALA 12 19.372 -21.029 0.142 116 H GLU 13 H GLU 13 20.730 -20.883 3.314 117 HA GLU 13 HA GLU 13 22.826 -22.743 4.229 118 HB2 GLU 13 2HB GLU 13 22.641 -21.440 6.422 119 HB3 GLU 13 3HB GLU 13 23.449 -20.644 5.080 120 HG2 GLU 13 2HG GLU 13 21.710 -19.165 4.733 121 HG3 GLU 13 3HG GLU 13 20.535 -20.198 5.545 122 H ARG 14 H ARG 14 19.496 -21.713 4.512 123 HA ARG 14 HA ARG 14 18.944 -24.126 6.110 124 HB2 ARG 14 2HB ARG 14 17.609 -21.420 6.289 125 HB3 ARG 14 3HB ARG 14 17.022 -22.867 7.095 126 HG2 ARG 14 2HG ARG 14 19.798 -21.831 7.545 127 HG3 ARG 14 3HG ARG 14 18.415 -21.230 8.460 128 HD2 ARG 14 2HD ARG 14 18.083 -23.238 9.537 129 HD3 ARG 14 3HD ARG 14 18.857 -24.171 8.256 130 HE ARG 14 HE ARG 14 20.833 -22.596 9.368 131 HH11 ARG 14 1HH1 ARG 14 18.661 -25.098 10.436 132 HH12 ARG 14 2HH1 ARG 14 19.738 -25.694 11.655 133 HH21 ARG 14 1HH2 ARG 14 22.260 -23.371 10.970 134 HH22 ARG 14 2HH2 ARG 14 21.785 -24.710 11.958 135 H ASP 15 H ASP 15 16.312 -24.343 6.020 136 HA ASP 15 HA ASP 15 15.787 -25.231 3.383 137 HB2 ASP 15 2HB ASP 15 14.815 -26.099 5.610 138 HB3 ASP 15 3HB ASP 15 13.657 -24.781 5.461 139 H ASP 16 H ASP 16 14.799 -22.384 5.213 140 HA ASP 16 HA ASP 16 12.880 -21.388 3.438 141 HB2 ASP 16 2HB ASP 16 14.728 -19.637 5.050 142 HB3 ASP 16 3HB ASP 16 13.052 -19.334 4.603 143 H GLU 17 H GLU 17 16.342 -20.576 3.691 144 HA GLU 17 HA GLU 17 16.494 -18.799 1.570 145 HB2 GLU 17 2HB GLU 17 18.601 -20.772 2.467 146 HB3 GLU 17 3HB GLU 17 18.889 -19.349 1.477 147 HG2 GLU 17 2HG GLU 17 18.051 -19.460 4.356 148 HG3 GLU 17 3HG GLU 17 19.534 -18.793 3.676 149 H LEU 18 H LEU 18 17.596 -19.165 -0.546 150 HA LEU 18 HA LEU 18 17.062 -21.802 -1.704 151 HB2 LEU 18 2HB LEU 18 15.093 -20.379 -2.120 152 HB3 LEU 18 3HB LEU 18 16.134 -19.205 -2.924 153 HG LEU 18 HG LEU 18 16.691 -21.387 -4.394 154 HD11 LEU 18 1HD1 LEU 18 14.756 -22.431 -2.854 155 HD12 LEU 18 2HD1 LEU 18 15.054 -22.933 -4.518 156 HD13 LEU 18 3HD1 LEU 18 13.776 -21.771 -4.163 157 HD21 LEU 18 3HD2 LEU 18 14.562 -20.477 -5.758 158 HD22 LEU 18 1HD2 LEU 18 16.106 -19.627 -5.682 159 HD23 LEU 18 2HD2 LEU 18 14.782 -19.148 -4.619 160 H ASP 19 H ASP 19 18.417 -22.386 -3.365 161 HA ASP 19 HA ASP 19 20.822 -20.785 -3.639 162 HB2 ASP 19 2HB ASP 19 21.155 -23.138 -3.289 163 HB3 ASP 19 3HB ASP 19 20.080 -23.544 -4.625 164 H VAL 20 H VAL 20 21.593 -19.891 -5.524 165 HA VAL 20 HA VAL 20 20.117 -20.194 -8.000 166 HB VAL 20 HB VAL 20 18.821 -18.436 -6.961 167 HG11 VAL 20 1HG1 VAL 20 21.419 -16.932 -6.663 168 HG12 VAL 20 2HG1 VAL 20 19.813 -16.330 -6.251 169 HG13 VAL 20 3HG1 VAL 20 20.509 -17.678 -5.350 170 HG21 VAL 20 3HG2 VAL 20 19.530 -18.341 -9.422 171 HG22 VAL 20 1HG2 VAL 20 18.869 -16.873 -8.701 172 HG23 VAL 20 2HG2 VAL 20 20.610 -17.039 -8.926 173 H SER 21 H SER 21 21.305 -19.658 -9.808 174 HA SER 21 HA SER 21 24.136 -19.070 -9.301 175 HB2 SER 21 2HB SER 21 22.674 -20.612 -11.394 176 HB3 SER 21 3HB SER 21 24.188 -19.832 -11.852 177 HG SER 21 HG SER 21 23.747 -22.015 -10.247 178 HA PRO 22 HA PRO 22 24.043 -15.157 -11.282 179 HB2 PRO 22 2HB PRO 22 26.372 -15.153 -12.677 180 HB3 PRO 22 3HB PRO 22 26.308 -15.025 -10.915 181 HG2 PRO 22 2HG PRO 22 26.857 -17.422 -12.622 182 HG3 PRO 22 3HG PRO 22 27.670 -16.896 -11.136 183 HD2 PRO 22 2HD PRO 22 25.803 -18.857 -11.158 184 HD3 PRO 22 3HD PRO 22 26.023 -17.763 -9.777 185 H GLY 23 H GLY 23 22.843 -14.481 -12.939 186 HA2 GLY 23 2HA GLY 23 22.670 -14.118 -15.331 187 HA3 GLY 23 3HA GLY 23 23.228 -15.768 -15.566 188 H GLU 24 H GLU 24 21.171 -15.900 -13.020 189 HA GLU 24 HA GLU 24 19.012 -16.885 -14.714 190 HB2 GLU 24 2HB GLU 24 19.845 -17.288 -11.886 191 HB3 GLU 24 3HB GLU 24 18.135 -17.459 -12.258 192 HG2 GLU 24 2HG GLU 24 20.148 -18.893 -13.922 193 HG3 GLU 24 3HG GLU 24 19.717 -19.523 -12.333 194 H ASN 25 H ASN 25 16.732 -16.483 -13.832 195 HA ASN 25 HA ASN 25 16.480 -13.627 -13.151 196 HB2 ASN 25 2HB ASN 25 14.563 -15.320 -14.770 197 HB3 ASN 25 3HB ASN 25 14.391 -13.602 -14.422 198 HD21 ASN 25 1HD2 ASN 25 15.003 -12.302 -15.978 199 HD22 ASN 25 2HD2 ASN 25 16.177 -12.647 -17.197 200 H LEU 26 H LEU 26 15.376 -13.109 -11.369 201 HA LEU 26 HA LEU 26 13.689 -15.179 -10.124 202 HB2 LEU 26 2HB LEU 26 15.443 -13.192 -8.688 203 HB3 LEU 26 3HB LEU 26 14.421 -14.417 -7.939 204 HG LEU 26 HG LEU 26 16.051 -15.918 -9.556 205 HD11 LEU 26 1HD1 LEU 26 17.324 -13.683 -9.864 206 HD12 LEU 26 2HD1 LEU 26 18.232 -15.153 -9.511 207 HD13 LEU 26 3HD1 LEU 26 17.908 -13.987 -8.228 208 HD21 LEU 26 3HD2 LEU 26 15.530 -16.601 -7.363 209 HD22 LEU 26 1HD2 LEU 26 16.239 -15.149 -6.656 210 HD23 LEU 26 2HD2 LEU 26 17.279 -16.374 -7.383 211 H SER 27 H SER 27 11.806 -14.503 -9.128 212 HA SER 27 HA SER 27 10.915 -11.821 -9.891 213 HB2 SER 27 2HB SER 27 9.680 -14.350 -9.941 214 HB3 SER 27 3HB SER 27 8.854 -13.438 -8.678 215 HG SER 27 HG SER 27 8.587 -11.749 -10.248 216 H ILE 28 H ILE 28 11.166 -10.285 -8.417 217 HA ILE 28 HA ILE 28 11.409 -10.882 -5.614 218 HB ILE 28 HB ILE 28 11.404 -8.291 -7.151 219 HG12 ILE 28 2HG1 ILE 28 13.556 -9.743 -5.595 220 HG13 ILE 28 3HG1 ILE 28 13.409 -9.708 -7.348 221 HG21 ILE 28 1HG2 ILE 28 12.070 -7.223 -5.000 222 HG22 ILE 28 2HG2 ILE 28 10.401 -7.790 -5.036 223 HG23 ILE 28 3HG2 ILE 28 11.629 -8.719 -4.177 224 HD11 ILE 28 3HD1 ILE 28 13.739 -7.272 -7.297 225 HD12 ILE 28 1HD1 ILE 28 13.965 -7.361 -5.551 226 HD13 ILE 28 2HD1 ILE 28 15.106 -8.163 -6.631 227 H CYS 29 H CYS 29 9.981 -10.439 -3.984 228 HA CYS 29 HA CYS 29 7.286 -9.577 -4.808 229 HB2 CYS 29 2HB CYS 29 7.967 -11.498 -2.572 230 HB3 CYS 29 3HB CYS 29 6.355 -11.049 -3.114 231 HG CYS 29 HG CYS 29 6.259 -12.551 -5.290 232 H ALA 30 H ALA 30 9.532 -9.729 -2.055 233 HA ALA 30 HA ALA 30 8.677 -7.057 -1.258 234 HB1 ALA 30 1HB ALA 30 7.198 -8.284 0.089 235 HB2 ALA 30 2HB ALA 30 8.422 -9.494 0.478 236 HB3 ALA 30 3HB ALA 30 8.543 -7.868 1.152 237 H HIS 31 H HIS 31 10.060 -6.327 0.696 238 HA HIS 31 HA HIS 31 12.791 -7.393 0.425 239 HB2 HIS 31 2HB HIS 31 13.720 -5.206 0.355 240 HB3 HIS 31 3HB HIS 31 12.408 -5.217 -0.820 241 HD1 HIS 31 HD1 HIS 31 13.765 -2.957 1.368 242 HD2 HIS 31 HD2 HIS 31 9.883 -4.361 0.901 243 HE1 HIS 31 HE1 HIS 31 12.286 -1.200 2.395 244 H TYR 32 H TYR 32 14.202 -6.257 2.249 245 HA TYR 32 HA TYR 32 12.686 -6.153 4.754 246 HB2 TYR 32 2HB TYR 32 13.591 -8.486 4.338 247 HB3 TYR 32 3HB TYR 32 15.204 -7.796 4.481 248 HD1 TYR 32 HD2 TYR 32 11.988 -8.107 6.339 249 HD2 TYR 32 HD1 TYR 32 16.210 -7.640 6.574 250 HE1 TYR 32 HE2 TYR 32 11.875 -8.371 8.781 251 HE2 TYR 32 HE1 TYR 32 16.109 -7.904 9.017 252 HH TYR 32 HH TYR 32 14.810 -8.239 10.781 253 H ASP 33 H ASP 33 13.086 -4.049 5.194 254 HA ASP 33 HA ASP 33 14.212 -2.148 5.745 255 HB2 ASP 33 2HB ASP 33 15.011 -3.726 7.528 256 HB3 ASP 33 3HB ASP 33 16.437 -4.034 6.540 257 H TYR 34 H TYR 34 14.576 -3.307 3.037 258 HA TYR 34 HA TYR 34 15.706 -2.812 1.126 259 HB2 TYR 34 2HB TYR 34 17.136 -0.714 2.766 260 HB3 TYR 34 3HB TYR 34 16.961 -0.752 1.015 261 HD1 TYR 34 HD2 TYR 34 15.213 -0.156 4.197 262 HD2 TYR 34 HD1 TYR 34 14.935 -0.017 -0.046 263 HE1 TYR 34 HE2 TYR 34 13.152 1.174 4.382 264 HE2 TYR 34 HE1 TYR 34 12.875 1.315 0.126 265 HH TYR 34 HH TYR 34 11.875 2.930 1.961 266 H GLU 35 H GLU 35 16.783 -4.696 3.170 267 HA GLU 35 HA GLU 35 19.620 -4.639 2.374 268 HB2 GLU 35 2HB GLU 35 18.582 -6.246 4.687 269 HB3 GLU 35 3HB GLU 35 20.215 -5.668 4.388 270 HG2 GLU 35 2HG GLU 35 17.849 -3.977 5.163 271 HG3 GLU 35 3HG GLU 35 19.179 -4.458 6.215 272 H TRP 36 H TRP 36 16.922 -6.849 3.078 273 HA TRP 36 HA TRP 36 18.156 -8.803 1.252 274 HB2 TRP 36 2HB TRP 36 16.130 -9.300 3.445 275 HB3 TRP 36 3HB TRP 36 16.884 -10.527 2.431 276 HD1 TRP 36 HD1 TRP 36 17.685 -8.138 5.326 277 HE1 TRP 36 HE1 TRP 36 19.826 -8.962 6.494 278 HE3 TRP 36 HE3 TRP 36 18.996 -11.867 2.083 279 HZ2 TRP 36 HZ2 TRP 36 21.807 -10.932 6.094 280 HZ3 TRP 36 HZ3 TRP 36 21.028 -13.174 2.548 281 HH2 TRP 36 HH2 TRP 36 22.404 -12.714 4.512 282 H PHE 37 H PHE 37 16.944 -9.733 -0.373 283 HA PHE 37 HA PHE 37 14.299 -8.521 -0.847 284 HB2 PHE 37 2HB PHE 37 16.661 -8.638 -2.531 285 HB3 PHE 37 3HB PHE 37 15.267 -9.362 -3.326 286 HD1 PHE 37 HD2 PHE 37 13.025 -7.802 -2.591 287 HD2 PHE 37 HD1 PHE 37 17.019 -6.515 -3.307 288 HE1 PHE 37 HE2 PHE 37 12.195 -5.561 -3.176 289 HE2 PHE 37 HE1 PHE 37 16.195 -4.272 -3.892 290 HZ PHE 37 HZ PHE 37 13.780 -3.793 -3.828 291 H ILE 38 H ILE 38 12.633 -9.854 -1.248 292 HA ILE 38 HA ILE 38 13.115 -12.715 -1.060 293 HB ILE 38 HB ILE 38 10.452 -11.314 -1.268 294 HG12 ILE 38 2HG1 ILE 38 11.650 -10.403 0.643 295 HG13 ILE 38 3HG1 ILE 38 10.375 -11.478 1.205 296 HG21 ILE 38 1HG2 ILE 38 11.227 -14.042 -1.210 297 HG22 ILE 38 2HG2 ILE 38 10.406 -13.675 0.307 298 HG23 ILE 38 3HG2 ILE 38 9.600 -13.362 -1.230 299 HD11 ILE 38 3HD1 ILE 38 13.132 -11.547 1.804 300 HD12 ILE 38 1HD1 ILE 38 11.857 -12.628 2.366 301 HD13 ILE 38 2HD1 ILE 38 12.745 -13.003 0.888 302 H ALA 39 H ALA 39 13.908 -13.373 -3.024 303 HA ALA 39 HA ALA 39 12.204 -12.890 -5.377 304 HB1 ALA 39 1HB ALA 39 14.956 -13.959 -5.688 305 HB2 ALA 39 2HB ALA 39 14.043 -12.859 -6.722 306 HB3 ALA 39 3HB ALA 39 14.772 -12.266 -5.230 307 H LYS 40 H LYS 40 11.499 -14.592 -6.619 308 HA LYS 40 HA LYS 40 11.944 -17.275 -5.485 309 HB2 LYS 40 2HB LYS 40 9.738 -17.883 -6.096 310 HB3 LYS 40 3HB LYS 40 9.607 -16.300 -5.340 311 HG2 LYS 40 2HG LYS 40 8.354 -15.806 -7.125 312 HG3 LYS 40 3HG LYS 40 9.906 -15.604 -7.942 313 HD2 LYS 40 2HD LYS 40 8.878 -17.036 -9.400 314 HD3 LYS 40 3HD LYS 40 9.647 -18.204 -8.324 315 HE2 LYS 40 2HE LYS 40 7.401 -18.918 -8.654 316 HE3 LYS 40 3HE LYS 40 7.507 -18.269 -7.019 317 HZ1 LYS 40 3HZ LYS 40 5.956 -17.349 -9.258 318 HZ2 LYS 40 1HZ LYS 40 6.807 -16.109 -8.484 319 HZ3 LYS 40 2HZ LYS 40 5.734 -17.075 -7.604 320 HA PRO 41 HA PRO 41 13.634 -18.639 -9.301 321 HB2 PRO 41 2HB PRO 41 12.804 -21.223 -9.344 322 HB3 PRO 41 3HB PRO 41 14.068 -20.638 -8.255 323 HG2 PRO 41 2HG PRO 41 11.167 -21.127 -7.700 324 HG3 PRO 41 3HG PRO 41 12.580 -21.529 -6.707 325 HD2 PRO 41 2HD PRO 41 11.027 -19.365 -6.223 326 HD3 PRO 41 3HD PRO 41 12.769 -19.384 -5.885 327 H ILE 42 H ILE 42 12.687 -17.643 -11.018 328 HA ILE 42 HA ILE 42 9.978 -17.998 -11.783 329 HB ILE 42 HB ILE 42 12.297 -16.971 -13.424 330 HG12 ILE 42 2HG1 ILE 42 10.211 -15.484 -11.813 331 HG13 ILE 42 3HG1 ILE 42 11.899 -15.685 -11.357 332 HG21 ILE 42 1HG2 ILE 42 9.320 -16.766 -13.855 333 HG22 ILE 42 2HG2 ILE 42 10.534 -15.880 -14.776 334 HG23 ILE 42 3HG2 ILE 42 10.478 -17.640 -14.857 335 HD11 ILE 42 3HD1 ILE 42 11.562 -13.494 -12.275 336 HD12 ILE 42 1HD1 ILE 42 12.554 -14.443 -13.381 337 HD13 ILE 42 2HD1 ILE 42 10.847 -14.176 -13.735 338 H ASN 43 H ASN 43 13.001 -19.513 -12.763 339 HA ASN 43 HA ASN 43 11.577 -21.171 -14.710 340 HB2 ASN 43 2HB ASN 43 14.470 -20.550 -14.216 341 HB3 ASN 43 3HB ASN 43 14.024 -21.993 -15.121 342 HD21 ASN 43 1HD2 ASN 43 14.880 -18.854 -15.411 343 HD22 ASN 43 2HD2 ASN 43 14.196 -18.501 -16.958 344 H ARG 43 H ARG 43 14.022 -21.669 -12.156 345 HA ARG 43 HA ARG 43 13.789 -24.418 -11.940 346 HB2 ARG 43 2HB ARG 43 14.336 -22.488 -9.678 347 HB3 ARG 43 3HB ARG 43 14.761 -24.194 -9.719 348 HG2 ARG 43 2HG ARG 43 15.842 -22.113 -11.608 349 HG3 ARG 43 3HG ARG 43 16.669 -22.696 -10.162 350 HD2 ARG 43 2HD ARG 43 17.609 -24.010 -11.809 351 HD3 ARG 43 3HD ARG 43 16.304 -25.041 -11.222 352 HE ARG 43 HE ARG 43 15.323 -23.504 -13.341 353 HH11 ARG 43 1HH1 ARG 43 17.619 -26.056 -12.760 354 HH12 ARG 43 2HH1 ARG 43 17.455 -26.742 -14.342 355 HH21 ARG 43 1HH2 ARG 43 15.098 -24.399 -15.428 356 HH22 ARG 43 2HH2 ARG 43 16.021 -25.798 -15.859 357 H LEU 44 H LEU 44 12.876 -25.639 -10.051 358 HA LEU 44 HA LEU 44 10.272 -24.551 -9.219 359 HB2 LEU 44 2HB LEU 44 10.912 -27.101 -10.588 360 HB3 LEU 44 3HB LEU 44 9.678 -27.146 -9.331 361 HG LEU 44 HG LEU 44 9.608 -25.417 -11.803 362 HD11 LEU 44 1HD1 LEU 44 8.163 -27.957 -11.077 363 HD12 LEU 44 2HD1 LEU 44 9.273 -27.699 -12.422 364 HD13 LEU 44 3HD1 LEU 44 7.700 -26.901 -12.412 365 HD21 LEU 44 3HD2 LEU 44 7.110 -25.366 -10.898 366 HD22 LEU 44 1HD2 LEU 44 8.321 -24.190 -10.386 367 HD23 LEU 44 2HD2 LEU 44 7.941 -25.570 -9.355 368 H GLY 45 H GLY 45 10.091 -24.480 -7.083 369 HA2 GLY 45 2HA GLY 45 10.618 -26.626 -5.356 370 HA3 GLY 45 3HA GLY 45 12.005 -25.549 -5.320 371 H GLY 46 H GLY 46 10.672 -23.090 -5.603 372 HA2 GLY 46 2HA GLY 46 8.608 -22.196 -4.340 373 HA3 GLY 46 3HA GLY 46 9.392 -22.942 -2.956 374 HA PRO 47 HA PRO 47 10.870 -18.492 -3.755 375 HB2 PRO 47 2HB PRO 47 9.558 -17.277 -1.712 376 HB3 PRO 47 3HB PRO 47 8.877 -17.429 -3.336 377 HG2 PRO 47 2HG PRO 47 8.354 -19.088 -0.900 378 HG3 PRO 47 3HG PRO 47 7.203 -18.463 -2.096 379 HD2 PRO 47 2HD PRO 47 8.089 -21.022 -2.124 380 HD3 PRO 47 3HD PRO 47 7.671 -20.140 -3.607 381 H GLY 48 H GLY 48 12.593 -17.649 -2.648 382 HA2 GLY 48 2HA GLY 48 13.179 -18.828 -0.004 383 HA3 GLY 48 3HA GLY 48 14.412 -18.694 -1.249 384 H LEU 49 H LEU 49 15.821 -17.281 -0.383 385 HA LEU 49 HA LEU 49 14.921 -14.538 -0.051 386 HB2 LEU 49 2HB LEU 49 14.926 -15.941 2.183 387 HB3 LEU 49 3HB LEU 49 16.656 -15.611 2.117 388 HG LEU 49 HG LEU 49 14.785 -13.314 1.850 389 HD11 LEU 49 1HD1 LEU 49 15.172 -14.948 4.321 390 HD12 LEU 49 2HD1 LEU 49 13.707 -14.198 3.689 391 HD13 LEU 49 3HD1 LEU 49 14.955 -13.201 4.437 392 HD21 LEU 49 3HD2 LEU 49 16.655 -12.399 3.397 393 HD22 LEU 49 1HD2 LEU 49 16.999 -12.664 1.687 394 HD23 LEU 49 2HD2 LEU 49 17.541 -13.837 2.887 395 H VAL 50 H VAL 50 16.320 -13.217 -1.003 396 HA VAL 50 HA VAL 50 19.161 -13.952 -1.082 397 HB VAL 50 HB VAL 50 18.175 -14.628 -3.233 398 HG11 VAL 50 1HG1 VAL 50 17.535 -11.708 -3.620 399 HG12 VAL 50 2HG1 VAL 50 17.230 -13.023 -4.756 400 HG13 VAL 50 3HG1 VAL 50 16.346 -12.951 -3.231 401 HG21 VAL 50 3HG2 VAL 50 19.997 -12.228 -3.387 402 HG22 VAL 50 1HG2 VAL 50 20.488 -13.910 -3.187 403 HG23 VAL 50 2HG2 VAL 50 19.729 -13.386 -4.690 404 HA PRO 51 HA PRO 51 19.588 -9.748 0.231 405 HB2 PRO 51 2HB PRO 51 22.281 -9.567 -0.067 406 HB3 PRO 51 3HB PRO 51 21.518 -10.440 1.268 407 HG2 PRO 51 2HG PRO 51 22.663 -11.506 -1.284 408 HG3 PRO 51 3HG PRO 51 22.822 -12.140 0.364 409 HD2 PRO 51 2HD PRO 51 21.087 -13.180 -1.435 410 HD3 PRO 51 3HD PRO 51 20.754 -13.155 0.309 411 H VAL 52 H VAL 52 19.951 -7.705 -0.646 412 HA VAL 52 HA VAL 52 19.582 -7.423 -3.420 413 HB VAL 52 HB VAL 52 20.642 -5.273 -1.590 414 HG11 VAL 52 1HG1 VAL 52 20.285 -3.874 -3.282 415 HG12 VAL 52 2HG1 VAL 52 20.038 -5.288 -4.309 416 HG13 VAL 52 3HG1 VAL 52 18.658 -4.503 -3.540 417 HG21 VAL 52 3HG2 VAL 52 18.801 -5.528 -0.358 418 HG22 VAL 52 1HG2 VAL 52 17.892 -4.963 -1.759 419 HG23 VAL 52 2HG2 VAL 52 18.117 -6.692 -1.492 420 H SER 53 H SER 53 22.423 -7.775 -1.514 421 HA SER 53 HA SER 53 24.223 -6.570 -3.404 422 HB2 SER 53 2HB SER 53 24.542 -8.132 -0.864 423 HB3 SER 53 3HB SER 53 25.934 -7.892 -1.920 424 HG SER 53 HG SER 53 24.927 -6.202 -0.161 425 H TYR 54 H TYR 54 22.458 -9.332 -3.512 426 HA TYR 54 HA TYR 54 24.443 -10.668 -5.230 427 HB2 TYR 54 2HB TYR 54 22.540 -11.853 -3.225 428 HB3 TYR 54 3HB TYR 54 23.160 -12.810 -4.565 429 HD1 TYR 54 HD2 TYR 54 24.544 -10.452 -2.006 430 HD2 TYR 54 HD1 TYR 54 24.954 -14.155 -4.060 431 HE1 TYR 54 HE2 TYR 54 26.576 -10.939 -0.710 432 HE2 TYR 54 HE1 TYR 54 26.987 -14.653 -2.768 433 HH TYR 54 HH TYR 54 28.676 -13.555 -1.496 434 H VAL 55 H VAL 55 22.056 -8.772 -5.615 435 HA VAL 55 HA VAL 55 21.032 -10.128 -7.962 436 HB VAL 55 HB VAL 55 18.644 -9.526 -7.325 437 HG11 VAL 55 1HG1 VAL 55 18.283 -11.621 -6.171 438 HG12 VAL 55 2HG1 VAL 55 19.522 -11.830 -7.409 439 HG13 VAL 55 3HG1 VAL 55 19.984 -11.694 -5.712 440 HG21 VAL 55 3HG2 VAL 55 19.111 -9.885 -4.495 441 HG22 VAL 55 1HG2 VAL 55 19.898 -8.427 -5.099 442 HG23 VAL 55 2HG2 VAL 55 18.165 -8.654 -5.331 443 H ARG 56 H ARG 56 20.003 -8.712 -9.453 444 HA ARG 56 HA ARG 56 20.399 -5.851 -8.870 445 HB2 ARG 56 2HB ARG 56 22.127 -6.401 -10.385 446 HB3 ARG 56 3HB ARG 56 21.066 -7.416 -11.352 447 HG2 ARG 56 2HG ARG 56 19.859 -5.445 -12.120 448 HG3 ARG 56 3HG ARG 56 20.898 -4.418 -11.131 449 HD2 ARG 56 2HD ARG 56 22.242 -6.262 -13.014 450 HD3 ARG 56 3HD ARG 56 21.360 -4.910 -13.722 451 HE ARG 56 HE ARG 56 22.836 -3.706 -11.825 452 HH11 ARG 56 1HH1 ARG 56 23.642 -5.974 -14.340 453 HH12 ARG 56 2HH1 ARG 56 25.256 -5.378 -14.540 454 HH21 ARG 56 1HH2 ARG 56 24.959 -2.912 -12.079 455 HH22 ARG 56 2HH2 ARG 56 26.004 -3.637 -13.253 456 H ILE 57 H ILE 57 18.566 -4.747 -8.923 457 HA ILE 57 HA ILE 57 16.123 -5.850 -9.835 458 HB ILE 57 HB ILE 57 16.619 -2.917 -9.362 459 HG12 ILE 57 2HG1 ILE 57 17.548 -4.047 -7.448 460 HG13 ILE 57 3HG1 ILE 57 15.982 -3.389 -6.985 461 HG21 ILE 57 1HG2 ILE 57 14.167 -4.593 -8.860 462 HG22 ILE 57 2HG2 ILE 57 14.300 -2.838 -8.778 463 HG23 ILE 57 3HG2 ILE 57 14.444 -3.661 -10.331 464 HD11 ILE 57 3HD1 ILE 57 15.490 -5.400 -6.209 465 HD12 ILE 57 1HD1 ILE 57 15.419 -5.950 -7.883 466 HD13 ILE 57 2HD1 ILE 57 16.915 -6.113 -6.964 467 H ILE 58 H ILE 58 15.585 -6.137 -11.889 468 HA ILE 58 HA ILE 58 16.116 -3.970 -13.799 469 HB ILE 58 HB ILE 58 16.501 -5.774 -15.551 470 HG12 ILE 58 2HG1 ILE 58 17.596 -7.584 -13.515 471 HG13 ILE 58 3HG1 ILE 58 15.838 -7.481 -13.502 472 HG21 ILE 58 1HG2 ILE 58 18.692 -5.335 -15.380 473 HG22 ILE 58 2HG2 ILE 58 18.225 -4.354 -13.992 474 HG23 ILE 58 3HG2 ILE 58 18.798 -6.005 -13.752 475 HD11 ILE 58 3HD1 ILE 58 15.713 -8.179 -15.777 476 HD12 ILE 58 1HD1 ILE 58 17.464 -8.075 -15.958 477 HD13 ILE 58 2HD1 ILE 58 16.758 -9.306 -14.911 478 H ASP 59 H ASP 59 14.502 -3.562 -15.232 479 HA ASP 59 HA ASP 59 11.926 -4.686 -14.680 480 HB2 ASP 59 2HB ASP 59 12.065 -2.347 -15.248 481 HB3 ASP 59 3HB ASP 59 12.864 -2.719 -16.774 482 H LEU 60 H LEU 60 11.081 -6.453 -15.546 483 HA LEU 60 HA LEU 60 12.344 -8.132 -17.333 484 HB2 LEU 60 2HB LEU 60 10.118 -8.300 -15.838 485 HB3 LEU 60 3HB LEU 60 9.391 -8.110 -17.432 486 HG LEU 60 HG LEU 60 11.237 -10.314 -16.523 487 HD11 LEU 60 1HD1 LEU 60 8.696 -11.037 -17.709 488 HD12 LEU 60 2HD1 LEU 60 8.495 -10.029 -16.276 489 HD13 LEU 60 3HD1 LEU 60 9.411 -11.533 -16.175 490 HD21 LEU 60 3HD2 LEU 60 10.207 -9.593 -19.252 491 HD22 LEU 60 1HD2 LEU 60 10.700 -11.235 -18.834 492 HD23 LEU 60 2HD2 LEU 60 11.868 -9.915 -18.750 493 H MET 61 H MET 61 10.268 -5.393 -17.969 494 HA MET 61 HA MET 61 10.068 -5.988 -20.797 495 HB2 MET 61 2HB MET 61 8.861 -4.061 -18.926 496 HB3 MET 61 3HB MET 61 9.153 -3.432 -20.542 497 HG2 MET 61 2HG MET 61 6.903 -4.340 -20.311 498 HG3 MET 61 3HG MET 61 7.847 -5.223 -21.509 499 HE1 MET 61 3HE MET 61 8.432 -6.318 -17.458 500 HE2 MET 61 1HE MET 61 7.410 -4.933 -17.843 501 HE3 MET 61 2HE MET 61 6.678 -6.450 -17.319 502 H ASP 62 H ASP 62 12.001 -4.035 -18.667 503 HA ASP 62 HA ASP 62 13.701 -3.303 -20.926 504 HB2 ASP 62 2HB ASP 62 13.044 -1.189 -18.898 505 HB3 ASP 62 3HB ASP 62 13.704 -1.003 -20.520 506 HA PRO 63 HA PRO 63 16.058 -4.826 -17.249 507 HB2 PRO 63 2HB PRO 63 17.722 -6.411 -18.695 508 HB3 PRO 63 3HB PRO 63 16.139 -6.949 -18.124 509 HG2 PRO 63 2HG PRO 63 16.936 -5.945 -20.829 510 HG3 PRO 63 3HG PRO 63 15.893 -7.315 -20.407 511 HD2 PRO 63 2HD PRO 63 14.905 -4.916 -21.181 512 HD3 PRO 63 3HD PRO 63 14.064 -5.966 -20.023 513 H ALA 64 H ALA 64 16.681 -3.013 -20.039 514 HA ALA 64 HA ALA 64 19.489 -2.550 -19.377 515 HB1 ALA 64 1HB ALA 64 18.303 -0.997 -21.565 516 HB2 ALA 64 2HB ALA 64 19.791 -1.943 -21.518 517 HB3 ALA 64 3HB ALA 64 18.243 -2.746 -21.781 518 H LYS 65 H LYS 65 16.533 -1.347 -18.484 519 HA LYS 65 HA LYS 65 17.269 1.448 -18.353 520 HB2 LYS 65 2HB LYS 65 14.855 -0.159 -17.624 521 HB3 LYS 65 3HB LYS 65 15.061 1.435 -16.910 522 HG2 LYS 65 2HG LYS 65 15.546 1.892 -19.574 523 HG3 LYS 65 3HG LYS 65 14.262 0.681 -19.601 524 HD2 LYS 65 2HD LYS 65 13.151 2.753 -19.557 525 HD3 LYS 65 3HD LYS 65 13.061 2.150 -17.901 526 HE2 LYS 65 2HE LYS 65 14.446 3.760 -17.098 527 HE3 LYS 65 3HE LYS 65 15.396 3.836 -18.581 528 HZ1 LYS 65 3HZ LYS 65 13.503 5.009 -19.619 529 HZ2 LYS 65 1HZ LYS 65 14.188 5.864 -18.330 530 HZ3 LYS 65 2HZ LYS 65 12.725 5.044 -18.117 531 H TYR 66 H TYR 66 16.576 -1.133 -15.997 532 HA TYR 66 HA TYR 66 17.862 0.479 -13.914 533 HB2 TYR 66 2HB TYR 66 16.107 -1.975 -13.777 534 HB3 TYR 66 3HB TYR 66 16.915 -1.287 -12.374 535 HD1 TYR 66 HD1 TYR 66 14.725 -0.160 -15.191 536 HD2 TYR 66 HD2 TYR 66 15.688 0.152 -11.058 537 HE1 TYR 66 HE1 TYR 66 12.841 1.389 -14.875 538 HE2 TYR 66 HE2 TYR 66 13.806 1.701 -10.731 539 HH TYR 66 HH TYR 66 12.481 3.327 -12.225 540 H ALA 67 H ALA 67 19.247 -1.050 -16.095 541 HA ALA 67 HA ALA 67 20.589 -3.211 -14.720 542 HB1 ALA 67 1HB ALA 67 21.939 -2.465 -17.118 543 HB2 ALA 67 2HB ALA 67 20.983 -3.910 -16.787 544 HB3 ALA 67 3HB ALA 67 20.200 -2.460 -17.414 545 H SER 68 H SER 68 20.970 0.154 -15.006 546 HA SER 68 HA SER 68 23.833 0.049 -14.403 547 HB2 SER 68 2HB SER 68 22.139 2.511 -14.852 548 HB3 SER 68 3HB SER 68 23.898 2.396 -14.893 549 HG SER 68 HG SER 68 22.267 2.154 -16.914 550 H VAL 69 H VAL 69 20.798 0.442 -12.890 551 HA VAL 69 HA VAL 69 21.285 2.127 -10.765 552 HB VAL 69 HB VAL 69 19.108 0.978 -11.305 553 HG11 VAL 69 1HG1 VAL 69 20.365 -1.324 -11.215 554 HG12 VAL 69 2HG1 VAL 69 19.941 -1.245 -9.504 555 HG13 VAL 69 3HG1 VAL 69 18.674 -1.201 -10.731 556 HG21 VAL 69 3HG2 VAL 69 19.326 0.459 -8.456 557 HG22 VAL 69 1HG2 VAL 69 20.077 1.985 -8.921 558 HG23 VAL 69 2HG2 VAL 69 18.385 1.680 -9.313 559 H ASP 70 H ASP 70 21.991 1.823 -8.624 560 HA ASP 70 HA ASP 70 23.942 -0.355 -8.331 561 HB2 ASP 70 2HB ASP 70 23.753 2.258 -6.816 562 HB3 ASP 70 3HB ASP 70 25.029 1.055 -6.650 563 H THR 71 H THR 71 22.503 -1.952 -7.628 564 HA THR 71 HA THR 71 20.543 -1.756 -5.697 565 HB THR 71 HB THR 71 21.526 -4.249 -5.178 566 HG1 THR 71 HG1 THR 71 22.968 -4.735 -6.636 567 HG21 THR 71 3HG2 THR 71 19.307 -3.256 -6.286 568 HG22 THR 71 1HG2 THR 71 19.706 -4.973 -6.341 569 HG23 THR 71 2HG2 THR 71 20.049 -3.943 -7.731 570 H TYR 72 H TYR 72 24.009 -2.346 -5.254 571 HA TYR 72 HA TYR 72 24.054 -2.865 -2.535 572 HB2 TYR 72 2HB TYR 72 26.055 -3.132 -3.825 573 HB3 TYR 72 3HB TYR 72 26.060 -1.432 -4.280 574 HD1 TYR 72 HD1 TYR 72 25.694 -3.150 -0.980 575 HD2 TYR 72 HD2 TYR 72 27.919 -0.415 -3.362 576 HE1 TYR 72 HE1 TYR 72 27.129 -2.644 0.952 577 HE2 TYR 72 HE2 TYR 72 29.361 0.098 -1.436 578 HH TYR 72 HH TYR 72 29.560 -0.105 0.820 579 H ASP 73 H ASP 73 24.096 0.261 -4.203 580 HA ASP 73 HA ASP 73 24.388 1.864 -1.904 581 HB2 ASP 73 2HB ASP 73 24.767 2.668 -4.220 582 HB3 ASP 73 3HB ASP 73 23.033 2.577 -4.513 583 H ARG 74 H ARG 74 23.041 1.821 -0.230 584 HA ARG 74 HA ARG 74 20.432 0.888 -0.200 585 HB2 ARG 74 2HB ARG 74 20.257 1.763 1.990 586 HB3 ARG 74 3HB ARG 74 21.956 1.360 1.779 587 HG2 ARG 74 2HG ARG 74 20.858 4.129 1.377 588 HG3 ARG 74 3HG ARG 74 21.490 3.543 2.918 589 HD2 ARG 74 2HD ARG 74 22.973 3.838 0.313 590 HD3 ARG 74 3HD ARG 74 23.240 4.733 1.809 591 HE ARG 74 HE ARG 74 24.311 2.188 1.132 592 HH11 ARG 74 1HH1 ARG 74 23.137 4.088 3.803 593 HH12 ARG 74 2HH1 ARG 74 24.092 3.255 4.984 594 HH21 ARG 74 1HH2 ARG 74 25.573 1.084 2.679 595 HH22 ARG 74 2HH2 ARG 74 25.477 1.547 4.344 596 H GLU 75 H GLU 75 21.664 3.982 -1.160 597 HA GLU 75 HA GLU 75 19.272 5.476 -0.915 598 HB2 GLU 75 2HB GLU 75 21.806 5.827 -2.485 599 HB3 GLU 75 3HB GLU 75 20.446 6.913 -2.738 600 HG2 GLU 75 2HG GLU 75 20.501 7.598 -0.432 601 HG3 GLU 75 3HG GLU 75 21.764 6.419 -0.078 602 H GLN 76 H GLN 76 20.816 4.030 -3.787 603 HA GLN 76 HA GLN 76 18.746 4.585 -5.581 604 HB2 GLN 76 2HB GLN 76 20.671 2.255 -5.650 605 HB3 GLN 76 3HB GLN 76 19.747 2.874 -7.013 606 HG2 GLN 76 2HG GLN 76 21.136 5.073 -6.000 607 HG3 GLN 76 3HG GLN 76 22.284 3.734 -5.978 608 HE21 GLN 76 1HE2 GLN 76 23.546 4.440 -7.638 609 HE22 GLN 76 2HE2 GLN 76 23.006 4.538 -9.276 610 H VAL 77 H VAL 77 19.454 1.508 -3.919 611 HA VAL 77 HA VAL 77 17.258 0.064 -4.769 612 HB VAL 77 HB VAL 77 19.262 -0.682 -3.311 613 HG11 VAL 77 1HG1 VAL 77 18.862 -0.810 -0.940 614 HG12 VAL 77 2HG1 VAL 77 18.745 0.874 -1.452 615 HG13 VAL 77 3HG1 VAL 77 17.280 -0.054 -1.128 616 HG21 VAL 77 3HG2 VAL 77 16.522 -1.702 -3.495 617 HG22 VAL 77 1HG2 VAL 77 18.060 -2.514 -3.790 618 HG23 VAL 77 2HG2 VAL 77 17.449 -2.353 -2.143 619 H MET 78 H MET 78 17.470 2.508 -2.272 620 HA MET 78 HA MET 78 14.973 1.982 -1.040 621 HB2 MET 78 2HB MET 78 17.006 4.114 -0.956 622 HB3 MET 78 3HB MET 78 15.370 4.635 -0.575 623 HG2 MET 78 2HG MET 78 15.273 2.773 1.101 624 HG3 MET 78 3HG MET 78 16.994 2.525 0.814 625 HE1 MET 78 3HE MET 78 18.783 5.111 2.703 626 HE2 MET 78 1HE MET 78 18.770 3.666 1.691 627 HE3 MET 78 2HE MET 78 18.595 5.260 0.955 628 H LYS 79 H LYS 79 15.946 4.499 -3.373 629 HA LYS 79 HA LYS 79 13.454 5.644 -3.778 630 HB2 LYS 79 2HB LYS 79 15.681 5.288 -5.792 631 HB3 LYS 79 3HB LYS 79 14.338 6.413 -5.950 632 HG2 LYS 79 2HG LYS 79 15.157 7.831 -4.340 633 HG3 LYS 79 3HG LYS 79 16.086 6.561 -3.541 634 HD2 LYS 79 2HD LYS 79 17.662 6.528 -5.400 635 HD3 LYS 79 3HD LYS 79 16.719 7.763 -6.237 636 HE2 LYS 79 2HE LYS 79 17.093 9.181 -4.126 637 HE3 LYS 79 3HE LYS 79 18.353 8.013 -3.732 638 HZ1 LYS 79 3HZ LYS 79 18.266 9.425 -6.332 639 HZ2 LYS 79 1HZ LYS 79 19.562 8.583 -5.643 640 HZ3 LYS 79 2HZ LYS 79 19.070 10.062 -4.986 641 H ILE 80 H ILE 80 14.884 2.792 -5.276 642 HA ILE 80 HA ILE 80 12.886 2.393 -7.235 643 HB ILE 80 HB ILE 80 14.713 0.370 -5.935 644 HG12 ILE 80 2HG1 ILE 80 14.979 1.805 -8.584 645 HG13 ILE 80 3HG1 ILE 80 15.835 2.265 -7.116 646 HG21 ILE 80 1HG2 ILE 80 12.837 0.198 -8.263 647 HG22 ILE 80 2HG2 ILE 80 14.266 -0.829 -8.171 648 HG23 ILE 80 3HG2 ILE 80 13.037 -0.915 -6.910 649 HD11 ILE 80 3HD1 ILE 80 16.240 -0.518 -7.642 650 HD12 ILE 80 1HD1 ILE 80 16.636 0.435 -9.073 651 HD13 ILE 80 2HD1 ILE 80 17.422 0.787 -7.533 652 H ILE 81 H ILE 81 13.394 0.792 -4.088 653 HA ILE 81 HA ILE 81 11.049 -0.739 -4.126 654 HB ILE 81 HB ILE 81 12.605 0.323 -1.766 655 HG12 ILE 81 2HG1 ILE 81 12.589 -2.454 -2.956 656 HG13 ILE 81 3HG1 ILE 81 13.762 -1.222 -3.406 657 HG21 ILE 81 1HG2 ILE 81 10.090 -1.112 -1.898 658 HG22 ILE 81 2HG2 ILE 81 11.313 -1.996 -0.987 659 HG23 ILE 81 3HG2 ILE 81 10.885 -0.350 -0.521 660 HD11 ILE 81 3HD1 ILE 81 13.528 -1.640 -0.527 661 HD12 ILE 81 1HD1 ILE 81 14.083 -3.053 -1.423 662 HD13 ILE 81 2HD1 ILE 81 14.960 -1.528 -1.550 663 H ASP 82 H ASP 82 11.645 2.571 -3.134 664 HA ASP 82 HA ASP 82 9.140 2.964 -1.837 665 HB2 ASP 82 2HB ASP 82 11.299 4.355 -1.608 666 HB3 ASP 82 3HB ASP 82 10.777 5.160 -3.086 667 H GLU 83 H GLU 83 10.374 3.929 -5.038 668 HA GLU 83 HA GLU 83 8.000 5.090 -5.967 669 HB2 GLU 83 2HB GLU 83 10.328 3.832 -7.409 670 HB3 GLU 83 3HB GLU 83 8.984 4.576 -8.265 671 HG2 GLU 83 2HG GLU 83 10.389 6.141 -6.162 672 HG3 GLU 83 3HG GLU 83 11.164 5.921 -7.729 673 H PHE 84 H PHE 84 9.212 1.773 -6.214 674 HA PHE 84 HA PHE 84 6.967 0.856 -7.743 675 HB2 PHE 84 2HB PHE 84 9.346 -0.419 -6.464 676 HB3 PHE 84 3HB PHE 84 7.983 -1.441 -6.907 677 HD1 PHE 84 HD2 PHE 84 10.020 1.305 -8.408 678 HD2 PHE 84 HD1 PHE 84 8.069 -2.437 -8.964 679 HE1 PHE 84 HE2 PHE 84 10.840 1.226 -10.727 680 HE2 PHE 84 HE1 PHE 84 8.887 -2.522 -11.284 681 HZ PHE 84 HZ PHE 84 10.273 -0.688 -12.168 682 H LYS 85 H LYS 85 7.556 1.433 -4.438 683 HA LYS 85 HA LYS 85 6.323 1.115 -2.554 684 HB2 LYS 85 2HB LYS 85 4.095 0.376 -4.460 685 HB3 LYS 85 3HB LYS 85 3.915 0.868 -2.781 686 HG2 LYS 85 2HG LYS 85 5.206 2.676 -4.788 687 HG3 LYS 85 3HG LYS 85 3.450 2.591 -4.623 688 HD2 LYS 85 2HD LYS 85 3.973 2.934 -2.081 689 HD3 LYS 85 3HD LYS 85 5.497 3.585 -2.687 690 HE2 LYS 85 2HE LYS 85 2.752 4.519 -3.519 691 HE3 LYS 85 3HE LYS 85 3.781 5.325 -2.335 692 HZ1 LYS 85 3HZ LYS 85 4.571 6.458 -4.062 693 HZ2 LYS 85 1HZ LYS 85 3.888 5.406 -5.197 694 HZ3 LYS 85 2HZ LYS 85 5.390 5.047 -4.508 695 H ILE 86 H ILE 86 7.960 -0.921 -2.985 696 HA ILE 86 HA ILE 86 6.601 -3.451 -3.112 697 HB ILE 86 HB ILE 86 9.425 -2.977 -2.171 698 HG12 ILE 86 2HG1 ILE 86 8.436 -3.376 -5.003 699 HG13 ILE 86 3HG1 ILE 86 9.072 -1.871 -4.347 700 HG21 ILE 86 1HG2 ILE 86 8.411 -5.358 -3.673 701 HG22 ILE 86 2HG2 ILE 86 9.813 -5.221 -2.613 702 HG23 ILE 86 3HG2 ILE 86 8.188 -5.233 -1.928 703 HD11 ILE 86 3HD1 ILE 86 11.124 -3.504 -3.801 704 HD12 ILE 86 1HD1 ILE 86 10.478 -4.298 -5.237 705 HD13 ILE 86 2HD1 ILE 86 10.965 -2.604 -5.309 706 HA PRO 87 HA PRO 87 5.499 -3.633 1.173 707 HB2 PRO 87 2HB PRO 87 4.808 -6.258 1.227 708 HB3 PRO 87 3HB PRO 87 3.785 -5.010 0.504 709 HG2 PRO 87 2HG PRO 87 5.666 -6.923 -0.825 710 HG3 PRO 87 3HG PRO 87 4.033 -6.436 -1.316 711 HD2 PRO 87 2HD PRO 87 6.264 -5.398 -2.446 712 HD3 PRO 87 3HD PRO 87 4.767 -4.463 -2.255 713 H THR 88 H THR 88 6.194 -4.643 3.130 714 HA THR 88 HA THR 88 8.964 -5.506 3.019 715 HB THR 88 HB THR 88 7.842 -5.549 5.679 716 HG1 THR 88 HG1 THR 88 7.656 -3.018 4.415 717 HG21 THR 88 3HG2 THR 88 9.627 -3.987 6.130 718 HG22 THR 88 1HG2 THR 88 9.824 -3.657 4.409 719 HG23 THR 88 2HG2 THR 88 10.229 -5.248 5.054 720 H VAL 89 H VAL 89 9.687 -7.331 4.396 721 HA VAL 89 HA VAL 89 8.598 -9.743 3.632 722 HB VAL 89 HB VAL 89 10.190 -9.169 6.134 723 HG11 VAL 89 1HG1 VAL 89 10.681 -11.770 5.176 724 HG12 VAL 89 2HG1 VAL 89 9.894 -11.300 6.684 725 HG13 VAL 89 3HG1 VAL 89 8.930 -11.575 5.233 726 HG21 VAL 89 3HG2 VAL 89 11.998 -10.231 4.578 727 HG22 VAL 89 1HG2 VAL 89 10.916 -9.704 3.288 728 HG23 VAL 89 2HG2 VAL 89 11.585 -8.524 4.415 729 H GLU 90 H GLU 90 8.275 -8.260 6.864 730 HA GLU 90 HA GLU 90 6.528 -10.070 7.985 731 HB2 GLU 90 2HB GLU 90 7.105 -7.190 8.421 732 HB3 GLU 90 3HB GLU 90 5.630 -7.822 9.139 733 HG2 GLU 90 2HG GLU 90 8.072 -9.417 9.566 734 HG3 GLU 90 3HG GLU 90 8.007 -7.848 10.366 735 H GLN 91 H GLN 91 5.730 -7.192 6.063 736 HA GLN 91 HA GLN 91 2.947 -7.392 6.230 737 HB2 GLN 91 2HB GLN 91 4.834 -6.133 4.279 738 HB3 GLN 91 3HB GLN 91 3.120 -6.204 3.894 739 HG2 GLN 91 2HG GLN 91 4.002 -4.098 5.021 740 HG3 GLN 91 3HG GLN 91 2.536 -4.826 5.674 741 HE21 GLN 91 1HE2 GLN 91 5.857 -4.082 6.228 742 HE22 GLN 91 2HE2 GLN 91 5.905 -4.542 7.893 743 H TRP 92 H TRP 92 5.227 -8.818 3.932 744 HA TRP 92 HA TRP 92 3.297 -9.955 2.216 745 HB2 TRP 92 2HB TRP 92 5.753 -9.626 1.715 746 HB3 TRP 92 3HB TRP 92 6.074 -11.029 2.730 747 HD1 TRP 92 HD1 TRP 92 3.506 -10.452 -0.139 748 HE1 TRP 92 HE1 TRP 92 3.713 -12.423 -1.781 749 HE3 TRP 92 HE3 TRP 92 7.286 -13.024 2.151 750 HZ2 TRP 92 HZ2 TRP 92 5.272 -14.759 -2.068 751 HZ3 TRP 92 HZ3 TRP 92 8.076 -15.117 1.128 752 HH2 TRP 92 HH2 TRP 92 7.088 -15.966 -0.937 753 H LYS 93 H LYS 93 4.976 -11.198 5.069 754 HA LYS 93 HA LYS 93 4.028 -13.841 4.931 755 HB2 LYS 93 2HB LYS 93 4.740 -12.257 7.406 756 HB3 LYS 93 3HB LYS 93 4.661 -14.009 7.280 757 HG2 LYS 93 2HG LYS 93 6.484 -12.541 5.449 758 HG3 LYS 93 3HG LYS 93 6.947 -12.723 7.142 759 HD2 LYS 93 2HD LYS 93 7.618 -14.802 6.738 760 HD3 LYS 93 3HD LYS 93 5.989 -15.232 6.213 761 HE2 LYS 93 2HE LYS 93 7.370 -15.753 4.389 762 HE3 LYS 93 3HE LYS 93 6.622 -14.214 3.966 763 HZ1 LYS 93 3HZ LYS 93 9.164 -14.054 5.363 764 HZ2 LYS 93 1HZ LYS 93 8.577 -13.133 4.071 765 HZ3 LYS 93 2HZ LYS 93 9.229 -14.667 3.788 766 H ASP 94 H ASP 94 2.744 -10.975 6.578 767 HA ASP 94 HA ASP 94 0.564 -12.265 7.818 768 HB2 ASP 94 2HB ASP 94 1.275 -10.092 8.588 769 HB3 ASP 94 3HB ASP 94 0.961 -9.380 7.008 770 H GLN 95 H GLN 95 0.820 -10.494 4.750 771 HA GLN 95 HA GLN 95 -1.857 -10.642 3.985 772 HB2 GLN 95 2HB GLN 95 0.627 -10.629 2.264 773 HB3 GLN 95 3HB GLN 95 -1.004 -10.365 1.663 774 HG2 GLN 95 2HG GLN 95 -1.148 -8.275 2.551 775 HG3 GLN 95 3HG GLN 95 -0.050 -8.643 3.880 776 HE21 GLN 95 1HE2 GLN 95 0.769 -6.487 3.205 777 HE22 GLN 95 2HE2 GLN 95 1.991 -6.441 1.985 778 H THR 96 H THR 96 0.824 -12.811 3.084 779 HA THR 96 HA THR 96 -0.722 -14.648 1.638 780 HB THR 96 HB THR 96 1.188 -16.278 2.274 781 HG1 THR 96 HG1 THR 96 3.015 -15.239 3.138 782 HG21 THR 96 3HG2 THR 96 1.779 -13.691 0.832 783 HG22 THR 96 1HG2 THR 96 1.060 -15.136 0.124 784 HG23 THR 96 2HG2 THR 96 2.726 -15.172 0.702 785 H ARG 97 H ARG 97 0.294 -14.666 5.043 786 HA ARG 97 HA ARG 97 -0.711 -17.115 5.821 787 HB2 ARG 97 2HB ARG 97 -0.353 -14.509 7.257 788 HB3 ARG 97 3HB ARG 97 -1.127 -15.859 8.076 789 HG2 ARG 97 2HG ARG 97 1.512 -16.241 6.732 790 HG3 ARG 97 3HG ARG 97 1.424 -15.490 8.326 791 HD2 ARG 97 2HD ARG 97 0.041 -18.089 7.761 792 HD3 ARG 97 3HD ARG 97 1.755 -18.045 8.170 793 HE ARG 97 HE ARG 97 -0.433 -17.721 9.959 794 HH11 ARG 97 1HH1 ARG 97 2.835 -16.691 9.342 795 HH12 ARG 97 2HH1 ARG 97 3.177 -16.341 11.005 796 HH21 ARG 97 1HH2 ARG 97 0.005 -17.265 12.150 797 HH22 ARG 97 2HH2 ARG 97 1.567 -16.669 12.601 798 H ARG 98 H ARG 98 -2.407 -13.980 5.950 799 HA ARG 98 HA ARG 98 -4.883 -15.065 6.770 800 HB2 ARG 98 2HB ARG 98 -4.236 -12.463 5.376 801 HB3 ARG 98 3HB ARG 98 -5.813 -12.863 6.045 802 HG2 ARG 98 2HG ARG 98 -4.604 -13.191 8.263 803 HG3 ARG 98 3HG ARG 98 -3.237 -12.377 7.499 804 HD2 ARG 98 2HD ARG 98 -4.364 -10.641 8.554 805 HD3 ARG 98 3HD ARG 98 -4.949 -10.549 6.893 806 HE ARG 98 HE ARG 98 -6.785 -12.122 8.087 807 HH11 ARG 98 1HH1 ARG 98 -5.426 -9.023 8.907 808 HH12 ARG 98 2HH1 ARG 98 -6.855 -8.464 9.711 809 HH21 ARG 98 1HH2 ARG 98 -8.672 -11.396 9.143 810 HH22 ARG 98 2HH2 ARG 98 -8.701 -9.815 9.845 811 H TYR 99 H TYR 99 -3.428 -14.526 3.633 812 HA TYR 99 HA TYR 99 -5.752 -14.821 2.062 813 HB2 TYR 99 2HB TYR 99 -3.801 -13.863 1.061 814 HB3 TYR 99 3HB TYR 99 -2.833 -15.282 1.443 815 HD1 TYR 99 HD1 TYR 99 -5.833 -14.264 -0.527 816 HD2 TYR 99 HD2 TYR 99 -2.524 -16.916 -0.176 817 HE1 TYR 99 HE1 TYR 99 -6.367 -15.213 -2.733 818 HE2 TYR 99 HE2 TYR 99 -3.048 -17.871 -2.381 819 HH TYR 99 HH TYR 99 -4.329 -16.923 -4.541 820 H LYS 100 H LYS 100 -3.375 -17.143 3.263 821 HA LYS 100 HA LYS 100 -4.530 -19.379 1.901 822 HB2 LYS 100 2HB LYS 100 -2.549 -19.183 4.171 823 HB3 LYS 100 3HB LYS 100 -3.047 -20.708 3.451 824 HG2 LYS 100 2HG LYS 100 -2.290 -19.636 1.226 825 HG3 LYS 100 3HG LYS 100 -1.418 -18.503 2.261 826 HD2 LYS 100 2HD LYS 100 0.023 -20.111 3.036 827 HD3 LYS 100 3HD LYS 100 -1.135 -21.420 2.792 828 HE2 LYS 100 2HE LYS 100 0.646 -21.648 1.193 829 HE3 LYS 100 3HE LYS 100 -0.824 -21.171 0.344 830 HZ1 LYS 100 3HZ LYS 100 1.295 -19.981 -0.292 831 HZ2 LYS 100 1HZ LYS 100 1.204 -19.195 1.203 832 HZ3 LYS 100 2HZ LYS 100 -0.035 -18.999 0.068 833 H GLU 101 H GLU 101 -5.099 -17.762 4.905 834 HA GLU 101 HA GLU 101 -6.682 -19.976 5.956 835 HB2 GLU 101 2HB GLU 101 -6.111 -17.266 7.167 836 HB3 GLU 101 3HB GLU 101 -6.894 -18.616 7.976 837 HG2 GLU 101 2HG GLU 101 -4.926 -19.843 8.108 838 HG3 GLU 101 3HG GLU 101 -4.139 -18.896 6.847 839 H SER 102 H SER 102 -8.727 -18.888 7.241 840 HA SER 102 HA SER 102 -10.572 -18.287 5.163 841 HB2 SER 102 2HB SER 102 -10.942 -18.109 8.164 842 HB3 SER 102 3HB SER 102 -12.234 -18.118 6.963 843 HG SER 102 HG SER 102 -12.137 -20.199 7.372 844 H SER 103 H SER 103 -10.969 -16.388 4.263 845 HA SER 103 HA SER 103 -9.821 -13.974 5.257 846 HB2 SER 103 2HB SER 103 -11.911 -14.254 3.089 847 HB3 SER 103 3HB SER 103 -10.789 -12.914 3.321 848 HG SER 103 HG SER 103 -10.371 -15.410 2.199 849 H ILE 104 H ILE 104 -11.327 -11.940 5.267 850 HA ILE 104 HA ILE 104 -13.064 -12.236 7.501 851 HB ILE 104 HB ILE 104 -12.784 -9.851 5.669 852 HG12 ILE 104 2HG1 ILE 104 -11.455 -9.659 8.238 853 HG13 ILE 104 3HG1 ILE 104 -10.841 -11.022 7.309 854 HG21 ILE 104 1HG2 ILE 104 -13.935 -10.194 8.427 855 HG22 ILE 104 2HG2 ILE 104 -13.501 -8.624 7.752 856 HG23 ILE 104 3HG2 ILE 104 -14.744 -9.605 6.975 857 HD11 ILE 104 3HD1 ILE 104 -10.988 -8.174 6.352 858 HD12 ILE 104 1HD1 ILE 104 -9.540 -8.998 6.928 859 HD13 ILE 104 2HD1 ILE 104 -10.336 -9.542 5.451 860 H GLN 105 H GLN 105 -15.258 -12.262 7.630 861 HA GLN 105 HA GLN 105 -17.068 -11.509 5.652 862 HB2 GLN 105 2HB GLN 105 -17.798 -13.985 5.133 863 HB3 GLN 105 3HB GLN 105 -16.550 -13.195 4.179 864 HG2 GLN 105 2HG GLN 105 -14.830 -14.377 5.245 865 HG3 GLN 105 3HG GLN 105 -15.887 -14.894 6.558 866 HE21 GLN 105 1HE2 GLN 105 -14.677 -16.919 5.716 867 HE22 GLN 105 2HE2 GLN 105 -15.554 -17.869 4.570 868 H ILE 106 H ILE 106 -19.301 -12.421 6.070 869 HA ILE 106 HA ILE 106 -19.635 -13.456 8.785 870 HB ILE 106 HB ILE 106 -21.039 -11.767 9.548 871 HG12 ILE 106 2HG1 ILE 106 -22.503 -11.567 7.633 872 HG13 ILE 106 3HG1 ILE 106 -21.931 -9.962 8.076 873 HG21 ILE 106 1HG2 ILE 106 -19.811 -9.672 9.264 874 HG22 ILE 106 2HG2 ILE 106 -18.715 -11.034 9.488 875 HG23 ILE 106 3HG2 ILE 106 -18.961 -10.356 7.879 876 HD11 ILE 106 3HD1 ILE 106 -21.378 -11.580 5.663 877 HD12 ILE 106 1HD1 ILE 106 -21.651 -9.846 5.833 878 HD13 ILE 106 2HD1 ILE 106 -20.087 -10.539 6.264 879 H GLY 107 H GLY 107 -22.097 -13.800 9.198 880 HA2 GLY 107 2HA GLY 107 -24.055 -14.061 7.351 881 HA3 GLY 107 3HA GLY 107 -23.041 -15.459 7.028 882 H ASN 108 H ASN 108 -25.692 -14.409 8.688 883 HA ASN 108 HA ASN 108 -25.435 -15.811 11.141 884 HB2 ASN 108 2HB ASN 108 -27.089 -13.947 10.578 885 HB3 ASN 108 3HB ASN 108 -28.040 -15.181 9.756 886 HD21 ASN 108 1HD2 ASN 108 -28.215 -13.478 12.337 887 HD22 ASN 108 2HD2 ASN 108 -28.762 -14.621 13.511 888 H GLY 109 H GLY 109 -25.787 -17.891 11.650 889 HA2 GLY 109 2HA GLY 109 -27.526 -19.654 10.354 890 HA3 GLY 109 3HA GLY 109 -25.937 -19.857 9.630 891 H HIS 110 H HIS 110 -24.308 -20.850 10.781 892 HA HIS 110 HA HIS 110 -25.205 -22.381 13.092 893 HB2 HIS 110 2HB HIS 110 -22.767 -22.570 11.322 894 HB3 HIS 110 3HB HIS 110 -22.974 -23.553 12.768 895 HD1 HIS 110 HD1 HIS 110 -23.864 -25.791 12.260 896 HD2 HIS 110 HD2 HIS 110 -25.234 -22.948 9.557 897 HE1 HIS 110 HE1 HIS 110 -25.306 -27.052 10.630 898 H GLY 111 H GLY 111 -25.078 -21.222 14.932 899 HA2 GLY 111 2HA GLY 111 -23.897 -20.477 16.805 900 HA3 GLY 111 3HA GLY 111 -22.433 -20.429 15.834 901 H GLN 112 H GLN 112 -23.504 -18.432 17.687 902 HA GLN 112 HA GLN 112 -24.384 -16.247 15.997 903 HB2 GLN 112 2HB GLN 112 -24.066 -16.682 18.929 904 HB3 GLN 112 3HB GLN 112 -24.036 -15.029 18.330 905 HG2 GLN 112 2HG GLN 112 -26.266 -15.703 19.056 906 HG3 GLN 112 3HG GLN 112 -26.222 -15.314 17.337 907 HE21 GLN 112 1HE2 GLN 112 -27.701 -16.559 16.421 908 HE22 GLN 112 2HE2 GLN 112 -27.837 -18.271 16.613 909 H SER 113 H SER 113 -22.830 -15.433 14.722 910 HA SER 113 HA SER 113 -20.110 -15.143 15.702 911 HB2 SER 113 2HB SER 113 -21.062 -14.138 13.035 912 HB3 SER 113 3HB SER 113 -19.476 -14.766 13.484 913 HG SER 113 HG SER 113 -20.454 -16.836 13.675 914 H GLN 114 H GLN 114 -19.101 -12.930 14.726 915 HA GLN 114 HA GLN 114 -20.672 -10.787 15.990 916 HB2 GLN 114 2HB GLN 114 -18.274 -11.562 16.795 917 HB3 GLN 114 3HB GLN 114 -17.743 -10.513 15.487 918 HG2 GLN 114 2HG GLN 114 -17.739 -9.011 17.179 919 HG3 GLN 114 3HG GLN 114 -19.410 -8.825 16.649 920 HE21 GLN 114 1HE2 GLN 114 -17.423 -10.716 18.891 921 HE22 GLN 114 2HE2 GLN 114 -18.596 -10.769 20.158 922 H GLY 115 H GLY 115 -21.092 -8.918 14.910 923 HA2 GLY 115 2HA GLY 115 -19.800 -8.437 12.333 924 HA3 GLY 115 3HA GLY 115 -21.542 -8.673 12.321 925 H LEU 116 H LEU 116 -19.176 -6.390 12.368 926 HA LEU 116 HA LEU 116 -21.069 -4.316 13.090 927 HB2 LEU 116 2HB LEU 116 -19.280 -3.221 14.544 928 HB3 LEU 116 3HB LEU 116 -20.195 -4.561 15.231 929 HG LEU 116 HG LEU 116 -17.853 -5.633 14.037 930 HD11 LEU 116 1HD1 LEU 116 -16.086 -4.419 14.814 931 HD12 LEU 116 2HD1 LEU 116 -17.020 -3.678 16.114 932 HD13 LEU 116 3HD1 LEU 116 -17.212 -3.109 14.456 933 HD21 LEU 116 3HD2 LEU 116 -18.956 -6.704 15.848 934 HD22 LEU 116 1HD2 LEU 116 -18.803 -5.276 16.871 935 HD23 LEU 116 2HD2 LEU 116 -17.369 -6.206 16.436 936 H GLU 117 H GLU 117 -20.026 -2.094 12.747 937 HA GLU 117 HA GLU 117 -19.134 -1.893 10.116 938 HB2 GLU 117 2HB GLU 117 -18.976 0.048 12.418 939 HB3 GLU 117 3HB GLU 117 -18.481 0.469 10.785 940 HG2 GLU 117 2HG GLU 117 -20.875 -0.387 10.167 941 HG3 GLU 117 3HG GLU 117 -21.202 -0.053 11.867 942 H1 GLY -9 H GLY -9 5.703 -13.900 12.354 943 HA2 GLY -9 2HA GLY -9 6.206 -13.521 9.948 944 HA3 GLY -9 3HA GLY -9 7.830 -13.092 10.466 945 H LYS -8 H LYS -8 8.022 -14.861 8.668 946 HA LYS -8 HA LYS -8 8.257 -17.459 10.039 947 HB2 LYS -8 2HB LYS -8 7.318 -16.794 7.274 948 HB3 LYS -8 3HB LYS -8 8.103 -18.339 7.572 949 HG2 LYS -8 2HG LYS -8 6.356 -18.478 9.530 950 HG3 LYS -8 3HG LYS -8 5.474 -17.328 8.522 951 HD2 LYS -8 2HD LYS -8 6.502 -20.015 7.610 952 HD3 LYS -8 3HD LYS -8 4.834 -19.666 8.069 953 HE2 LYS -8 2HE LYS -8 6.357 -18.377 5.805 954 HE3 LYS -8 3HE LYS -8 5.125 -19.628 5.640 955 HZ1 LYS -8 3HZ LYS -8 3.539 -18.073 6.687 956 HZ2 LYS -8 1HZ LYS -8 4.143 -17.507 5.212 957 HZ3 LYS -8 2HZ LYS -8 4.729 -16.870 6.665 958 H PHE -7 H PHE -7 9.554 -15.448 7.410 959 HA PHE -7 HA PHE -7 11.990 -16.978 7.269 960 HB2 PHE -7 2HB PHE -7 10.982 -14.493 5.911 961 HB3 PHE -7 3HB PHE -7 12.664 -14.988 5.750 962 HD1 PHE -7 HD2 PHE -7 9.317 -16.642 5.598 963 HD2 PHE -7 HD1 PHE -7 13.148 -16.111 3.821 964 HE1 PHE -7 HE2 PHE -7 8.686 -18.181 3.785 965 HE2 PHE -7 HE1 PHE -7 12.523 -17.648 2.005 966 HZ PHE -7 HZ PHE -7 10.290 -18.686 1.986 967 H ILE -6 H ILE -6 11.575 -13.474 7.737 968 HA ILE -6 HA ILE -6 12.777 -11.962 8.948 969 HB ILE -6 HB ILE -6 13.028 -14.144 11.013 970 HG12 ILE -6 2HG1 ILE -6 10.710 -14.093 10.290 971 HG13 ILE -6 3HG1 ILE -6 10.840 -13.346 11.878 972 HG21 ILE -6 1HG2 ILE -6 13.163 -11.161 11.031 973 HG22 ILE -6 2HG2 ILE -6 12.635 -12.024 12.475 974 HG23 ILE -6 3HG2 ILE -6 14.231 -12.338 11.794 975 HD11 ILE -6 3HD1 ILE -6 11.140 -11.257 10.060 976 HD12 ILE -6 1HD1 ILE -6 9.838 -12.258 9.418 977 HD13 ILE -6 2HD1 ILE -6 9.732 -11.618 11.059 978 HA PRO -5 HA PRO -5 16.832 -13.810 7.697 979 HB2 PRO -5 2HB PRO -5 17.589 -11.680 6.193 980 HB3 PRO -5 3HB PRO -5 16.596 -12.998 5.560 981 HG2 PRO -5 2HG PRO -5 15.758 -10.296 6.540 982 HG3 PRO -5 3HG PRO -5 15.204 -11.190 5.112 983 HD2 PRO -5 2HD PRO -5 13.778 -11.091 7.412 984 HD3 PRO -5 3HD PRO -5 13.762 -12.505 6.338 985 H SER -4 H SER -4 17.567 -13.591 9.853 986 HA SER -4 HA SER -4 18.454 -10.939 10.707 987 HB2 SER -4 2HB SER -4 19.001 -13.190 12.508 988 HB3 SER -4 3HB SER -4 18.180 -11.662 12.829 989 HG SER -4 HG SER -4 16.292 -12.527 12.030 990 H ARG -3 H ARG -3 19.775 -12.430 8.541 991 HA ARG -3 HA ARG -3 22.328 -13.225 9.686 992 HB2 ARG -3 2HB ARG -3 21.877 -13.025 6.741 993 HB3 ARG -3 3HB ARG -3 22.818 -14.199 7.651 994 HG2 ARG -3 2HG ARG -3 19.810 -14.071 7.560 995 HG3 ARG -3 3HG ARG -3 20.821 -15.187 6.639 996 HD2 ARG -3 2HD ARG -3 20.901 -16.585 8.362 997 HD3 ARG -3 3HD ARG -3 21.561 -15.315 9.392 998 HE ARG -3 HE ARG -3 18.863 -14.824 9.269 999 HH11 ARG -3 1HH1 ARG -3 20.886 -17.479 10.259 1000 HH12 ARG -3 2HH1 ARG -3 19.768 -18.057 11.450 1001 HH21 ARG -3 1HH2 ARG -3 17.383 -15.575 10.834 1002 HH22 ARG -3 2HH2 ARG -3 17.776 -16.974 11.776 1003 HA PRO -2 HA PRO -2 24.492 -9.471 9.001 1004 HB2 PRO -2 2HB PRO -2 26.916 -10.353 8.153 1005 HB3 PRO -2 3HB PRO -2 26.365 -10.517 9.824 1006 HG2 PRO -2 2HG PRO -2 26.362 -12.543 7.621 1007 HG3 PRO -2 3HG PRO -2 26.813 -12.744 9.324 1008 HD2 PRO -2 2HD PRO -2 24.406 -13.517 8.353 1009 HD3 PRO -2 3HD PRO -2 24.621 -12.925 10.013 1010 H ALA -1 H ALA -1 23.819 -8.197 7.376 1011 HA ALA -1 HA ALA -1 23.462 -8.844 4.721 1012 HB1 ALA -1 1HB ALA -1 22.522 -6.832 5.558 1013 HB2 ALA -1 2HB ALA -1 24.109 -6.192 5.990 1014 HB3 ALA -1 3HB ALA -1 23.663 -6.375 4.293 1015 HA PRO 0 HA PRO 0 27.776 -9.418 3.585 1016 HB2 PRO 0 2HB PRO 0 27.229 -10.470 1.143 1017 HB3 PRO 0 3HB PRO 0 27.132 -11.410 2.637 1018 HG2 PRO 0 2HG PRO 0 24.937 -10.106 1.074 1019 HG3 PRO 0 3HG PRO 0 24.973 -11.710 1.828 1020 HD2 PRO 0 2HD PRO 0 23.728 -9.592 2.967 1021 HD3 PRO 0 3HD PRO 0 24.499 -10.874 3.923 1022 H LYS 1 H LYS 1 29.181 -8.289 2.287 1023 HA LYS 1 HA LYS 1 28.034 -6.006 0.858 1024 HB2 LYS 1 2HB LYS 1 30.611 -6.557 2.223 1025 HB3 LYS 1 3HB LYS 1 30.675 -5.501 0.818 1026 HG2 LYS 1 2HG LYS 1 28.916 -4.094 1.881 1027 HG3 LYS 1 3HG LYS 1 29.060 -5.098 3.325 1028 HD2 LYS 1 2HD LYS 1 31.513 -4.525 3.344 1029 HD3 LYS 1 3HD LYS 1 31.169 -3.344 2.078 1030 HE2 LYS 1 2HE LYS 1 29.577 -2.224 3.568 1031 HE3 LYS 1 3HE LYS 1 29.935 -3.400 4.831 1032 HZ1 LYS 1 3HZ LYS 1 32.199 -2.624 4.902 1033 HZ2 LYS 1 1HZ LYS 1 31.154 -1.310 5.114 1034 HZ3 LYS 1 2HZ LYS 1 31.920 -1.549 3.626 1035 HA PRO 2 HA PRO 2 29.100 -7.412 -3.159 1036 HB2 PRO 2 2HB PRO 2 30.014 -5.151 -4.352 1037 HB3 PRO 2 3HB PRO 2 28.309 -5.413 -3.969 1038 HG2 PRO 2 2HG PRO 2 30.368 -3.840 -2.469 1039 HG3 PRO 2 3HG PRO 2 28.681 -3.423 -2.824 1040 HD2 PRO 2 2HD PRO 2 29.468 -4.386 -0.419 1041 HD3 PRO 2 3HD PRO 2 27.866 -4.724 -1.105 1042 HA PRO 3 HA PRO 3 33.363 -8.392 -3.602 1043 HB2 PRO 3 2HB PRO 3 33.717 -8.340 -6.293 1044 HB3 PRO 3 3HB PRO 3 32.802 -9.608 -5.469 1045 HG2 PRO 3 2HG PRO 3 31.802 -7.182 -6.909 1046 HG3 PRO 3 3HG PRO 3 31.187 -8.845 -6.957 1047 HD2 PRO 3 2HD PRO 3 30.029 -6.906 -5.463 1048 HD3 PRO 3 3HD PRO 3 30.039 -8.611 -4.971 1049 H SER 4 H SER 4 34.816 -6.952 -2.875 1050 HA SER 4 HA SER 4 35.736 -4.879 -4.709 1051 HB2 SER 4 2HB SER 4 35.717 -3.155 -2.950 1052 HB3 SER 4 3HB SER 4 34.088 -3.738 -3.289 1053 HG SER 4 HG SER 4 35.751 -4.499 -1.118 1054 H SER 5 H SER 5 37.732 -3.752 -3.688 1055 HA SER 5 HA SER 5 39.361 -5.814 -2.350 1056 HB2 SER 5 2HB SER 5 41.307 -4.635 -3.564 1057 HB3 SER 5 3HB SER 5 40.247 -5.664 -4.528 1058 HG SER 5 HG SER 5 40.830 -3.226 -5.062 1059 H ALA 6 H ALA 6 39.461 -5.172 -0.281 1060 HA ALA 6 HA ALA 6 39.902 -2.340 0.324 1061 HB1 ALA 6 1HB ALA 6 38.105 -3.792 1.458 1062 HB2 ALA 6 2HB ALA 6 39.446 -4.471 2.380 1063 HB3 ALA 6 3HB ALA 6 39.099 -2.744 2.470 Start of MODEL 5 1 H1 MET -2 H MET -2 0.961 3.553 -1.863 2 HA MET -2 HA MET -2 3.704 2.797 -2.219 3 HB2 MET -2 2HB MET -2 3.340 1.913 0.031 4 HB3 MET -2 3HB MET -2 1.917 1.042 -0.525 5 HG2 MET -2 2HG MET -2 3.919 0.192 -2.228 6 HG3 MET -2 3HG MET -2 4.714 0.313 -0.661 7 HE1 MET -2 3HE MET -2 4.019 -2.560 -2.459 8 HE2 MET -2 1HE MET -2 5.181 -2.211 -1.178 9 HE3 MET -2 2HE MET -2 4.000 -3.505 -0.969 10 H ALA -1 H ALA -1 3.949 1.637 -4.048 11 HA ALA -1 HA ALA -1 1.512 0.531 -5.287 12 HB1 ALA -1 1HB ALA -1 3.303 1.063 -7.352 13 HB2 ALA -1 2HB ALA -1 1.843 1.968 -6.951 14 HB3 ALA -1 3HB ALA -1 3.400 2.469 -6.291 15 HA PRO 1 HA PRO 1 3.508 -3.349 -5.744 16 HB2 PRO 1 2HB PRO 1 2.650 -4.163 -8.188 17 HB3 PRO 1 3HB PRO 1 1.596 -4.104 -6.770 18 HG2 PRO 1 2HG PRO 1 1.867 -2.139 -9.012 19 HG3 PRO 1 3HG PRO 1 0.397 -2.742 -8.224 20 HD2 PRO 1 2HD PRO 1 1.482 -0.331 -7.637 21 HD3 PRO 1 3HD PRO 1 0.620 -1.310 -6.432 22 H LEU 2 H LEU 2 5.611 -3.676 -6.066 23 HA LEU 2 HA LEU 2 6.809 -2.749 -8.594 24 HB2 LEU 2 2HB LEU 2 8.893 -2.398 -7.404 25 HB3 LEU 2 3HB LEU 2 7.594 -1.444 -6.691 26 HG LEU 2 HG LEU 2 7.822 -3.956 -5.320 27 HD11 LEU 2 1HD1 LEU 2 10.037 -3.714 -4.381 28 HD12 LEU 2 2HD1 LEU 2 10.347 -2.311 -5.403 29 HD13 LEU 2 3HD1 LEU 2 10.144 -3.905 -6.131 30 HD21 LEU 2 3HD2 LEU 2 6.788 -1.898 -4.460 31 HD22 LEU 2 1HD2 LEU 2 8.373 -1.124 -4.437 32 HD23 LEU 2 2HD2 LEU 2 8.051 -2.506 -3.388 33 H PHE 3 H PHE 3 8.327 -4.080 -9.594 34 HA PHE 3 HA PHE 3 8.516 -6.816 -8.520 35 HB2 PHE 3 2HB PHE 3 8.039 -5.921 -11.362 36 HB3 PHE 3 3HB PHE 3 8.582 -7.546 -10.957 37 HD1 PHE 3 HD1 PHE 3 5.922 -5.131 -9.946 38 HD2 PHE 3 HD2 PHE 3 6.980 -9.172 -10.764 39 HE1 PHE 3 HE1 PHE 3 3.586 -5.813 -9.582 40 HE2 PHE 3 HE2 PHE 3 4.646 -9.860 -10.402 41 HZ PHE 3 HZ PHE 3 2.945 -8.180 -9.810 42 H ALA 4 H ALA 4 10.467 -7.865 -8.724 43 HA ALA 4 HA ALA 4 12.694 -6.257 -9.796 44 HB1 ALA 4 1HB ALA 4 14.006 -7.695 -8.010 45 HB2 ALA 4 2HB ALA 4 13.200 -6.189 -7.571 46 HB3 ALA 4 3HB ALA 4 12.423 -7.736 -7.233 47 H VAL 5 H VAL 5 14.441 -7.396 -10.746 48 HA VAL 5 HA VAL 5 13.774 -10.149 -11.567 49 HB VAL 5 HB VAL 5 13.538 -8.682 -13.471 50 HG11 VAL 5 1HG1 VAL 5 16.410 -7.853 -13.121 51 HG12 VAL 5 2HG1 VAL 5 15.220 -7.206 -14.252 52 HG13 VAL 5 3HG1 VAL 5 15.053 -6.900 -12.522 53 HG21 VAL 5 3HG2 VAL 5 16.069 -9.702 -14.374 54 HG22 VAL 5 1HG2 VAL 5 15.258 -10.889 -13.351 55 HG23 VAL 5 2HG2 VAL 5 14.439 -10.244 -14.773 56 H THR 6 H THR 6 15.179 -11.628 -10.917 57 HA THR 6 HA THR 6 17.519 -11.054 -9.493 58 HB THR 6 HB THR 6 17.945 -13.614 -10.418 59 HG1 THR 6 HG1 THR 6 16.129 -14.197 -11.335 60 HG21 THR 6 3HG2 THR 6 16.278 -13.975 -8.256 61 HG22 THR 6 1HG2 THR 6 16.862 -12.327 -8.034 62 HG23 THR 6 2HG2 THR 6 18.010 -13.658 -8.178 63 H LEU 7 H LEU 7 19.689 -11.125 -10.020 64 HA LEU 7 HA LEU 7 20.298 -11.098 -12.903 65 HB2 LEU 7 2HB LEU 7 21.859 -9.657 -10.777 66 HB3 LEU 7 3HB LEU 7 21.974 -9.465 -12.525 67 HG LEU 7 HG LEU 7 19.677 -8.587 -10.776 68 HD11 LEU 7 1HD1 LEU 7 21.115 -6.627 -12.398 69 HD12 LEU 7 2HD1 LEU 7 22.089 -7.361 -11.126 70 HD13 LEU 7 3HD1 LEU 7 20.581 -6.543 -10.719 71 HD21 LEU 7 3HD2 LEU 7 18.682 -7.674 -12.752 72 HD22 LEU 7 1HD2 LEU 7 19.010 -9.383 -13.043 73 HD23 LEU 7 2HD2 LEU 7 20.068 -8.152 -13.733 74 H TYR 8 H TYR 8 20.824 -12.657 -9.967 75 HA TYR 8 HA TYR 8 23.081 -14.135 -11.128 76 HB2 TYR 8 2HB TYR 8 22.891 -13.142 -8.278 77 HB3 TYR 8 3HB TYR 8 24.100 -14.284 -8.856 78 HD1 TYR 8 HD1 TYR 8 22.847 -10.817 -9.289 79 HD2 TYR 8 HD2 TYR 8 26.072 -13.526 -9.890 80 HE1 TYR 8 HE1 TYR 8 24.293 -8.940 -9.950 81 HE2 TYR 8 HE2 TYR 8 27.527 -11.657 -10.550 82 HH TYR 8 HH TYR 8 26.441 -8.315 -10.330 83 H GLU 9 H GLU 9 23.420 -16.262 -10.036 84 HA GLU 9 HA GLU 9 20.833 -17.529 -9.624 85 HB2 GLU 9 2HB GLU 9 22.415 -18.555 -11.190 86 HB3 GLU 9 3HB GLU 9 23.595 -18.726 -9.899 87 HG2 GLU 9 2HG GLU 9 22.774 -20.778 -9.660 88 HG3 GLU 9 3HG GLU 9 21.418 -19.995 -8.852 89 H PHE 10 H PHE 10 20.087 -17.359 -7.600 90 HA PHE 10 HA PHE 10 21.894 -17.488 -5.333 91 HB2 PHE 10 2HB PHE 10 19.807 -15.953 -5.599 92 HB3 PHE 10 3HB PHE 10 18.901 -17.383 -5.113 93 HD1 PHE 10 HD2 PHE 10 22.103 -15.832 -3.981 94 HD2 PHE 10 HD1 PHE 10 18.223 -17.234 -2.933 95 HE1 PHE 10 HE2 PHE 10 22.556 -15.311 -1.619 96 HE2 PHE 10 HE1 PHE 10 18.670 -16.714 -0.570 97 HZ PHE 10 HZ PHE 10 20.839 -15.753 0.090 98 H LYS 11 H LYS 11 22.376 -19.293 -4.286 99 HA LYS 11 HA LYS 11 20.760 -21.689 -4.784 100 HB2 LYS 11 2HB LYS 11 23.465 -21.595 -3.457 101 HB3 LYS 11 3HB LYS 11 22.665 -22.981 -4.186 102 HG2 LYS 11 2HG LYS 11 24.109 -22.510 -5.859 103 HG3 LYS 11 3HG LYS 11 22.801 -21.427 -6.340 104 HD2 LYS 11 2HD LYS 11 23.920 -19.541 -5.623 105 HD3 LYS 11 3HD LYS 11 24.908 -20.439 -4.469 106 HE2 LYS 11 2HE LYS 11 26.222 -19.648 -6.385 107 HE3 LYS 11 3HE LYS 11 26.193 -21.408 -6.286 108 HZ1 LYS 11 3HZ LYS 11 24.541 -19.735 -8.100 109 HZ2 LYS 11 1HZ LYS 11 24.453 -21.420 -7.982 110 HZ3 LYS 11 2HZ LYS 11 25.867 -20.685 -8.550 111 H ALA 12 H ALA 12 19.103 -21.568 -3.331 112 HA ALA 12 HA ALA 12 19.168 -20.630 -0.730 113 HB1 ALA 12 1HB ALA 12 17.063 -21.057 -1.713 114 HB2 ALA 12 2HB ALA 12 17.460 -22.751 -2.006 115 HB3 ALA 12 3HB ALA 12 17.204 -22.177 -0.358 116 H GLU 13 H GLU 13 19.127 -21.782 1.311 117 HA GLU 13 HA GLU 13 20.864 -24.162 1.277 118 HB2 GLU 13 2HB GLU 13 21.807 -23.450 3.373 119 HB3 GLU 13 3HB GLU 13 21.911 -22.115 2.234 120 HG2 GLU 13 2HG GLU 13 19.969 -21.069 3.258 121 HG3 GLU 13 3HG GLU 13 19.825 -22.418 4.383 122 H ARG 14 H ARG 14 17.995 -22.671 2.583 123 HA ARG 14 HA ARG 14 17.200 -25.274 3.680 124 HB2 ARG 14 2HB ARG 14 17.064 -22.611 5.091 125 HB3 ARG 14 3HB ARG 14 16.099 -23.997 5.583 126 HG2 ARG 14 2HG ARG 14 19.048 -24.310 5.313 127 HG3 ARG 14 3HG ARG 14 18.390 -23.485 6.727 128 HD2 ARG 14 2HD ARG 14 17.273 -26.126 5.883 129 HD3 ARG 14 3HD ARG 14 18.787 -26.061 6.784 130 HE ARG 14 HE ARG 14 17.051 -24.505 8.216 131 HH11 ARG 14 1HH1 ARG 14 17.082 -27.799 7.091 132 HH12 ARG 14 2HH1 ARG 14 16.135 -28.397 8.412 133 HH21 ARG 14 1HH2 ARG 14 15.803 -25.280 9.961 134 HH22 ARG 14 2HH2 ARG 14 15.407 -26.963 10.044 135 H ASP 15 H ASP 15 14.731 -24.893 4.489 136 HA ASP 15 HA ASP 15 13.222 -24.654 2.140 137 HB2 ASP 15 2HB ASP 15 12.523 -24.768 5.057 138 HB3 ASP 15 3HB ASP 15 11.267 -24.467 3.859 139 H ASP 16 H ASP 16 13.812 -22.366 4.768 140 HA ASP 16 HA ASP 16 12.010 -20.374 4.032 141 HB2 ASP 16 2HB ASP 16 13.674 -18.815 5.177 142 HB3 ASP 16 3HB ASP 16 13.061 -20.157 6.139 143 H GLU 17 H GLU 17 15.289 -21.016 2.893 144 HA GLU 17 HA GLU 17 15.350 -18.678 1.213 145 HB2 GLU 17 2HB GLU 17 17.183 -21.056 1.500 146 HB3 GLU 17 3HB GLU 17 17.462 -19.777 0.326 147 HG2 GLU 17 2HG GLU 17 17.190 -18.273 2.505 148 HG3 GLU 17 3HG GLU 17 17.763 -19.757 3.266 149 H LEU 18 H LEU 18 15.132 -18.576 -0.997 150 HA LEU 18 HA LEU 18 14.065 -20.994 -2.301 151 HB2 LEU 18 2HB LEU 18 12.391 -19.193 -1.869 152 HB3 LEU 18 3HB LEU 18 13.329 -18.140 -2.925 153 HG LEU 18 HG LEU 18 12.930 -20.109 -4.648 154 HD11 LEU 18 1HD1 LEU 18 11.175 -21.483 -4.288 155 HD12 LEU 18 2HD1 LEU 18 10.289 -20.289 -3.341 156 HD13 LEU 18 3HD1 LEU 18 11.599 -21.206 -2.598 157 HD21 LEU 18 3HD2 LEU 18 11.779 -17.588 -4.124 158 HD22 LEU 18 1HD2 LEU 18 10.462 -18.674 -4.567 159 HD23 LEU 18 2HD2 LEU 18 11.834 -18.464 -5.655 160 H ASP 19 H ASP 19 15.112 -21.675 -4.052 161 HA ASP 19 HA ASP 19 17.448 -20.315 -4.971 162 HB2 ASP 19 2HB ASP 19 16.084 -22.643 -6.326 163 HB3 ASP 19 3HB ASP 19 17.784 -22.190 -6.410 164 H VAL 20 H VAL 20 17.797 -19.179 -6.826 165 HA VAL 20 HA VAL 20 15.652 -18.913 -8.782 166 HB VAL 20 HB VAL 20 15.244 -17.139 -7.082 167 HG11 VAL 20 1HG1 VAL 20 17.783 -16.867 -6.690 168 HG12 VAL 20 2HG1 VAL 20 17.717 -15.768 -8.070 169 HG13 VAL 20 3HG1 VAL 20 16.756 -15.435 -6.629 170 HG21 VAL 20 3HG2 VAL 20 16.078 -15.603 -9.455 171 HG22 VAL 20 1HG2 VAL 20 15.041 -16.995 -9.766 172 HG23 VAL 20 2HG2 VAL 20 14.502 -15.720 -8.673 173 H SER 21 H SER 21 16.332 -18.058 -10.791 174 HA SER 21 HA SER 21 19.253 -18.131 -11.160 175 HB2 SER 21 2HB SER 21 16.965 -19.075 -12.827 176 HB3 SER 21 3HB SER 21 18.407 -18.492 -13.658 177 HG SER 21 HG SER 21 19.171 -20.405 -13.269 178 HA PRO 22 HA PRO 22 19.364 -13.994 -12.612 179 HB2 PRO 22 2HB PRO 22 21.149 -14.141 -14.652 180 HB3 PRO 22 3HB PRO 22 21.618 -14.277 -12.953 181 HG2 PRO 22 2HG PRO 22 21.174 -16.441 -14.973 182 HG3 PRO 22 3HG PRO 22 22.466 -16.283 -13.768 183 HD2 PRO 22 2HD PRO 22 20.324 -17.899 -13.405 184 HD3 PRO 22 3HD PRO 22 21.140 -17.078 -12.059 185 H GLY 23 H GLY 23 17.746 -13.019 -13.654 186 HA2 GLY 23 2HA GLY 23 16.936 -12.204 -15.791 187 HA3 GLY 23 3HA GLY 23 17.218 -13.809 -16.448 188 H GLU 24 H GLU 24 15.952 -14.177 -13.411 189 HA GLU 24 HA GLU 24 13.332 -14.811 -14.519 190 HB2 GLU 24 2HB GLU 24 14.784 -15.529 -11.997 191 HB3 GLU 24 3HB GLU 24 13.036 -15.706 -12.080 192 HG2 GLU 24 2HG GLU 24 14.929 -16.960 -14.049 193 HG3 GLU 24 3HG GLU 24 14.346 -17.769 -12.596 194 H ASN 25 H ASN 25 11.381 -14.049 -13.640 195 HA ASN 25 HA ASN 25 11.603 -11.388 -12.462 196 HB2 ASN 25 2HB ASN 25 9.141 -12.791 -13.522 197 HB3 ASN 25 3HB ASN 25 9.290 -11.082 -13.123 198 HD21 ASN 25 1HD2 ASN 25 9.807 -9.735 -14.696 199 HD22 ASN 25 2HD2 ASN 25 10.449 -10.182 -16.236 200 H LEU 26 H LEU 26 10.771 -10.817 -10.501 201 HA LEU 26 HA LEU 26 9.322 -12.825 -8.945 202 HB2 LEU 26 2HB LEU 26 11.889 -11.490 -8.127 203 HB3 LEU 26 3HB LEU 26 10.784 -12.223 -6.966 204 HG LEU 26 HG LEU 26 11.147 -14.294 -8.663 205 HD11 LEU 26 1HD1 LEU 26 12.873 -12.682 -9.805 206 HD12 LEU 26 2HD1 LEU 26 13.233 -14.396 -9.600 207 HD13 LEU 26 3HD1 LEU 26 13.915 -13.213 -8.485 208 HD21 LEU 26 3HD2 LEU 26 12.166 -15.290 -6.894 209 HD22 LEU 26 1HD2 LEU 26 11.569 -13.847 -6.073 210 HD23 LEU 26 2HD2 LEU 26 13.249 -13.927 -6.606 211 H SER 27 H SER 27 7.958 -11.990 -7.376 212 HA SER 27 HA SER 27 7.451 -9.115 -7.613 213 HB2 SER 27 2HB SER 27 5.723 -11.228 -7.756 214 HB3 SER 27 3HB SER 27 5.544 -10.747 -6.069 215 HG SER 27 HG SER 27 4.118 -9.641 -7.539 216 H ILE 28 H ILE 28 8.333 -7.865 -6.114 217 HA ILE 28 HA ILE 28 9.211 -8.898 -3.584 218 HB ILE 28 HB ILE 28 9.086 -6.012 -4.459 219 HG12 ILE 28 2HG1 ILE 28 11.342 -8.007 -4.752 220 HG13 ILE 28 3HG1 ILE 28 10.355 -7.381 -6.068 221 HG21 ILE 28 1HG2 ILE 28 10.924 -5.749 -2.816 222 HG22 ILE 28 2HG2 ILE 28 9.397 -6.239 -2.085 223 HG23 ILE 28 3HG2 ILE 28 10.679 -7.425 -2.326 224 HD11 ILE 28 3HD1 ILE 28 11.429 -5.179 -4.638 225 HD12 ILE 28 1HD1 ILE 28 12.734 -6.314 -4.986 226 HD13 ILE 28 2HD1 ILE 28 11.741 -5.680 -6.299 227 H CYS 29 H CYS 29 8.486 -8.279 -1.522 228 HA CYS 29 HA CYS 29 5.774 -7.128 -1.453 229 HB2 CYS 29 2HB CYS 29 6.803 -9.244 0.441 230 HB3 CYS 29 3HB CYS 29 5.153 -8.651 0.291 231 HG CYS 29 HG CYS 29 6.775 -10.419 -2.150 232 H ALA 30 H ALA 30 8.876 -7.491 0.157 233 HA ALA 30 HA ALA 30 8.686 -4.896 1.325 234 HB1 ALA 30 1HB ALA 30 9.060 -6.019 3.707 235 HB2 ALA 30 2HB ALA 30 7.456 -5.608 3.098 236 HB3 ALA 30 3HB ALA 30 8.045 -7.267 2.984 237 H HIS 31 H HIS 31 10.597 -4.581 2.927 238 HA HIS 31 HA HIS 31 12.907 -6.136 1.963 239 HB2 HIS 31 2HB HIS 31 14.236 -4.168 1.836 240 HB3 HIS 31 3HB HIS 31 12.724 -3.790 1.016 241 HD1 HIS 31 HD1 HIS 31 14.983 -2.137 3.015 242 HD2 HIS 31 HD2 HIS 31 10.873 -2.669 3.317 243 HE1 HIS 31 HE1 HIS 31 14.169 -0.268 4.489 244 H TYR 32 H TYR 32 14.891 -5.584 3.462 245 HA TYR 32 HA TYR 32 14.037 -5.472 6.265 246 HB2 TYR 32 2HB TYR 32 14.271 -7.868 5.480 247 HB3 TYR 32 3HB TYR 32 15.987 -7.546 5.258 248 HD1 TYR 32 HD2 TYR 32 13.284 -7.790 7.762 249 HD2 TYR 32 HD1 TYR 32 17.478 -7.485 7.114 250 HE1 TYR 32 HE2 TYR 32 13.683 -8.324 10.130 251 HE2 TYR 32 HE1 TYR 32 17.889 -8.019 9.480 252 HH TYR 32 HH TYR 32 16.473 -9.355 11.337 253 H ASP 33 H ASP 33 14.987 -3.556 6.731 254 HA ASP 33 HA ASP 33 16.609 -2.010 7.137 255 HB2 ASP 33 2HB ASP 33 17.418 -3.916 8.548 256 HB3 ASP 33 3HB ASP 33 18.460 -4.400 7.213 257 H TYR 34 H TYR 34 16.091 -2.909 4.338 258 HA TYR 34 HA TYR 34 16.836 -2.400 2.250 259 HB2 TYR 34 2HB TYR 34 19.039 -0.848 3.616 260 HB3 TYR 34 3HB TYR 34 18.436 -0.623 1.978 261 HD1 TYR 34 HD2 TYR 34 17.771 -0.042 5.535 262 HD2 TYR 34 HD1 TYR 34 16.358 0.552 1.566 263 HE1 TYR 34 HE2 TYR 34 16.168 1.629 6.363 264 HE2 TYR 34 HE1 TYR 34 14.751 2.226 2.383 265 HH TYR 34 HH TYR 34 13.687 2.966 4.320 266 H GLU 35 H GLU 35 18.097 -4.563 4.068 267 HA GLU 35 HA GLU 35 20.567 -5.004 2.541 268 HB2 GLU 35 2HB GLU 35 19.668 -6.603 4.928 269 HB3 GLU 35 3HB GLU 35 21.289 -6.450 4.267 270 HG2 GLU 35 2HG GLU 35 19.728 -4.325 5.716 271 HG3 GLU 35 3HG GLU 35 21.126 -5.212 6.320 272 H TRP 36 H TRP 36 17.676 -6.751 3.664 273 HA TRP 36 HA TRP 36 18.059 -8.642 1.439 274 HB2 TRP 36 2HB TRP 36 16.596 -9.008 4.061 275 HB3 TRP 36 3HB TRP 36 16.631 -10.197 2.761 276 HD1 TRP 36 HD1 TRP 36 18.913 -8.593 5.404 277 HE1 TRP 36 HE1 TRP 36 20.953 -10.122 5.752 278 HE3 TRP 36 HE3 TRP 36 18.041 -11.972 1.668 279 HZ2 TRP 36 HZ2 TRP 36 22.049 -12.452 4.596 280 HZ3 TRP 36 HZ3 TRP 36 19.634 -13.821 1.355 281 HH2 TRP 36 HH2 TRP 36 21.596 -14.054 2.790 282 H PHE 37 H PHE 37 16.040 -9.514 0.485 283 HA PHE 37 HA PHE 37 13.792 -7.632 0.602 284 HB2 PHE 37 2HB PHE 37 15.584 -8.061 -1.644 285 HB3 PHE 37 3HB PHE 37 13.914 -8.414 -2.071 286 HD1 PHE 37 HD2 PHE 37 12.226 -6.559 -1.000 287 HD2 PHE 37 HD1 PHE 37 16.285 -5.943 -2.122 288 HE1 PHE 37 HE2 PHE 37 11.784 -4.153 -1.262 289 HE2 PHE 37 HE1 PHE 37 15.850 -3.535 -2.385 290 HZ PHE 37 HZ PHE 37 13.598 -2.637 -1.957 291 H ILE 38 H ILE 38 11.772 -8.513 0.165 292 HA ILE 38 HA ILE 38 11.696 -11.450 0.208 293 HB ILE 38 HB ILE 38 9.370 -9.647 0.830 294 HG12 ILE 38 2HG1 ILE 38 11.158 -8.955 2.318 295 HG13 ILE 38 3HG1 ILE 38 9.981 -9.897 3.226 296 HG21 ILE 38 1HG2 ILE 38 9.282 -11.928 2.395 297 HG22 ILE 38 2HG2 ILE 38 8.354 -11.625 0.927 298 HG23 ILE 38 3HG2 ILE 38 9.884 -12.498 0.838 299 HD11 ILE 38 3HD1 ILE 38 11.597 -11.231 3.913 300 HD12 ILE 38 1HD1 ILE 38 11.940 -11.684 2.244 301 HD13 ILE 38 2HD1 ILE 38 12.770 -10.309 2.974 302 H ALA 39 H ALA 39 11.777 -11.973 -1.946 303 HA ALA 39 HA ALA 39 9.582 -10.942 -3.624 304 HB1 ALA 39 1HB ALA 39 12.118 -10.539 -4.210 305 HB2 ALA 39 2HB ALA 39 11.994 -12.176 -4.855 306 HB3 ALA 39 3HB ALA 39 10.936 -10.904 -5.467 307 H LYS 40 H LYS 40 8.385 -12.385 -4.843 308 HA LYS 40 HA LYS 40 8.781 -15.230 -4.182 309 HB2 LYS 40 2HB LYS 40 6.258 -15.362 -4.697 310 HB3 LYS 40 3HB LYS 40 6.757 -14.658 -3.165 311 HG2 LYS 40 2HG LYS 40 6.119 -12.548 -3.765 312 HG3 LYS 40 3HG LYS 40 6.355 -12.847 -5.488 313 HD2 LYS 40 2HD LYS 40 4.058 -12.798 -5.358 314 HD3 LYS 40 3HD LYS 40 4.370 -14.524 -5.161 315 HE2 LYS 40 2HE LYS 40 2.915 -14.160 -3.428 316 HE3 LYS 40 3HE LYS 40 4.456 -13.893 -2.615 317 HZ1 LYS 40 3HZ LYS 40 3.490 -11.987 -1.985 318 HZ2 LYS 40 1HZ LYS 40 2.341 -12.017 -3.226 319 HZ3 LYS 40 2HZ LYS 40 3.902 -11.442 -3.532 320 HA PRO 41 HA PRO 41 9.099 -16.219 -8.446 321 HB2 PRO 41 2HB PRO 41 7.822 -18.612 -8.559 322 HB3 PRO 41 3HB PRO 41 9.408 -18.405 -7.806 323 HG2 PRO 41 2HG PRO 41 6.707 -18.548 -6.524 324 HG3 PRO 41 3HG PRO 41 8.227 -19.310 -6.020 325 HD2 PRO 41 2HD PRO 41 7.278 -17.050 -4.869 326 HD3 PRO 41 3HD PRO 41 9.014 -17.379 -5.037 327 H ILE 42 H ILE 42 8.057 -15.544 -10.210 328 HA ILE 42 HA ILE 42 5.184 -15.082 -10.070 329 HB ILE 42 HB ILE 42 7.094 -14.333 -12.285 330 HG12 ILE 42 2HG1 ILE 42 6.119 -12.691 -9.937 331 HG13 ILE 42 3HG1 ILE 42 7.759 -13.287 -10.166 332 HG21 ILE 42 1HG2 ILE 42 4.701 -12.720 -11.856 333 HG22 ILE 42 2HG2 ILE 42 5.366 -13.389 -13.345 334 HG23 ILE 42 3HG2 ILE 42 4.355 -14.390 -12.303 335 HD11 ILE 42 3HD1 ILE 42 7.423 -11.930 -12.462 336 HD12 ILE 42 1HD1 ILE 42 6.389 -10.993 -11.385 337 HD13 ILE 42 2HD1 ILE 42 8.092 -11.228 -10.989 338 H ASN 43 H ASN 43 7.527 -16.815 -12.091 339 HA ASN 43 HA ASN 43 5.825 -17.811 -14.031 340 HB2 ASN 43 2HB ASN 43 8.246 -18.071 -14.162 341 HB3 ASN 43 3HB ASN 43 8.227 -19.157 -12.776 342 HD21 ASN 43 1HD2 ASN 43 8.112 -21.251 -13.164 343 HD22 ASN 43 2HD2 ASN 43 7.647 -21.977 -14.662 344 H ARG 43 H ARG 43 7.028 -19.870 -11.391 345 HA ARG 43 HA ARG 43 4.550 -21.405 -11.515 346 HB2 ARG 43 2HB ARG 43 5.722 -23.058 -10.160 347 HB3 ARG 43 3HB ARG 43 6.687 -22.617 -11.562 348 HG2 ARG 43 2HG ARG 43 8.270 -21.531 -10.307 349 HG3 ARG 43 3HG ARG 43 7.146 -21.192 -8.989 350 HD2 ARG 43 2HD ARG 43 8.295 -23.891 -9.695 351 HD3 ARG 43 3HD ARG 43 8.794 -22.876 -8.343 352 HE ARG 43 HE ARG 43 6.058 -23.305 -8.097 353 HH11 ARG 43 1HH1 ARG 43 9.005 -25.156 -8.032 354 HH12 ARG 43 2HH1 ARG 43 8.379 -26.360 -6.955 355 HH21 ARG 43 1HH2 ARG 43 5.222 -24.884 -6.678 356 HH22 ARG 43 2HH2 ARG 43 6.227 -26.205 -6.186 357 H LEU 44 H LEU 44 4.023 -22.357 -9.161 358 HA LEU 44 HA LEU 44 3.196 -20.043 -7.629 359 HB2 LEU 44 2HB LEU 44 2.567 -22.965 -7.568 360 HB3 LEU 44 3HB LEU 44 2.158 -21.948 -6.188 361 HG LEU 44 HG LEU 44 0.774 -20.542 -7.685 362 HD11 LEU 44 1HD1 LEU 44 0.211 -22.010 -9.870 363 HD12 LEU 44 2HD1 LEU 44 1.931 -22.355 -9.697 364 HD13 LEU 44 3HD1 LEU 44 1.378 -20.688 -9.850 365 HD21 LEU 44 3HD2 LEU 44 0.032 -22.701 -6.406 366 HD22 LEU 44 1HD2 LEU 44 -0.171 -23.350 -8.034 367 HD23 LEU 44 2HD2 LEU 44 -1.066 -21.912 -7.540 368 H GLY 45 H GLY 45 4.419 -23.175 -6.461 369 HA2 GLY 45 2HA GLY 45 5.829 -23.678 -4.718 370 HA3 GLY 45 3HA GLY 45 6.792 -22.335 -5.314 371 H GLY 46 H GLY 46 7.022 -20.597 -4.046 372 HA2 GLY 46 2HA GLY 46 5.058 -19.554 -2.328 373 HA3 GLY 46 3HA GLY 46 6.109 -20.605 -1.390 374 HA PRO 47 HA PRO 47 7.884 -16.228 -1.975 375 HB2 PRO 47 2HB PRO 47 7.408 -15.277 0.523 376 HB3 PRO 47 3HB PRO 47 6.268 -15.081 -0.813 377 HG2 PRO 47 2HG PRO 47 6.254 -17.087 1.409 378 HG3 PRO 47 3HG PRO 47 4.903 -16.162 0.728 379 HD2 PRO 47 2HD PRO 47 5.378 -18.745 0.070 380 HD3 PRO 47 3HD PRO 47 4.672 -17.583 -1.072 381 H GLY 48 H GLY 48 10.018 -16.102 -1.645 382 HA2 GLY 48 2HA GLY 48 11.151 -17.585 0.647 383 HA3 GLY 48 3HA GLY 48 11.935 -17.494 -0.923 384 H LEU 49 H LEU 49 13.821 -16.651 0.054 385 HA LEU 49 HA LEU 49 13.591 -13.797 0.726 386 HB2 LEU 49 2HB LEU 49 14.208 -15.708 2.561 387 HB3 LEU 49 3HB LEU 49 15.810 -15.248 1.989 388 HG LEU 49 HG LEU 49 15.485 -13.896 3.848 389 HD11 LEU 49 1HD1 LEU 49 15.287 -11.643 3.017 390 HD12 LEU 49 2HD1 LEU 49 14.470 -12.214 1.562 391 HD13 LEU 49 3HD1 LEU 49 16.163 -12.624 1.841 392 HD21 LEU 49 3HD2 LEU 49 12.649 -13.591 2.895 393 HD22 LEU 49 1HD2 LEU 49 13.350 -12.576 4.156 394 HD23 LEU 49 2HD2 LEU 49 13.227 -14.319 4.394 395 H VAL 50 H VAL 50 14.882 -12.506 -0.421 396 HA VAL 50 HA VAL 50 17.324 -13.593 -1.615 397 HB VAL 50 HB VAL 50 15.573 -13.793 -3.339 398 HG11 VAL 50 1HG1 VAL 50 14.250 -11.824 -2.463 399 HG12 VAL 50 2HG1 VAL 50 15.400 -10.790 -3.313 400 HG13 VAL 50 3HG1 VAL 50 14.406 -11.934 -4.215 401 HG21 VAL 50 3HG2 VAL 50 17.698 -11.713 -3.834 402 HG22 VAL 50 1HG2 VAL 50 17.821 -13.453 -4.092 403 HG23 VAL 50 2HG2 VAL 50 16.753 -12.485 -5.108 404 HA PRO 51 HA PRO 51 18.874 -9.731 -0.105 405 HB2 PRO 51 2HB PRO 51 21.317 -9.863 -1.281 406 HB3 PRO 51 3HB PRO 51 20.882 -10.821 0.140 407 HG2 PRO 51 2HG PRO 51 20.945 -11.629 -2.742 408 HG3 PRO 51 3HG PRO 51 21.510 -12.521 -1.317 409 HD2 PRO 51 2HD PRO 51 19.136 -13.038 -2.512 410 HD3 PRO 51 3HD PRO 51 19.389 -13.234 -0.766 411 H VAL 52 H VAL 52 19.760 -7.700 -0.951 412 HA VAL 52 HA VAL 52 18.405 -6.895 -3.338 413 HB VAL 52 HB VAL 52 20.461 -5.292 -1.821 414 HG11 VAL 52 1HG1 VAL 52 20.025 -3.902 -3.529 415 HG12 VAL 52 2HG1 VAL 52 18.547 -4.755 -3.977 416 HG13 VAL 52 3HG1 VAL 52 18.524 -3.578 -2.663 417 HG21 VAL 52 3HG2 VAL 52 19.115 -5.366 -0.049 418 HG22 VAL 52 1HG2 VAL 52 17.925 -4.482 -1.004 419 HG23 VAL 52 2HG2 VAL 52 17.878 -6.244 -0.948 420 H SER 53 H SER 53 21.553 -8.066 -2.617 421 HA SER 53 HA SER 53 22.825 -6.924 -4.940 422 HB2 SER 53 2HB SER 53 23.765 -9.081 -3.034 423 HB3 SER 53 3HB SER 53 24.757 -8.322 -4.280 424 HG SER 53 HG SER 53 24.190 -7.447 -1.802 425 H TYR 54 H TYR 54 20.553 -9.215 -4.657 426 HA TYR 54 HA TYR 54 21.544 -10.677 -7.011 427 HB2 TYR 54 2HB TYR 54 20.203 -11.780 -4.550 428 HB3 TYR 54 3HB TYR 54 20.187 -12.650 -6.080 429 HD1 TYR 54 HD1 TYR 54 22.666 -10.910 -3.879 430 HD2 TYR 54 HD2 TYR 54 21.814 -14.252 -6.371 431 HE1 TYR 54 HE1 TYR 54 24.875 -11.857 -3.355 432 HE2 TYR 54 HE2 TYR 54 24.020 -15.208 -5.853 433 HH TYR 54 HH TYR 54 26.487 -13.442 -4.377 434 H VAL 55 H VAL 55 19.691 -8.346 -6.559 435 HA VAL 55 HA VAL 55 17.590 -9.288 -8.328 436 HB VAL 55 HB VAL 55 15.782 -8.283 -6.976 437 HG11 VAL 55 1HG1 VAL 55 15.614 -10.086 -5.331 438 HG12 VAL 55 2HG1 VAL 55 16.180 -10.689 -6.890 439 HG13 VAL 55 3HG1 VAL 55 17.321 -10.460 -5.564 440 HG21 VAL 55 3HG2 VAL 55 18.038 -7.826 -5.064 441 HG22 VAL 55 1HG2 VAL 55 16.764 -6.719 -5.576 442 HG23 VAL 55 2HG2 VAL 55 16.392 -8.039 -4.467 443 H ARG 56 H ARG 56 16.663 -7.662 -9.570 444 HA ARG 56 HA ARG 56 17.929 -5.015 -9.303 445 HB2 ARG 56 2HB ARG 56 18.742 -5.900 -11.316 446 HB3 ARG 56 3HB ARG 56 17.197 -6.637 -11.722 447 HG2 ARG 56 2HG ARG 56 16.296 -4.653 -12.478 448 HG3 ARG 56 3HG ARG 56 17.424 -3.667 -11.546 449 HD2 ARG 56 2HD ARG 56 17.978 -3.553 -13.899 450 HD3 ARG 56 3HD ARG 56 19.251 -4.402 -13.022 451 HE ARG 56 HE ARG 56 18.730 -6.327 -14.171 452 HH11 ARG 56 1HH1 ARG 56 16.270 -3.924 -14.713 453 HH12 ARG 56 2HH1 ARG 56 15.498 -4.813 -15.984 454 HH21 ARG 56 1HH2 ARG 56 17.722 -7.507 -15.842 455 HH22 ARG 56 2HH2 ARG 56 16.323 -6.852 -16.624 456 H ILE 57 H ILE 57 16.531 -3.594 -8.508 457 HA ILE 57 HA ILE 57 13.723 -3.916 -8.551 458 HB ILE 57 HB ILE 57 15.338 -1.416 -8.032 459 HG12 ILE 57 2HG1 ILE 57 15.855 -3.304 -6.514 460 HG13 ILE 57 3HG1 ILE 57 15.078 -1.966 -5.675 461 HG21 ILE 57 1HG2 ILE 57 12.436 -2.023 -7.893 462 HG22 ILE 57 2HG2 ILE 57 13.126 -1.000 -6.634 463 HG23 ILE 57 3HG2 ILE 57 13.261 -0.527 -8.328 464 HD11 ILE 57 3HD1 ILE 57 13.658 -4.442 -6.624 465 HD12 ILE 57 1HD1 ILE 57 14.251 -4.183 -4.983 466 HD13 ILE 57 2HD1 ILE 57 12.986 -3.143 -5.639 467 H ILE 58 H ILE 58 12.391 -3.648 -10.203 468 HA ILE 58 HA ILE 58 12.918 -1.491 -12.124 469 HB ILE 58 HB ILE 58 12.040 -3.039 -13.937 470 HG12 ILE 58 2HG1 ILE 58 12.868 -5.179 -11.967 471 HG13 ILE 58 3HG1 ILE 58 11.195 -4.765 -12.326 472 HG21 ILE 58 1HG2 ILE 58 14.508 -4.348 -13.429 473 HG22 ILE 58 2HG2 ILE 58 14.175 -3.017 -14.535 474 HG23 ILE 58 3HG2 ILE 58 14.641 -2.682 -12.868 475 HD11 ILE 58 3HD1 ILE 58 11.610 -5.363 -14.690 476 HD12 ILE 58 1HD1 ILE 58 13.228 -5.894 -14.233 477 HD13 ILE 58 2HD1 ILE 58 11.811 -6.711 -13.571 478 H ASP 59 H ASP 59 10.970 -1.026 -13.492 479 HA ASP 59 HA ASP 59 8.539 -1.307 -11.856 480 HB2 ASP 59 2HB ASP 59 9.081 0.994 -12.025 481 HB3 ASP 59 3HB ASP 59 9.453 0.859 -13.742 482 H LEU 60 H LEU 60 6.874 -2.415 -12.646 483 HA LEU 60 HA LEU 60 6.998 -3.921 -14.976 484 HB2 LEU 60 2HB LEU 60 4.972 -3.259 -12.976 485 HB3 LEU 60 3HB LEU 60 4.304 -3.631 -14.564 486 HG LEU 60 HG LEU 60 6.078 -5.435 -12.918 487 HD11 LEU 60 1HD1 LEU 60 3.150 -5.653 -13.600 488 HD12 LEU 60 2HD1 LEU 60 3.803 -5.189 -12.029 489 HD13 LEU 60 3HD1 LEU 60 4.098 -6.808 -12.663 490 HD21 LEU 60 3HD2 LEU 60 6.570 -5.969 -15.133 491 HD22 LEU 60 1HD2 LEU 60 4.918 -5.669 -15.673 492 HD23 LEU 60 2HD2 LEU 60 5.284 -7.099 -14.708 493 H MET 61 H MET 61 5.904 -0.652 -14.471 494 HA MET 61 HA MET 61 4.693 -0.470 -17.100 495 HB2 MET 61 2HB MET 61 5.073 1.485 -14.841 496 HB3 MET 61 3HB MET 61 4.473 1.992 -16.415 497 HG2 MET 61 2HG MET 61 2.470 1.594 -15.502 498 HG3 MET 61 3HG MET 61 2.827 -0.081 -15.917 499 HE1 MET 61 3HE MET 61 3.242 -1.859 -14.531 500 HE2 MET 61 1HE MET 61 2.974 -1.936 -12.789 501 HE3 MET 61 2HE MET 61 1.626 -1.597 -13.875 502 H ASP 62 H ASP 62 7.754 0.038 -15.650 503 HA ASP 62 HA ASP 62 8.923 0.733 -18.175 504 HB2 ASP 62 2HB ASP 62 8.017 2.908 -16.934 505 HB3 ASP 62 3HB ASP 62 9.542 2.747 -16.068 506 HA PRO 63 HA PRO 63 11.611 -1.729 -15.360 507 HB2 PRO 63 2HB PRO 63 12.469 -3.413 -17.308 508 HB3 PRO 63 3HB PRO 63 10.965 -3.665 -16.415 509 HG2 PRO 63 2HG PRO 63 11.378 -2.478 -19.132 510 HG3 PRO 63 3HG PRO 63 10.144 -3.630 -18.590 511 HD2 PRO 63 2HD PRO 63 9.642 -0.985 -18.877 512 HD3 PRO 63 3HD PRO 63 8.839 -1.980 -17.646 513 H ALA 64 H ALA 64 12.043 0.283 -18.051 514 HA ALA 64 HA ALA 64 14.950 0.008 -18.076 515 HB1 ALA 64 1HB ALA 64 14.893 0.816 -20.161 516 HB2 ALA 64 2HB ALA 64 13.157 0.512 -20.076 517 HB3 ALA 64 3HB ALA 64 13.789 2.121 -19.726 518 H LYS 65 H LYS 65 12.783 1.567 -16.207 519 HA LYS 65 HA LYS 65 14.092 4.145 -16.060 520 HB2 LYS 65 2HB LYS 65 11.700 2.880 -14.834 521 HB3 LYS 65 3HB LYS 65 12.479 4.163 -13.917 522 HG2 LYS 65 2HG LYS 65 12.276 5.120 -16.540 523 HG3 LYS 65 3HG LYS 65 10.731 4.345 -16.181 524 HD2 LYS 65 2HD LYS 65 10.410 6.521 -15.432 525 HD3 LYS 65 3HD LYS 65 10.855 5.659 -13.957 526 HE2 LYS 65 2HE LYS 65 12.796 6.779 -13.741 527 HE3 LYS 65 3HE LYS 65 13.114 6.763 -15.475 528 HZ1 LYS 65 3HZ LYS 65 12.555 8.976 -14.220 529 HZ2 LYS 65 1HZ LYS 65 10.959 8.477 -14.477 530 HZ3 LYS 65 2HZ LYS 65 11.996 8.706 -15.793 531 H TYR 66 H TYR 66 13.731 1.292 -13.973 532 HA TYR 66 HA TYR 66 15.962 2.300 -12.336 533 HB2 TYR 66 2HB TYR 66 13.745 0.367 -11.639 534 HB3 TYR 66 3HB TYR 66 15.110 0.724 -10.587 535 HD1 TYR 66 HD1 TYR 66 12.384 2.477 -12.447 536 HD2 TYR 66 HD2 TYR 66 14.875 2.389 -8.999 537 HE1 TYR 66 HE1 TYR 66 11.157 4.396 -11.519 538 HE2 TYR 66 HE2 TYR 66 13.654 4.307 -8.061 539 HH TYR 66 HH TYR 66 12.232 6.301 -9.165 540 H ALA 67 H ALA 67 16.026 0.759 -14.909 541 HA ALA 67 HA ALA 67 16.969 -1.869 -14.225 542 HB1 ALA 67 1HB ALA 67 16.160 -0.538 -16.581 543 HB2 ALA 67 2HB ALA 67 17.815 -1.095 -16.835 544 HB3 ALA 67 3HB ALA 67 16.559 -2.243 -16.372 545 H SER 68 H SER 68 18.347 1.268 -14.443 546 HA SER 68 HA SER 68 21.067 0.157 -14.524 547 HB2 SER 68 2HB SER 68 21.798 2.464 -15.010 548 HB3 SER 68 3HB SER 68 20.608 1.902 -16.184 549 HG SER 68 HG SER 68 20.330 4.090 -15.220 550 H VAL 69 H VAL 69 18.759 1.226 -12.369 551 HA VAL 69 HA VAL 69 20.070 2.781 -10.508 552 HB VAL 69 HB VAL 69 17.651 2.044 -10.447 553 HG11 VAL 69 1HG1 VAL 69 18.599 -0.467 -10.438 554 HG12 VAL 69 2HG1 VAL 69 18.383 -0.225 -8.704 555 HG13 VAL 69 3HG1 VAL 69 17.015 -0.027 -9.800 556 HG21 VAL 69 3HG2 VAL 69 18.639 1.553 -7.721 557 HG22 VAL 69 1HG2 VAL 69 19.260 3.011 -8.496 558 HG23 VAL 69 2HG2 VAL 69 17.521 2.777 -8.321 559 H ASP 70 H ASP 70 21.041 2.231 -8.449 560 HA ASP 70 HA ASP 70 22.735 -0.159 -8.668 561 HB2 ASP 70 2HB ASP 70 23.111 2.367 -7.046 562 HB3 ASP 70 3HB ASP 70 24.218 0.997 -7.047 563 H THR 71 H THR 71 21.082 -1.562 -7.860 564 HA THR 71 HA THR 71 19.684 -1.283 -5.485 565 HB THR 71 HB THR 71 20.109 -3.969 -5.518 566 HG1 THR 71 HG1 THR 71 20.288 -4.560 -7.730 567 HG21 THR 71 3HG2 THR 71 18.193 -3.674 -7.465 568 HG22 THR 71 1HG2 THR 71 18.152 -2.114 -6.645 569 HG23 THR 71 2HG2 THR 71 17.905 -3.600 -5.727 570 H TYR 72 H TYR 72 22.900 -2.681 -6.020 571 HA TYR 72 HA TYR 72 23.410 -3.605 -3.453 572 HB2 TYR 72 2HB TYR 72 24.918 -4.183 -5.210 573 HB3 TYR 72 3HB TYR 72 25.268 -2.493 -5.555 574 HD1 TYR 72 HD1 TYR 72 25.474 -4.892 -2.692 575 HD2 TYR 72 HD2 TYR 72 27.265 -1.645 -4.777 576 HE1 TYR 72 HE1 TYR 72 27.406 -4.991 -1.173 577 HE2 TYR 72 HE2 TYR 72 29.203 -1.735 -3.265 578 HH TYR 72 HH TYR 72 29.399 -2.764 -0.587 579 H ASP 73 H ASP 73 23.831 -0.371 -4.810 580 HA ASP 73 HA ASP 73 25.130 0.778 -2.588 581 HB2 ASP 73 2HB ASP 73 23.624 1.843 -4.941 582 HB3 ASP 73 3HB ASP 73 24.001 2.936 -3.612 583 H ARG 74 H ARG 74 24.307 0.732 -0.598 584 HA ARG 74 HA ARG 74 21.668 0.412 0.141 585 HB2 ARG 74 2HB ARG 74 22.315 1.009 2.342 586 HB3 ARG 74 3HB ARG 74 23.727 0.259 1.611 587 HG2 ARG 74 2HG ARG 74 23.321 3.235 1.723 588 HG3 ARG 74 3HG ARG 74 24.164 2.320 2.975 589 HD2 ARG 74 2HD ARG 74 24.926 2.617 0.077 590 HD3 ARG 74 3HD ARG 74 25.809 3.198 1.489 591 HE ARG 74 HE ARG 74 25.662 0.496 1.839 592 HH11 ARG 74 1HH1 ARG 74 26.836 2.593 -0.680 593 HH12 ARG 74 2HH1 ARG 74 28.060 1.488 -1.210 594 HH21 ARG 74 1HH2 ARG 74 27.270 -0.968 1.150 595 HH22 ARG 74 2HH2 ARG 74 28.305 -0.538 -0.169 596 H GLU 75 H GLU 75 23.344 3.307 -0.829 597 HA GLU 75 HA GLU 75 21.493 5.193 0.186 598 HB2 GLU 75 2HB GLU 75 23.735 5.217 -1.751 599 HB3 GLU 75 3HB GLU 75 22.545 6.499 -1.924 600 HG2 GLU 75 2HG GLU 75 22.883 7.061 0.468 601 HG3 GLU 75 3HG GLU 75 24.178 5.866 0.521 602 H GLN 76 H GLN 76 21.947 3.952 -3.129 603 HA GLN 76 HA GLN 76 19.701 5.186 -4.244 604 HB2 GLN 76 2HB GLN 76 20.983 2.573 -5.064 605 HB3 GLN 76 3HB GLN 76 19.914 3.553 -6.060 606 HG2 GLN 76 2HG GLN 76 21.926 5.296 -5.272 607 HG3 GLN 76 3HG GLN 76 22.755 3.781 -5.623 608 HE21 GLN 76 1HE2 GLN 76 23.730 4.423 -7.486 609 HE22 GLN 76 2HE2 GLN 76 22.870 4.813 -8.933 610 H VAL 77 H VAL 77 20.055 1.822 -3.114 611 HA VAL 77 HA VAL 77 17.446 0.985 -3.525 612 HB VAL 77 HB VAL 77 19.461 -0.404 -2.779 613 HG11 VAL 77 1HG1 VAL 77 19.702 -0.788 -0.395 614 HG12 VAL 77 2HG1 VAL 77 19.969 0.916 -0.767 615 HG13 VAL 77 3HG1 VAL 77 18.441 0.396 -0.056 616 HG21 VAL 77 3HG2 VAL 77 16.620 -0.732 -2.078 617 HG22 VAL 77 1HG2 VAL 77 17.691 -1.782 -3.006 618 HG23 VAL 77 2HG2 VAL 77 17.740 -1.808 -1.243 619 H MET 78 H MET 78 18.800 2.896 -0.920 620 HA MET 78 HA MET 78 16.611 2.682 0.863 621 HB2 MET 78 2HB MET 78 19.032 4.354 0.623 622 HB3 MET 78 3HB MET 78 17.697 5.086 1.502 623 HG2 MET 78 2HG MET 78 17.617 3.088 2.957 624 HG3 MET 78 3HG MET 78 19.037 2.465 2.120 625 HE1 MET 78 3HE MET 78 21.586 4.102 2.273 626 HE2 MET 78 1HE MET 78 21.855 3.736 3.977 627 HE3 MET 78 2HE MET 78 21.077 2.547 2.932 628 H LYS 79 H LYS 79 17.564 5.324 -1.336 629 HA LYS 79 HA LYS 79 15.360 6.962 -0.948 630 HB2 LYS 79 2HB LYS 79 16.923 6.562 -3.506 631 HB3 LYS 79 3HB LYS 79 15.891 7.939 -3.139 632 HG2 LYS 79 2HG LYS 79 17.385 8.841 -1.652 633 HG3 LYS 79 3HG LYS 79 18.128 7.282 -1.287 634 HD2 LYS 79 2HD LYS 79 19.218 7.258 -3.450 635 HD3 LYS 79 3HD LYS 79 18.401 8.754 -3.908 636 HE2 LYS 79 2HE LYS 79 19.540 9.678 -1.738 637 HE3 LYS 79 3HE LYS 79 20.636 8.318 -1.977 638 HZ1 LYS 79 3HZ LYS 79 20.359 9.544 -4.442 639 HZ2 LYS 79 1HZ LYS 79 21.718 9.562 -3.434 640 HZ3 LYS 79 2HZ LYS 79 20.569 10.799 -3.328 641 H ILE 80 H ILE 80 15.750 4.181 -3.072 642 HA ILE 80 HA ILE 80 13.340 4.502 -4.513 643 HB ILE 80 HB ILE 80 14.882 1.969 -3.939 644 HG12 ILE 80 2HG1 ILE 80 14.937 3.467 -6.533 645 HG13 ILE 80 3HG1 ILE 80 15.946 4.014 -5.199 646 HG21 ILE 80 1HG2 ILE 80 12.714 2.570 -5.942 647 HG22 ILE 80 2HG2 ILE 80 13.740 1.138 -5.994 648 HG23 ILE 80 3HG2 ILE 80 12.662 1.400 -4.624 649 HD11 ILE 80 3HD1 ILE 80 16.293 1.772 -6.999 650 HD12 ILE 80 1HD1 ILE 80 17.464 2.589 -5.964 651 HD13 ILE 80 2HD1 ILE 80 16.443 1.311 -5.304 652 H ILE 81 H ILE 81 14.139 2.327 -1.800 653 HA ILE 81 HA ILE 81 11.553 1.316 -1.434 654 HB ILE 81 HB ILE 81 13.782 1.633 0.578 655 HG12 ILE 81 2HG1 ILE 81 12.886 -0.825 -0.935 656 HG13 ILE 81 3HG1 ILE 81 14.208 0.211 -1.460 657 HG21 ILE 81 1HG2 ILE 81 11.046 0.815 0.925 658 HG22 ILE 81 2HG2 ILE 81 12.144 -0.511 1.300 659 HG23 ILE 81 3HG2 ILE 81 12.312 1.034 2.132 660 HD11 ILE 81 3HD1 ILE 81 14.550 -0.569 1.287 661 HD12 ILE 81 1HD1 ILE 81 14.354 -1.977 0.244 662 HD13 ILE 81 2HD1 ILE 81 15.623 -0.799 -0.093 663 H ASP 82 H ASP 82 13.132 4.186 -0.149 664 HA ASP 82 HA ASP 82 11.082 4.839 1.716 665 HB2 ASP 82 2HB ASP 82 13.494 5.665 1.732 666 HB3 ASP 82 3HB ASP 82 13.014 6.789 0.463 667 H GLU 83 H GLU 83 11.859 5.980 -1.558 668 HA GLU 83 HA GLU 83 9.754 7.845 -1.743 669 HB2 GLU 83 2HB GLU 83 11.437 6.410 -3.777 670 HB3 GLU 83 3HB GLU 83 10.116 7.457 -4.277 671 HG2 GLU 83 2HG GLU 83 12.307 8.391 -2.452 672 HG3 GLU 83 3HG GLU 83 12.427 8.481 -4.208 673 H PHE 84 H PHE 84 10.012 4.472 -2.825 674 HA PHE 84 HA PHE 84 7.357 4.374 -3.860 675 HB2 PHE 84 2HB PHE 84 9.491 2.347 -3.301 676 HB3 PHE 84 3HB PHE 84 7.854 1.806 -3.657 677 HD1 PHE 84 HD1 PHE 84 10.481 4.086 -4.996 678 HD2 PHE 84 HD2 PHE 84 7.262 1.434 -5.848 679 HE1 PHE 84 HE1 PHE 84 10.936 4.313 -7.403 680 HE2 PHE 84 HE2 PHE 84 7.713 1.656 -8.256 681 HZ PHE 84 HZ PHE 84 9.552 3.096 -9.037 682 H LYS 85 H LYS 85 8.608 4.322 -0.733 683 HA LYS 85 HA LYS 85 7.716 3.921 1.321 684 HB2 LYS 85 2HB LYS 85 5.273 4.340 -0.366 685 HB3 LYS 85 3HB LYS 85 5.101 3.865 1.318 686 HG2 LYS 85 2HG LYS 85 5.081 6.080 1.667 687 HG3 LYS 85 3HG LYS 85 6.835 5.909 1.578 688 HD2 LYS 85 2HD LYS 85 6.962 7.005 -0.382 689 HD3 LYS 85 3HD LYS 85 5.510 6.231 -1.020 690 HE2 LYS 85 2HE LYS 85 4.300 7.770 0.722 691 HE3 LYS 85 3HE LYS 85 5.784 8.716 0.612 692 HZ1 LYS 85 3HZ LYS 85 5.374 8.540 -1.911 693 HZ2 LYS 85 1HZ LYS 85 4.461 9.644 -1.011 694 HZ3 LYS 85 2HZ LYS 85 3.783 8.166 -1.477 695 H ILE 86 H ILE 86 8.738 1.695 0.333 696 HA ILE 86 HA ILE 86 6.793 -0.445 0.269 697 HB ILE 86 HB ILE 86 9.808 -0.622 0.311 698 HG12 ILE 86 2HG1 ILE 86 7.971 -0.827 -2.079 699 HG13 ILE 86 3HG1 ILE 86 8.795 0.660 -1.623 700 HG21 ILE 86 1HG2 ILE 86 8.591 -2.669 1.004 701 HG22 ILE 86 2HG2 ILE 86 7.770 -2.666 -0.557 702 HG23 ILE 86 3HG2 ILE 86 9.519 -2.875 -0.481 703 HD11 ILE 86 3HD1 ILE 86 9.968 -1.904 -2.623 704 HD12 ILE 86 1HD1 ILE 86 10.138 -0.274 -3.275 705 HD13 ILE 86 2HD1 ILE 86 10.945 -0.711 -1.768 706 HA PRO 87 HA PRO 87 6.826 -1.151 4.636 707 HB2 PRO 87 2HB PRO 87 5.622 -3.584 4.601 708 HB3 PRO 87 3HB PRO 87 4.743 -2.073 4.337 709 HG2 PRO 87 2HG PRO 87 5.761 -4.048 2.331 710 HG3 PRO 87 3HG PRO 87 4.202 -3.205 2.379 711 HD2 PRO 87 2HD PRO 87 6.239 -2.411 0.780 712 HD3 PRO 87 3HD PRO 87 5.080 -1.268 1.489 713 H THR 88 H THR 88 7.657 -2.708 6.195 714 HA THR 88 HA THR 88 10.040 -4.064 5.166 715 HB THR 88 HB THR 88 9.810 -4.101 8.049 716 HG1 THR 88 HG1 THR 88 9.838 -1.513 6.861 717 HG21 THR 88 3HG2 THR 88 11.733 -3.155 5.973 718 HG22 THR 88 1HG2 THR 88 11.962 -4.332 7.265 719 HG23 THR 88 2HG2 THR 88 11.939 -2.608 7.636 720 H VAL 89 H VAL 89 10.668 -6.100 6.401 721 HA VAL 89 HA VAL 89 8.894 -8.145 5.884 722 HB VAL 89 HB VAL 89 11.084 -8.126 7.965 723 HG11 VAL 89 1HG1 VAL 89 10.712 -10.683 6.816 724 HG12 VAL 89 2HG1 VAL 89 10.462 -10.190 8.492 725 HG13 VAL 89 3HG1 VAL 89 9.131 -10.103 7.338 726 HG21 VAL 89 3HG2 VAL 89 11.044 -8.567 5.013 727 HG22 VAL 89 1HG2 VAL 89 12.198 -7.671 6.002 728 HG23 VAL 89 2HG2 VAL 89 12.217 -9.435 6.005 729 H GLU 90 H GLU 90 9.647 -6.793 9.101 730 HA GLU 90 HA GLU 90 7.821 -8.238 10.587 731 HB2 GLU 90 2HB GLU 90 8.952 -5.473 10.924 732 HB3 GLU 90 3HB GLU 90 7.796 -6.123 12.078 733 HG2 GLU 90 2HG GLU 90 9.344 -8.079 12.368 734 HG3 GLU 90 3HG GLU 90 10.527 -7.183 11.416 735 H GLN 91 H GLN 91 7.330 -5.043 9.090 736 HA GLN 91 HA GLN 91 4.676 -4.679 9.846 737 HB2 GLN 91 2HB GLN 91 5.863 -3.748 7.233 738 HB3 GLN 91 3HB GLN 91 4.545 -3.010 8.133 739 HG2 GLN 91 2HG GLN 91 7.468 -3.043 8.798 740 HG3 GLN 91 3HG GLN 91 6.420 -1.654 8.513 741 HE21 GLN 91 1HE2 GLN 91 8.140 -2.757 10.822 742 HE22 GLN 91 2HE2 GLN 91 7.110 -2.575 12.197 743 H TRP 92 H TRP 92 6.025 -6.290 6.998 744 HA TRP 92 HA TRP 92 3.551 -6.809 5.732 745 HB2 TRP 92 2HB TRP 92 5.633 -6.910 4.486 746 HB3 TRP 92 3HB TRP 92 6.214 -8.227 5.501 747 HD1 TRP 92 HD1 TRP 92 3.026 -7.695 3.326 748 HE1 TRP 92 HE1 TRP 92 2.632 -9.852 1.978 749 HE3 TRP 92 HE3 TRP 92 6.983 -10.449 5.026 750 HZ2 TRP 92 HZ2 TRP 92 3.838 -12.386 1.677 751 HZ3 TRP 92 HZ3 TRP 92 7.292 -12.731 4.158 752 HH2 TRP 92 HH2 TRP 92 5.750 -13.678 2.519 753 H LYS 93 H LYS 93 5.458 -8.583 8.099 754 HA LYS 93 HA LYS 93 3.954 -10.986 7.992 755 HB2 LYS 93 2HB LYS 93 5.703 -9.838 10.172 756 HB3 LYS 93 3HB LYS 93 5.032 -11.463 10.196 757 HG2 LYS 93 2HG LYS 93 6.685 -10.567 7.877 758 HG3 LYS 93 3HG LYS 93 7.460 -11.082 9.378 759 HD2 LYS 93 2HD LYS 93 7.344 -13.130 8.448 760 HD3 LYS 93 3HD LYS 93 5.672 -13.086 9.012 761 HE2 LYS 93 2HE LYS 93 5.417 -11.821 6.644 762 HE3 LYS 93 3HE LYS 93 6.764 -12.899 6.278 763 HZ1 LYS 93 3HZ LYS 93 5.138 -14.358 5.847 764 HZ2 LYS 93 1HZ LYS 93 3.979 -13.519 6.751 765 HZ3 LYS 93 2HZ LYS 93 5.069 -14.554 7.526 766 H ASP 94 H ASP 94 3.654 -8.010 9.828 767 HA ASP 94 HA ASP 94 1.665 -8.979 11.629 768 HB2 ASP 94 2HB ASP 94 3.218 -6.910 11.859 769 HB3 ASP 94 3HB ASP 94 1.993 -6.081 10.904 770 H GLN 95 H GLN 95 1.533 -6.952 8.707 771 HA GLN 95 HA GLN 95 -1.253 -6.623 8.662 772 HB2 GLN 95 2HB GLN 95 -0.967 -5.973 6.324 773 HB3 GLN 95 3HB GLN 95 0.276 -5.244 7.332 774 HG2 GLN 95 2HG GLN 95 1.843 -7.011 6.617 775 HG3 GLN 95 3HG GLN 95 0.596 -7.641 5.542 776 HE21 GLN 95 1HE2 GLN 95 0.109 -6.558 3.666 777 HE22 GLN 95 2HE2 GLN 95 1.069 -5.259 3.053 778 H THR 96 H THR 96 0.831 -9.111 7.276 779 HA THR 96 HA THR 96 -1.234 -10.448 5.848 780 HB THR 96 HB THR 96 0.392 -12.358 5.758 781 HG1 THR 96 HG1 THR 96 1.819 -12.319 7.326 782 HG21 THR 96 3HG2 THR 96 2.162 -11.024 4.497 783 HG22 THR 96 1HG2 THR 96 1.243 -9.588 4.946 784 HG23 THR 96 2HG2 THR 96 0.494 -10.839 3.955 785 H ARG 97 H ARG 97 0.297 -10.986 9.004 786 HA ARG 97 HA ARG 97 -1.026 -13.353 9.679 787 HB2 ARG 97 2HB ARG 97 0.298 -11.172 11.231 788 HB3 ARG 97 3HB ARG 97 -0.668 -12.356 12.102 789 HG2 ARG 97 2HG ARG 97 1.413 -13.281 10.175 790 HG3 ARG 97 3HG ARG 97 1.884 -12.727 11.783 791 HD2 ARG 97 2HD ARG 97 1.594 -15.014 12.073 792 HD3 ARG 97 3HD ARG 97 0.063 -14.340 12.631 793 HE ARG 97 HE ARG 97 -0.032 -15.020 9.868 794 HH11 ARG 97 1HH1 ARG 97 -0.181 -16.360 13.078 795 HH12 ARG 97 2HH1 ARG 97 -1.130 -17.729 12.603 796 HH21 ARG 97 1HH2 ARG 97 -1.281 -16.818 9.230 797 HH22 ARG 97 2HH2 ARG 97 -1.754 -17.990 10.414 798 H ARG 98 H ARG 98 -1.930 -9.973 10.260 799 HA ARG 98 HA ARG 98 -4.347 -10.638 11.635 800 HB2 ARG 98 2HB ARG 98 -4.807 -8.284 11.626 801 HB3 ARG 98 3HB ARG 98 -3.091 -8.499 11.944 802 HG2 ARG 98 2HG ARG 98 -2.572 -7.947 9.636 803 HG3 ARG 98 3HG ARG 98 -4.293 -7.779 9.279 804 HD2 ARG 98 2HD ARG 98 -3.861 -5.598 9.689 805 HD3 ARG 98 3HD ARG 98 -4.109 -6.103 11.360 806 HE ARG 98 HE ARG 98 -1.426 -6.481 10.826 807 HH11 ARG 98 1HH1 ARG 98 -3.670 -3.820 10.877 808 HH12 ARG 98 2HH1 ARG 98 -2.470 -2.646 11.309 809 HH21 ARG 98 1HH2 ARG 98 0.163 -4.946 11.394 810 HH22 ARG 98 2HH2 ARG 98 -0.291 -3.288 11.602 811 H TYR 99 H TYR 99 -3.473 -9.916 8.318 812 HA TYR 99 HA TYR 99 -6.116 -9.567 7.343 813 HB2 TYR 99 2HB TYR 99 -4.342 -8.681 6.028 814 HB3 TYR 99 3HB TYR 99 -3.503 -10.227 5.987 815 HD1 TYR 99 HD2 TYR 99 -7.038 -9.263 5.246 816 HD2 TYR 99 HD1 TYR 99 -3.422 -10.980 3.805 817 HE1 TYR 99 HE2 TYR 99 -8.149 -9.804 3.119 818 HE2 TYR 99 HE1 TYR 99 -4.522 -11.524 1.674 819 HH TYR 99 HH TYR 99 -7.774 -11.571 1.244 820 H LYS 100 H LYS 100 -4.096 -12.343 7.926 821 HA LYS 100 HA LYS 100 -5.900 -14.128 6.498 822 HB2 LYS 100 2HB LYS 100 -3.315 -14.594 7.987 823 HB3 LYS 100 3HB LYS 100 -4.271 -15.894 7.286 824 HG2 LYS 100 2HG LYS 100 -4.037 -14.265 5.151 825 HG3 LYS 100 3HG LYS 100 -2.525 -13.914 5.992 826 HD2 LYS 100 2HD LYS 100 -1.941 -15.697 4.629 827 HD3 LYS 100 3HD LYS 100 -2.309 -16.493 6.161 828 HE2 LYS 100 2HE LYS 100 -4.734 -16.589 5.091 829 HE3 LYS 100 3HE LYS 100 -3.808 -16.506 3.594 830 HZ1 LYS 100 3HZ LYS 100 -2.465 -18.407 4.546 831 HZ2 LYS 100 1HZ LYS 100 -4.044 -18.772 4.060 832 HZ3 LYS 100 2HZ LYS 100 -3.688 -18.577 5.702 833 H GLU 101 H GLU 101 -5.448 -12.891 9.640 834 HA GLU 101 HA GLU 101 -6.282 -14.995 11.263 835 HB2 GLU 101 2HB GLU 101 -6.265 -12.038 11.480 836 HB3 GLU 101 3HB GLU 101 -7.325 -12.899 12.586 837 HG2 GLU 101 2HG GLU 101 -4.520 -13.834 12.318 838 HG3 GLU 101 3HG GLU 101 -4.827 -12.340 13.203 839 H SER 102 H SER 102 -8.477 -14.652 12.589 840 HA SER 102 HA SER 102 -10.562 -15.210 10.674 841 HB2 SER 102 2HB SER 102 -10.913 -15.038 13.664 842 HB3 SER 102 3HB SER 102 -11.840 -15.992 12.507 843 HG SER 102 HG SER 102 -10.179 -17.402 12.322 844 H SER 103 H SER 103 -12.854 -14.311 11.603 845 HA SER 103 HA SER 103 -14.262 -12.524 11.616 846 HB2 SER 103 2HB SER 103 -11.934 -11.510 13.211 847 HB3 SER 103 3HB SER 103 -13.250 -10.411 12.797 848 HG SER 103 HG SER 103 -14.583 -12.306 13.672 849 H ILE 104 H ILE 104 -12.694 -12.957 9.290 850 HA ILE 104 HA ILE 104 -12.286 -10.202 8.327 851 HB ILE 104 HB ILE 104 -11.143 -12.727 7.130 852 HG12 ILE 104 2HG1 ILE 104 -10.249 -12.182 9.412 853 HG13 ILE 104 3HG1 ILE 104 -9.038 -12.148 8.135 854 HG21 ILE 104 1HG2 ILE 104 -9.592 -10.828 6.154 855 HG22 ILE 104 2HG2 ILE 104 -11.121 -11.253 5.386 856 HG23 ILE 104 3HG2 ILE 104 -11.025 -9.839 6.436 857 HD11 ILE 104 3HD1 ILE 104 -10.399 -9.746 9.332 858 HD12 ILE 104 1HD1 ILE 104 -8.763 -10.298 9.689 859 HD13 ILE 104 2HD1 ILE 104 -9.166 -9.720 8.071 860 H GLN 105 H GLN 105 -13.125 -9.604 6.314 861 HA GLN 105 HA GLN 105 -14.577 -11.378 4.640 862 HB2 GLN 105 2HB GLN 105 -16.834 -10.471 5.033 863 HB3 GLN 105 3HB GLN 105 -16.205 -11.311 6.445 864 HG2 GLN 105 2HG GLN 105 -15.467 -8.972 7.231 865 HG3 GLN 105 3HG GLN 105 -16.601 -8.379 6.019 866 HE21 GLN 105 1HE2 GLN 105 -17.414 -7.493 8.180 867 HE22 GLN 105 2HE2 GLN 105 -18.623 -8.438 8.973 868 H ILE 106 H ILE 106 -14.626 -10.531 2.657 869 HA ILE 106 HA ILE 106 -14.556 -7.605 2.370 870 HB ILE 106 HB ILE 106 -12.917 -9.466 0.654 871 HG12 ILE 106 2HG1 ILE 106 -11.194 -7.866 2.171 872 HG13 ILE 106 3HG1 ILE 106 -12.392 -8.452 3.320 873 HG21 ILE 106 1HG2 ILE 106 -11.777 -7.323 0.050 874 HG22 ILE 106 2HG2 ILE 106 -13.456 -7.436 -0.475 875 HG23 ILE 106 3HG2 ILE 106 -13.038 -6.471 0.940 876 HD11 ILE 106 3HD1 ILE 106 -11.861 -10.704 2.865 877 HD12 ILE 106 1HD1 ILE 106 -10.911 -10.268 1.445 878 HD13 ILE 106 2HD1 ILE 106 -10.327 -9.856 3.058 879 H GLY 107 H GLY 107 -15.431 -6.783 0.419 880 HA2 GLY 107 2HA GLY 107 -17.585 -8.398 -0.621 881 HA3 GLY 107 3HA GLY 107 -17.243 -6.723 -1.028 882 H ASN 108 H ASN 108 -15.530 -9.833 -1.391 883 HA ASN 108 HA ASN 108 -15.132 -9.147 -4.230 884 HB2 ASN 108 2HB ASN 108 -12.997 -10.323 -4.153 885 HB3 ASN 108 3HB ASN 108 -13.030 -9.053 -2.933 886 HD21 ASN 108 1HD2 ASN 108 -11.476 -11.564 -3.147 887 HD22 ASN 108 2HD2 ASN 108 -11.765 -12.402 -1.665 888 H GLY 109 H GLY 109 -15.209 -10.847 -5.747 889 HA2 GLY 109 2HA GLY 109 -16.897 -13.070 -4.876 890 HA3 GLY 109 3HA GLY 109 -16.609 -12.574 -6.537 891 H HIS 110 H HIS 110 -14.618 -13.670 -3.785 892 HA HIS 110 HA HIS 110 -13.825 -16.081 -4.999 893 HB2 HIS 110 2HB HIS 110 -12.629 -14.598 -6.552 894 HB3 HIS 110 3HB HIS 110 -11.798 -13.843 -5.195 895 HD1 HIS 110 HD1 HIS 110 -9.465 -14.631 -5.145 896 HD2 HIS 110 HD2 HIS 110 -12.085 -17.665 -6.234 897 HE1 HIS 110 HE1 HIS 110 -8.036 -16.679 -5.439 898 H GLY 111 H GLY 111 -12.759 -17.385 -3.565 899 HA2 GLY 111 2HA GLY 111 -11.060 -16.702 -1.517 900 HA3 GLY 111 3HA GLY 111 -12.672 -16.509 -0.842 901 H GLN 112 H GLN 112 -10.418 -18.448 -0.326 902 HA GLN 112 HA GLN 112 -12.042 -20.734 0.125 903 HB2 GLN 112 2HB GLN 112 -10.692 -22.310 -1.284 904 HB3 GLN 112 3HB GLN 112 -11.726 -21.217 -2.194 905 HG2 GLN 112 2HG GLN 112 -9.800 -19.786 -2.660 906 HG3 GLN 112 3HG GLN 112 -8.765 -20.893 -1.759 907 HE21 GLN 112 1HE2 GLN 112 -11.057 -20.835 -4.459 908 HE22 GLN 112 2HE2 GLN 112 -10.214 -21.992 -5.426 909 H SER 113 H SER 113 -11.090 -22.200 1.536 910 HA SER 113 HA SER 113 -8.501 -21.331 2.632 911 HB2 SER 113 2HB SER 113 -9.367 -22.735 4.661 912 HB3 SER 113 3HB SER 113 -10.022 -21.121 4.385 913 HG SER 113 HG SER 113 -11.880 -22.086 4.337 914 H GLN 114 H GLN 114 -7.404 -23.244 3.870 915 HA GLN 114 HA GLN 114 -7.662 -25.777 2.458 916 HB2 GLN 114 2HB GLN 114 -5.324 -23.937 2.245 917 HB3 GLN 114 3HB GLN 114 -5.019 -25.668 2.305 918 HG2 GLN 114 2HG GLN 114 -6.993 -24.530 0.369 919 HG3 GLN 114 3HG GLN 114 -5.265 -24.518 0.018 920 HE21 GLN 114 1HE2 GLN 114 -7.805 -26.044 -0.912 921 HE22 GLN 114 2HE2 GLN 114 -7.250 -27.677 -1.013 922 H GLY 115 H GLY 115 -5.762 -27.283 3.371 923 HA2 GLY 115 2HA GLY 115 -4.885 -26.830 6.024 924 HA3 GLY 115 3HA GLY 115 -6.365 -27.778 6.044 925 H LEU 116 H LEU 116 -3.135 -28.046 6.200 926 HA LEU 116 HA LEU 116 -3.179 -30.749 5.033 927 HB2 LEU 116 2HB LEU 116 -0.749 -28.979 5.119 928 HB3 LEU 116 3HB LEU 116 -0.936 -30.519 4.283 929 HG LEU 116 HG LEU 116 -2.799 -29.161 2.973 930 HD11 LEU 116 1HD1 LEU 116 -2.823 -26.978 3.338 931 HD12 LEU 116 2HD1 LEU 116 -1.131 -26.876 2.851 932 HD13 LEU 116 3HD1 LEU 116 -1.546 -27.152 4.543 933 HD21 LEU 116 3HD2 LEU 116 0.166 -28.951 2.460 934 HD22 LEU 116 1HD2 LEU 116 -1.103 -28.654 1.271 935 HD23 LEU 116 2HD2 LEU 116 -0.894 -30.267 1.954 936 H GLU 117 H GLU 117 -0.963 -28.810 7.049 937 HA GLU 117 HA GLU 117 -0.476 -31.105 8.747 938 HB2 GLU 117 2HB GLU 117 1.336 -29.524 8.031 939 HB3 GLU 117 3HB GLU 117 0.587 -28.293 9.039 940 HG2 GLU 117 2HG GLU 117 0.971 -29.630 11.016 941 HG3 GLU 117 3HG GLU 117 1.638 -30.932 10.033 942 H1 GLY -9 H GLY -9 7.116 -12.399 14.080 943 HA2 GLY -9 2HA GLY -9 6.307 -12.504 11.602 944 HA3 GLY -9 3HA GLY -9 7.949 -11.954 11.301 945 H LYS -8 H LYS -8 8.142 -13.934 10.048 946 HA LYS -8 HA LYS -8 8.897 -16.192 11.770 947 HB2 LYS -8 2HB LYS -8 8.027 -17.744 10.023 948 HB3 LYS -8 3HB LYS -8 6.772 -16.812 10.829 949 HG2 LYS -8 2HG LYS -8 7.051 -15.190 8.819 950 HG3 LYS -8 3HG LYS -8 7.799 -16.584 8.036 951 HD2 LYS -8 2HD LYS -8 5.596 -17.754 9.030 952 HD3 LYS -8 3HD LYS -8 4.981 -16.115 8.802 953 HE2 LYS -8 2HE LYS -8 4.519 -17.254 6.791 954 HE3 LYS -8 3HE LYS -8 5.922 -16.242 6.452 955 HZ1 LYS -8 3HZ LYS -8 7.343 -18.175 6.769 956 HZ2 LYS -8 1HZ LYS -8 6.204 -18.459 5.550 957 HZ3 LYS -8 2HZ LYS -8 5.992 -19.144 7.081 958 H PHE -7 H PHE -7 9.180 -14.672 8.583 959 HA PHE -7 HA PHE -7 11.277 -16.173 7.557 960 HB2 PHE -7 2HB PHE -7 10.438 -13.315 7.140 961 HB3 PHE -7 3HB PHE -7 11.840 -13.982 6.310 962 HD1 PHE -7 HD2 PHE -7 8.190 -14.229 6.706 963 HD2 PHE -7 HD1 PHE -7 11.597 -15.472 4.478 964 HE1 PHE -7 HE2 PHE -7 6.713 -15.158 4.971 965 HE2 PHE -7 HE1 PHE -7 10.126 -16.401 2.739 966 HZ PHE -7 HZ PHE -7 7.680 -16.246 2.985 967 H ILE -6 H ILE -6 11.768 -12.855 8.733 968 HA ILE -6 HA ILE -6 13.565 -11.858 9.720 969 HB ILE -6 HB ILE -6 13.923 -14.444 11.222 970 HG12 ILE -6 2HG1 ILE -6 11.556 -13.920 11.286 971 HG13 ILE -6 3HG1 ILE -6 12.272 -13.540 12.848 972 HG21 ILE -6 1HG2 ILE -6 14.596 -11.569 11.730 973 HG22 ILE -6 2HG2 ILE -6 14.430 -12.714 13.060 974 HG23 ILE -6 3HG2 ILE -6 15.641 -12.987 11.807 975 HD11 ILE -6 3HD1 ILE -6 12.491 -11.157 11.589 976 HD12 ILE -6 1HD1 ILE -6 11.008 -11.788 10.873 977 HD13 ILE -6 2HD1 ILE -6 11.142 -11.625 12.624 978 HA PRO -5 HA PRO -5 16.613 -13.945 6.957 979 HB2 PRO -5 2HB PRO -5 17.442 -11.643 5.779 980 HB3 PRO -5 3HB PRO -5 16.031 -12.552 5.225 981 HG2 PRO -5 2HG PRO -5 16.153 -10.120 6.966 982 HG3 PRO -5 3HG PRO -5 15.048 -10.483 5.627 983 HD2 PRO -5 2HD PRO -5 14.338 -10.780 8.223 984 HD3 PRO -5 3HD PRO -5 13.703 -11.823 6.935 985 H SER -4 H SER -4 17.687 -14.315 9.062 986 HA SER -4 HA SER -4 19.570 -12.222 9.858 987 HB2 SER -4 2HB SER -4 18.117 -13.548 11.522 988 HB3 SER -4 3HB SER -4 19.230 -14.884 11.228 989 HG SER -4 HG SER -4 20.778 -13.848 12.265 990 H ARG -3 H ARG -3 20.003 -13.496 7.363 991 HA ARG -3 HA ARG -3 22.251 -15.307 7.851 992 HB2 ARG -3 2HB ARG -3 21.477 -14.620 5.078 993 HB3 ARG -3 3HB ARG -3 21.905 -16.176 5.776 994 HG2 ARG -3 2HG ARG -3 19.266 -14.769 6.129 995 HG3 ARG -3 3HG ARG -3 19.581 -16.110 5.025 996 HD2 ARG -3 2HD ARG -3 19.600 -16.118 8.031 997 HD3 ARG -3 3HD ARG -3 18.587 -17.064 6.942 998 HE ARG -3 HE ARG -3 21.085 -17.884 6.320 999 HH11 ARG -3 1HH1 ARG -3 19.344 -17.602 9.321 1000 HH12 ARG -3 2HH1 ARG -3 20.176 -18.919 10.079 1001 HH21 ARG -3 1HH2 ARG -3 22.188 -19.620 7.306 1002 HH22 ARG -3 2HH2 ARG -3 21.794 -20.066 8.932 1003 HA PRO -2 HA PRO -2 25.381 -12.375 6.936 1004 HB2 PRO -2 2HB PRO -2 27.131 -13.826 5.452 1005 HB3 PRO -2 3HB PRO -2 26.912 -14.069 7.189 1006 HG2 PRO -2 2HG PRO -2 25.768 -15.622 4.900 1007 HG3 PRO -2 3HG PRO -2 26.463 -16.217 6.419 1008 HD2 PRO -2 2HD PRO -2 23.792 -16.037 6.010 1009 HD3 PRO -2 3HD PRO -2 24.531 -15.809 7.608 1010 H ALA -1 H ALA -1 24.429 -10.823 5.636 1011 HA ALA -1 HA ALA -1 23.603 -11.036 3.015 1012 HB1 ALA -1 1HB ALA -1 23.320 -9.072 4.582 1013 HB2 ALA -1 2HB ALA -1 24.945 -8.576 4.108 1014 HB3 ALA -1 3HB ALA -1 23.666 -8.677 2.899 1015 HA PRO 0 HA PRO 0 27.587 -11.929 1.128 1016 HB2 PRO 0 2HB PRO 0 26.551 -12.549 -1.304 1017 HB3 PRO 0 3HB PRO 0 26.548 -13.677 0.057 1018 HG2 PRO 0 2HG PRO 0 24.344 -11.920 -0.952 1019 HG3 PRO 0 3HG PRO 0 24.273 -13.610 -0.419 1020 HD2 PRO 0 2HD PRO 0 23.506 -11.549 1.162 1021 HD3 PRO 0 3HD PRO 0 24.228 -13.035 1.813 1022 H LYS 1 H LYS 1 28.877 -10.914 -0.441 1023 HA LYS 1 HA LYS 1 27.917 -8.260 -1.232 1024 HB2 LYS 1 2HB LYS 1 30.540 -9.409 -0.523 1025 HB3 LYS 1 3HB LYS 1 30.567 -8.256 -1.851 1026 HG2 LYS 1 2HG LYS 1 29.568 -6.562 -0.463 1027 HG3 LYS 1 3HG LYS 1 29.368 -7.715 0.858 1028 HD2 LYS 1 2HD LYS 1 31.294 -6.534 1.441 1029 HD3 LYS 1 3HD LYS 1 31.920 -8.011 0.707 1030 HE2 LYS 1 2HE LYS 1 33.208 -6.394 -0.316 1031 HE3 LYS 1 3HE LYS 1 31.904 -6.605 -1.483 1032 HZ1 LYS 1 3HZ LYS 1 32.071 -4.323 -1.266 1033 HZ2 LYS 1 1HZ LYS 1 32.352 -4.382 0.401 1034 HZ3 LYS 1 2HZ LYS 1 30.804 -4.690 -0.207 1035 HA PRO 2 HA PRO 2 27.816 -9.130 -5.531 1036 HB2 PRO 2 2HB PRO 2 28.866 -6.873 -6.614 1037 HB3 PRO 2 3HB PRO 2 27.263 -6.926 -5.871 1038 HG2 PRO 2 2HG PRO 2 29.854 -5.964 -4.721 1039 HG3 PRO 2 3HG PRO 2 28.240 -5.236 -4.607 1040 HD2 PRO 2 2HD PRO 2 29.325 -6.695 -2.600 1041 HD3 PRO 2 3HD PRO 2 27.579 -6.661 -2.921 1042 HA PRO 3 HA PRO 3 31.622 -10.674 -7.099 1043 HB2 PRO 3 2HB PRO 3 31.399 -10.231 -9.768 1044 HB3 PRO 3 3HB PRO 3 30.457 -11.461 -8.916 1045 HG2 PRO 3 2HG PRO 3 29.651 -8.703 -9.758 1046 HG3 PRO 3 3HG PRO 3 28.737 -10.219 -9.867 1047 HD2 PRO 3 2HD PRO 3 28.311 -8.398 -7.908 1048 HD3 PRO 3 3HD PRO 3 28.104 -10.143 -7.652 1049 H SER 4 H SER 4 30.778 -7.508 -8.489 1050 HA SER 4 HA SER 4 33.529 -6.862 -9.039 1051 HB2 SER 4 2HB SER 4 30.903 -5.468 -9.372 1052 HB3 SER 4 3HB SER 4 32.385 -4.514 -9.418 1053 HG SER 4 HG SER 4 32.563 -5.164 -11.398 1054 H SER 5 H SER 5 33.789 -7.437 -6.557 1055 HA SER 5 HA SER 5 33.318 -5.119 -4.857 1056 HB2 SER 5 2HB SER 5 34.165 -6.549 -3.039 1057 HB3 SER 5 3HB SER 5 32.874 -7.351 -3.934 1058 HG SER 5 HG SER 5 35.643 -7.865 -3.959 1059 H ALA 6 H ALA 6 36.110 -7.167 -5.719 1060 HA ALA 6 HA ALA 6 37.795 -4.771 -5.721 1061 HB1 ALA 6 1HB ALA 6 37.823 -6.688 -3.645 1062 HB2 ALA 6 2HB ALA 6 39.309 -6.896 -4.574 1063 HB3 ALA 6 3HB ALA 6 38.912 -5.321 -3.886 Start of MODEL 6 1 H1 MET -2 H MET -2 -0.187 -2.426 -4.991 2 HA MET -2 HA MET -2 1.278 0.065 -5.301 3 HB2 MET -2 2HB MET -2 3.340 -0.802 -4.351 4 HB3 MET -2 3HB MET -2 2.064 -0.826 -3.141 5 HG2 MET -2 2HG MET -2 2.132 -3.048 -2.933 6 HG3 MET -2 3HG MET -2 2.304 -3.305 -4.668 7 HE1 MET -2 3HE MET -2 5.222 -4.670 -5.200 8 HE2 MET -2 1HE MET -2 4.882 -5.447 -3.653 9 HE3 MET -2 2HE MET -2 3.556 -5.014 -4.732 10 H ALA -1 H ALA -1 3.300 -0.311 -6.644 11 HA ALA -1 HA ALA -1 2.562 -1.788 -8.979 12 HB1 ALA -1 1HB ALA -1 3.855 -0.244 -9.905 13 HB2 ALA -1 2HB ALA -1 4.417 0.278 -8.317 14 HB3 ALA -1 3HB ALA -1 5.265 -1.010 -9.173 15 HA PRO 1 HA PRO 1 4.623 -5.614 -8.381 16 HB2 PRO 1 2HB PRO 1 5.656 -6.114 -10.841 17 HB3 PRO 1 3HB PRO 1 3.927 -6.211 -10.487 18 HG2 PRO 1 2HG PRO 1 5.476 -3.993 -11.770 19 HG3 PRO 1 3HG PRO 1 3.899 -4.664 -12.224 20 HD2 PRO 1 2HD PRO 1 4.154 -2.359 -10.826 21 HD3 PRO 1 3HD PRO 1 2.781 -3.463 -10.605 22 H LEU 2 H LEU 2 6.760 -6.767 -8.701 23 HA LEU 2 HA LEU 2 9.087 -5.090 -9.047 24 HB2 LEU 2 2HB LEU 2 8.130 -4.991 -6.589 25 HB3 LEU 2 3HB LEU 2 8.975 -6.530 -6.445 26 HG LEU 2 HG LEU 2 10.086 -3.780 -6.800 27 HD11 LEU 2 1HD1 LEU 2 9.804 -5.158 -4.602 28 HD12 LEU 2 2HD1 LEU 2 11.287 -4.250 -4.897 29 HD13 LEU 2 3HD1 LEU 2 11.251 -5.992 -5.172 30 HD21 LEU 2 3HD2 LEU 2 12.278 -4.821 -7.342 31 HD22 LEU 2 1HD2 LEU 2 11.086 -4.958 -8.634 32 HD23 LEU 2 2HD2 LEU 2 11.439 -6.350 -7.610 33 H PHE 3 H PHE 3 10.482 -6.267 -10.163 34 HA PHE 3 HA PHE 3 10.673 -9.149 -9.598 35 HB2 PHE 3 2HB PHE 3 10.686 -7.810 -12.309 36 HB3 PHE 3 3HB PHE 3 11.103 -9.499 -12.036 37 HD1 PHE 3 HD2 PHE 3 9.405 -11.127 -11.474 38 HD2 PHE 3 HD1 PHE 3 8.403 -7.044 -12.140 39 HE1 PHE 3 HE2 PHE 3 7.031 -11.744 -11.666 40 HE2 PHE 3 HE1 PHE 3 6.027 -7.655 -12.332 41 HZ PHE 3 HZ PHE 3 5.339 -10.008 -12.096 42 H ALA 4 H ALA 4 12.699 -10.008 -9.526 43 HA ALA 4 HA ALA 4 14.958 -8.260 -10.223 44 HB1 ALA 4 1HB ALA 4 16.099 -9.182 -8.133 45 HB2 ALA 4 2HB ALA 4 14.853 -7.954 -7.903 46 HB3 ALA 4 3HB ALA 4 14.482 -9.652 -7.606 47 H VAL 5 H VAL 5 16.999 -9.418 -10.493 48 HA VAL 5 HA VAL 5 16.611 -12.251 -11.206 49 HB VAL 5 HB VAL 5 16.735 -10.980 -13.259 50 HG11 VAL 5 1HG1 VAL 5 19.435 -9.968 -12.397 51 HG12 VAL 5 2HG1 VAL 5 18.499 -9.498 -13.817 52 HG13 VAL 5 3HG1 VAL 5 17.950 -9.037 -12.205 53 HG21 VAL 5 3HG2 VAL 5 17.932 -12.621 -14.161 54 HG22 VAL 5 1HG2 VAL 5 19.425 -11.936 -13.519 55 HG23 VAL 5 2HG2 VAL 5 18.481 -13.062 -12.544 56 H THR 6 H THR 6 17.977 -13.618 -10.266 57 HA THR 6 HA THR 6 19.931 -12.739 -8.417 58 HB THR 6 HB THR 6 20.604 -15.354 -8.861 59 HG1 THR 6 HG1 THR 6 18.873 -15.439 -10.459 60 HG21 THR 6 3HG2 THR 6 18.347 -15.396 -7.163 61 HG22 THR 6 1HG2 THR 6 19.121 -13.827 -6.947 62 HG23 THR 6 2HG2 THR 6 20.048 -15.308 -6.704 63 H LEU 7 H LEU 7 21.999 -12.217 -8.698 64 HA LEU 7 HA LEU 7 23.219 -12.718 -11.319 65 HB2 LEU 7 2HB LEU 7 24.046 -10.819 -9.128 66 HB3 LEU 7 3HB LEU 7 24.812 -10.965 -10.709 67 HG LEU 7 HG LEU 7 21.958 -10.087 -10.282 68 HD11 LEU 7 1HD1 LEU 7 24.504 -8.611 -10.179 69 HD12 LEU 7 2HD1 LEU 7 22.937 -8.231 -9.465 70 HD13 LEU 7 3HD1 LEU 7 23.235 -7.890 -11.170 71 HD21 LEU 7 3HD2 LEU 7 23.712 -9.782 -12.709 72 HD22 LEU 7 1HD2 LEU 7 21.979 -9.483 -12.575 73 HD23 LEU 7 2HD2 LEU 7 22.599 -11.131 -12.482 74 H TYR 8 H TYR 8 23.347 -13.689 -8.055 75 HA TYR 8 HA TYR 8 25.808 -15.199 -8.604 76 HB2 TYR 8 2HB TYR 8 25.168 -13.937 -5.933 77 HB3 TYR 8 3HB TYR 8 26.637 -14.800 -6.375 78 HD1 TYR 8 HD1 TYR 8 24.702 -11.703 -6.950 79 HD2 TYR 8 HD2 TYR 8 28.424 -13.695 -7.482 80 HE1 TYR 8 HE1 TYR 8 25.732 -9.580 -7.644 81 HE2 TYR 8 HE2 TYR 8 29.465 -11.578 -8.177 82 HH TYR 8 HH TYR 8 28.744 -9.405 -9.147 83 H GLU 9 H GLU 9 26.059 -17.117 -7.227 84 HA GLU 9 HA GLU 9 23.507 -18.456 -6.911 85 HB2 GLU 9 2HB GLU 9 25.247 -19.688 -8.030 86 HB3 GLU 9 3HB GLU 9 26.357 -19.430 -6.691 87 HG2 GLU 9 2HG GLU 9 25.669 -21.293 -5.730 88 HG3 GLU 9 3HG GLU 9 24.015 -20.684 -5.683 89 H PHE 10 H PHE 10 22.462 -17.995 -5.073 90 HA PHE 10 HA PHE 10 23.898 -17.576 -2.594 91 HB2 PHE 10 2HB PHE 10 21.800 -16.304 -3.364 92 HB3 PHE 10 3HB PHE 10 20.905 -17.744 -2.888 93 HD1 PHE 10 HD1 PHE 10 23.671 -15.715 -1.408 94 HD2 PHE 10 HD2 PHE 10 19.856 -17.524 -0.870 95 HE1 PHE 10 HE1 PHE 10 23.620 -14.907 0.916 96 HE2 PHE 10 HE2 PHE 10 19.798 -16.718 1.454 97 HZ PHE 10 HZ PHE 10 21.681 -15.407 2.350 98 H LYS 11 H LYS 11 24.306 -19.080 -1.117 99 HA LYS 11 HA LYS 11 23.038 -21.710 -1.416 100 HB2 LYS 11 2HB LYS 11 25.582 -20.837 -0.044 101 HB3 LYS 11 3HB LYS 11 24.920 -22.460 0.100 102 HG2 LYS 11 2HG LYS 11 25.594 -23.060 -1.957 103 HG3 LYS 11 3HG LYS 11 25.244 -21.475 -2.651 104 HD2 LYS 11 2HD LYS 11 27.324 -20.674 -2.213 105 HD3 LYS 11 3HD LYS 11 27.498 -21.628 -0.737 106 HE2 LYS 11 2HE LYS 11 27.657 -22.719 -3.545 107 HE3 LYS 11 3HE LYS 11 29.043 -22.338 -2.525 108 HZ1 LYS 11 3HZ LYS 11 27.786 -23.938 -0.887 109 HZ2 LYS 11 1HZ LYS 11 28.815 -24.543 -2.086 110 HZ3 LYS 11 2HZ LYS 11 27.141 -24.552 -2.325 111 H ALA 12 H ALA 12 21.171 -21.651 -0.275 112 HA ALA 12 HA ALA 12 20.614 -20.241 2.036 113 HB1 ALA 12 1HB ALA 12 18.760 -21.159 0.999 114 HB2 ALA 12 2HB ALA 12 19.492 -22.759 0.875 115 HB3 ALA 12 3HB ALA 12 18.927 -22.166 2.437 116 H GLU 13 H GLU 13 20.568 -20.781 4.244 117 HA GLU 13 HA GLU 13 22.344 -23.004 5.010 118 HB2 GLU 13 2HB GLU 13 22.954 -21.532 6.998 119 HB3 GLU 13 3HB GLU 13 23.608 -21.060 5.436 120 HG2 GLU 13 2HG GLU 13 21.824 -19.389 5.211 121 HG3 GLU 13 3HG GLU 13 21.220 -19.842 6.804 122 H ARG 14 H ARG 14 19.553 -21.032 5.835 123 HA ARG 14 HA ARG 14 18.790 -23.042 7.851 124 HB2 ARG 14 2HB ARG 14 18.289 -20.084 7.691 125 HB3 ARG 14 3HB ARG 14 17.244 -21.123 8.650 126 HG2 ARG 14 2HG ARG 14 20.178 -21.316 9.066 127 HG3 ARG 14 3HG ARG 14 19.328 -19.906 9.699 128 HD2 ARG 14 2HD ARG 14 17.688 -21.615 10.706 129 HD3 ARG 14 3HD ARG 14 18.954 -22.800 10.389 130 HE ARG 14 HE ARG 14 20.079 -20.641 11.771 131 HH11 ARG 14 1HH1 ARG 14 17.822 -23.242 12.282 132 HH12 ARG 14 2HH1 ARG 14 18.145 -23.363 13.980 133 HH21 ARG 14 1HH2 ARG 14 20.513 -20.790 14.006 134 HH22 ARG 14 2HH2 ARG 14 19.675 -21.966 14.959 135 H ASP 15 H ASP 15 16.214 -22.761 8.180 136 HA ASP 15 HA ASP 15 15.069 -23.868 5.833 137 HB2 ASP 15 2HB ASP 15 12.905 -23.651 7.165 138 HB3 ASP 15 3HB ASP 15 14.181 -24.622 7.894 139 H ASP 16 H ASP 16 15.010 -20.675 7.293 140 HA ASP 16 HA ASP 16 12.956 -19.597 5.663 141 HB2 ASP 16 2HB ASP 16 13.833 -17.395 6.416 142 HB3 ASP 16 3HB ASP 16 13.551 -18.515 7.746 143 H GLU 17 H GLU 17 16.478 -19.690 5.380 144 HA GLU 17 HA GLU 17 16.730 -18.013 3.147 145 HB2 GLU 17 2HB GLU 17 18.461 -20.356 3.954 146 HB3 GLU 17 3HB GLU 17 18.913 -19.103 2.807 147 HG2 GLU 17 2HG GLU 17 18.317 -18.679 5.726 148 HG3 GLU 17 3HG GLU 17 19.920 -18.738 4.995 149 H LEU 18 H LEU 18 17.487 -18.776 0.960 150 HA LEU 18 HA LEU 18 16.238 -21.273 0.094 151 HB2 LEU 18 2HB LEU 18 14.737 -19.141 -0.143 152 HB3 LEU 18 3HB LEU 18 15.768 -18.817 -1.536 153 HG LEU 18 HG LEU 18 15.101 -21.029 -2.465 154 HD11 LEU 18 1HD1 LEU 18 14.245 -21.583 0.064 155 HD12 LEU 18 2HD1 LEU 18 13.790 -22.482 -1.382 156 HD13 LEU 18 3HD1 LEU 18 12.731 -21.215 -0.763 157 HD21 LEU 18 3HD2 LEU 18 12.478 -20.003 -2.335 158 HD22 LEU 18 1HD2 LEU 18 13.677 -19.773 -3.608 159 HD23 LEU 18 2HD2 LEU 18 13.576 -18.623 -2.274 160 H ASP 19 H ASP 19 17.064 -22.112 -1.851 161 HA ASP 19 HA ASP 19 19.722 -21.095 -2.513 162 HB2 ASP 19 2HB ASP 19 20.176 -23.239 -3.449 163 HB3 ASP 19 3HB ASP 19 19.319 -23.525 -1.937 164 H VAL 20 H VAL 20 20.215 -20.149 -4.395 165 HA VAL 20 HA VAL 20 18.488 -20.484 -6.714 166 HB VAL 20 HB VAL 20 17.518 -18.558 -5.513 167 HG11 VAL 20 1HG1 VAL 20 18.745 -16.508 -5.227 168 HG12 VAL 20 2HG1 VAL 20 19.631 -17.816 -4.442 169 HG13 VAL 20 3HG1 VAL 20 20.166 -17.203 -6.007 170 HG21 VAL 20 3HG2 VAL 20 17.874 -18.800 -8.130 171 HG22 VAL 20 1HG2 VAL 20 17.125 -17.370 -7.419 172 HG23 VAL 20 2HG2 VAL 20 18.826 -17.336 -7.884 173 H SER 21 H SER 21 19.476 -19.938 -8.683 174 HA SER 21 HA SER 21 22.392 -19.577 -8.495 175 HB2 SER 21 2HB SER 21 20.658 -21.220 -10.273 176 HB3 SER 21 3HB SER 21 22.126 -20.538 -10.974 177 HG SER 21 HG SER 21 21.826 -22.569 -9.159 178 HA PRO 22 HA PRO 22 22.262 -15.837 -10.782 179 HB2 PRO 22 2HB PRO 22 24.430 -16.064 -12.400 180 HB3 PRO 22 3HB PRO 22 24.555 -15.792 -10.657 181 HG2 PRO 22 2HG PRO 22 24.821 -18.343 -12.200 182 HG3 PRO 22 3HG PRO 22 25.806 -17.742 -10.854 183 HD2 PRO 22 2HD PRO 22 23.865 -19.600 -10.521 184 HD3 PRO 22 3HD PRO 22 24.274 -18.412 -9.268 185 H GLY 23 H GLY 23 20.971 -15.200 -12.389 186 HA2 GLY 23 2HA GLY 23 20.580 -15.043 -14.778 187 HA3 GLY 23 3HA GLY 23 20.989 -16.748 -14.900 188 H GLU 24 H GLU 24 19.248 -16.672 -12.194 189 HA GLU 24 HA GLU 24 16.818 -17.468 -13.596 190 HB2 GLU 24 2HB GLU 24 17.836 -17.843 -10.793 191 HB3 GLU 24 3HB GLU 24 16.146 -18.128 -11.183 192 HG2 GLU 24 2HG GLU 24 18.442 -19.481 -12.576 193 HG3 GLU 24 3HG GLU 24 17.578 -20.162 -11.199 194 H ASN 25 H ASN 25 14.725 -16.720 -12.929 195 HA ASN 25 HA ASN 25 14.779 -13.901 -12.156 196 HB2 ASN 25 2HB ASN 25 12.599 -15.602 -13.385 197 HB3 ASN 25 3HB ASN 25 12.414 -13.900 -12.968 198 HD21 ASN 25 1HD2 ASN 25 12.740 -12.527 -14.550 199 HD22 ASN 25 2HD2 ASN 25 13.704 -12.800 -15.957 200 H LEU 26 H LEU 26 13.760 -13.095 -10.379 201 HA LEU 26 HA LEU 26 12.326 -14.991 -8.648 202 HB2 LEU 26 2HB LEU 26 14.525 -13.090 -7.884 203 HB3 LEU 26 3HB LEU 26 13.400 -13.760 -6.705 204 HG LEU 26 HG LEU 26 15.396 -15.040 -6.591 205 HD11 LEU 26 1HD1 LEU 26 13.254 -16.285 -6.529 206 HD12 LEU 26 2HD1 LEU 26 14.613 -17.253 -7.099 207 HD13 LEU 26 3HD1 LEU 26 13.439 -16.619 -8.251 208 HD21 LEU 26 3HD2 LEU 26 15.339 -15.987 -9.382 209 HD22 LEU 26 1HD2 LEU 26 16.708 -15.637 -8.326 210 HD23 LEU 26 2HD2 LEU 26 15.864 -14.320 -9.142 211 H SER 27 H SER 27 10.597 -14.174 -7.527 212 HA SER 27 HA SER 27 9.748 -11.480 -8.314 213 HB2 SER 27 2HB SER 27 8.397 -13.958 -8.177 214 HB3 SER 27 3HB SER 27 7.711 -12.945 -6.906 215 HG SER 27 HG SER 27 8.109 -11.811 -9.429 216 H ILE 28 H ILE 28 10.053 -9.902 -6.902 217 HA ILE 28 HA ILE 28 10.530 -10.478 -4.107 218 HB ILE 28 HB ILE 28 10.399 -7.785 -5.464 219 HG12 ILE 28 2HG1 ILE 28 12.754 -9.621 -4.980 220 HG13 ILE 28 3HG1 ILE 28 12.097 -9.147 -6.543 221 HG21 ILE 28 1HG2 ILE 28 11.656 -8.644 -2.861 222 HG22 ILE 28 2HG2 ILE 28 11.714 -7.024 -3.553 223 HG23 ILE 28 3HG2 ILE 28 10.173 -7.706 -3.034 224 HD11 ILE 28 3HD1 ILE 28 13.403 -7.305 -4.555 225 HD12 ILE 28 1HD1 ILE 28 14.144 -7.942 -6.023 226 HD13 ILE 28 2HD1 ILE 28 12.766 -6.845 -6.134 227 H CYS 29 H CYS 29 9.297 -9.767 -2.374 228 HA CYS 29 HA CYS 29 6.566 -8.890 -3.048 229 HB2 CYS 29 2HB CYS 29 7.345 -10.539 -0.640 230 HB3 CYS 29 3HB CYS 29 5.720 -10.177 -1.208 231 HG CYS 29 HG CYS 29 7.873 -12.539 -2.241 232 H ALA 30 H ALA 30 9.359 -8.446 -1.036 233 HA ALA 30 HA ALA 30 8.586 -5.810 -0.321 234 HB1 ALA 30 1HB ALA 30 7.360 -6.238 1.487 235 HB2 ALA 30 2HB ALA 30 7.807 -7.944 1.479 236 HB3 ALA 30 3HB ALA 30 8.854 -6.762 2.264 237 H HIS 31 H HIS 31 10.136 -5.036 1.578 238 HA HIS 31 HA HIS 31 12.779 -6.261 1.164 239 HB2 HIS 31 2HB HIS 31 13.815 -4.141 0.872 240 HB3 HIS 31 3HB HIS 31 12.417 -4.153 -0.199 241 HD1 HIS 31 HD1 HIS 31 14.061 -1.852 1.753 242 HD2 HIS 31 HD2 HIS 31 10.078 -3.026 1.607 243 HE1 HIS 31 HE1 HIS 31 12.761 0.055 2.752 244 H TYR 32 H TYR 32 14.392 -5.148 2.798 245 HA TYR 32 HA TYR 32 13.084 -4.760 5.393 246 HB2 TYR 32 2HB TYR 32 13.763 -7.165 5.128 247 HB3 TYR 32 3HB TYR 32 15.433 -6.622 5.005 248 HD1 TYR 32 HD1 TYR 32 12.538 -6.951 7.254 249 HD2 TYR 32 HD2 TYR 32 16.653 -5.912 6.948 250 HE1 TYR 32 HE1 TYR 32 12.728 -7.004 9.706 251 HE2 TYR 32 HE2 TYR 32 16.854 -5.964 9.399 252 HH TYR 32 HH TYR 32 15.771 -6.869 11.316 253 H ASP 33 H ASP 33 13.654 -2.660 5.634 254 HA ASP 33 HA ASP 33 14.943 -0.812 5.965 255 HB2 ASP 33 2HB ASP 33 15.759 -2.315 7.806 256 HB3 ASP 33 3HB ASP 33 17.086 -2.794 6.751 257 H TYR 34 H TYR 34 15.042 -2.205 3.336 258 HA TYR 34 HA TYR 34 16.062 -1.931 1.322 259 HB2 TYR 34 2HB TYR 34 17.768 0.171 2.660 260 HB3 TYR 34 3HB TYR 34 17.386 0.032 0.948 261 HD1 TYR 34 HD2 TYR 34 16.112 1.021 4.243 262 HD2 TYR 34 HD1 TYR 34 15.257 0.782 0.082 263 HE1 TYR 34 HE2 TYR 34 14.179 2.508 4.561 264 HE2 TYR 34 HE1 TYR 34 13.322 2.269 0.388 265 HH TYR 34 HH TYR 34 12.691 3.856 3.446 266 H GLU 35 H GLU 35 17.188 -3.678 3.498 267 HA GLU 35 HA GLU 35 19.950 -3.889 2.498 268 HB2 GLU 35 2HB GLU 35 18.939 -5.196 5.011 269 HB3 GLU 35 3HB GLU 35 20.599 -4.849 4.549 270 HG2 GLU 35 2HG GLU 35 18.499 -2.856 5.365 271 HG3 GLU 35 3HG GLU 35 19.915 -3.348 6.292 272 H TRP 36 H TRP 36 17.239 -5.904 3.633 273 HA TRP 36 HA TRP 36 18.201 -8.048 1.860 274 HB2 TRP 36 2HB TRP 36 16.401 -8.208 4.288 275 HB3 TRP 36 3HB TRP 36 16.856 -9.575 3.276 276 HD1 TRP 36 HD1 TRP 36 18.356 -7.116 5.820 277 HE1 TRP 36 HE1 TRP 36 20.523 -8.140 6.760 278 HE3 TRP 36 HE3 TRP 36 18.695 -11.219 2.790 279 HZ2 TRP 36 HZ2 TRP 36 22.159 -10.390 6.279 280 HZ3 TRP 36 HZ3 TRP 36 20.591 -12.757 3.094 281 HH2 TRP 36 HH2 TRP 36 22.287 -12.349 4.803 282 H PHE 37 H PHE 37 16.809 -9.039 0.423 283 HA PHE 37 HA PHE 37 14.219 -7.689 0.032 284 HB2 PHE 37 2HB PHE 37 16.410 -8.240 -1.814 285 HB3 PHE 37 3HB PHE 37 14.864 -8.842 -2.405 286 HD1 PHE 37 HD2 PHE 37 12.926 -6.924 -1.601 287 HD2 PHE 37 HD1 PHE 37 16.938 -6.277 -2.868 288 HE1 PHE 37 HE2 PHE 37 12.324 -4.654 -2.336 289 HE2 PHE 37 HE1 PHE 37 16.343 -4.006 -3.605 290 HZ PHE 37 HZ PHE 37 14.033 -3.192 -3.340 291 H ILE 38 H ILE 38 12.442 -8.915 0.034 292 HA ILE 38 HA ILE 38 12.734 -11.777 0.435 293 HB ILE 38 HB ILE 38 10.150 -10.230 0.378 294 HG12 ILE 38 2HG1 ILE 38 11.612 -9.128 1.977 295 HG13 ILE 38 3HG1 ILE 38 10.382 -10.045 2.840 296 HG21 ILE 38 1HG2 ILE 38 9.354 -12.040 1.809 297 HG22 ILE 38 2HG2 ILE 38 9.968 -12.663 0.278 298 HG23 ILE 38 3HG2 ILE 38 10.943 -12.801 1.741 299 HD11 ILE 38 3HD1 ILE 38 12.599 -10.244 3.859 300 HD12 ILE 38 1HD1 ILE 38 11.975 -11.798 3.308 301 HD13 ILE 38 2HD1 ILE 38 13.209 -10.959 2.367 302 H ALA 39 H ALA 39 13.229 -12.671 -1.534 303 HA ALA 39 HA ALA 39 11.288 -12.258 -3.710 304 HB1 ALA 39 1HB ALA 39 13.838 -13.625 -4.295 305 HB2 ALA 39 2HB ALA 39 12.949 -12.425 -5.234 306 HB3 ALA 39 3HB ALA 39 13.945 -11.917 -3.870 307 H LYS 40 H LYS 40 10.702 -14.127 -4.996 308 HA LYS 40 HA LYS 40 10.982 -16.693 -3.590 309 HB2 LYS 40 2HB LYS 40 8.553 -17.113 -4.376 310 HB3 LYS 40 3HB LYS 40 8.816 -16.119 -2.949 311 HG2 LYS 40 2HG LYS 40 8.379 -14.125 -4.143 312 HG3 LYS 40 3HG LYS 40 8.440 -14.962 -5.697 313 HD2 LYS 40 2HD LYS 40 6.472 -16.352 -4.766 314 HD3 LYS 40 3HD LYS 40 6.313 -15.049 -3.585 315 HE2 LYS 40 2HE LYS 40 4.851 -14.469 -5.326 316 HE3 LYS 40 3HE LYS 40 6.279 -13.467 -5.582 317 HZ1 LYS 40 3HZ LYS 40 7.023 -15.290 -7.156 318 HZ2 LYS 40 1HZ LYS 40 5.740 -14.317 -7.674 319 HZ3 LYS 40 2HZ LYS 40 5.437 -15.872 -7.083 320 HA PRO 41 HA PRO 41 11.895 -18.462 -7.500 321 HB2 PRO 41 2HB PRO 41 10.756 -20.917 -7.287 322 HB3 PRO 41 3HB PRO 41 12.218 -20.457 -6.406 323 HG2 PRO 41 2HG PRO 41 9.381 -20.544 -5.454 324 HG3 PRO 41 3HG PRO 41 10.855 -21.084 -4.629 325 HD2 PRO 41 2HD PRO 41 9.660 -18.719 -4.075 326 HD3 PRO 41 3HD PRO 41 11.417 -18.950 -3.964 327 H ILE 42 H ILE 42 10.956 -17.686 -9.288 328 HA ILE 42 HA ILE 42 8.098 -17.662 -9.631 329 HB ILE 42 HB ILE 42 10.288 -16.926 -11.577 330 HG12 ILE 42 2HG1 ILE 42 8.553 -15.187 -9.810 331 HG13 ILE 42 3HG1 ILE 42 10.257 -15.536 -9.539 332 HG21 ILE 42 1HG2 ILE 42 7.878 -15.572 -12.134 333 HG22 ILE 42 2HG2 ILE 42 8.702 -16.779 -13.120 334 HG23 ILE 42 3HG2 ILE 42 7.482 -17.281 -11.950 335 HD11 ILE 42 3HD1 ILE 42 9.086 -13.477 -11.095 336 HD12 ILE 42 1HD1 ILE 42 10.793 -13.793 -10.782 337 HD13 ILE 42 2HD1 ILE 42 9.998 -14.537 -12.169 338 H ASN 43 H ASN 43 10.833 -19.356 -11.127 339 HA ASN 43 HA ASN 43 9.501 -20.734 -13.118 340 HB2 ASN 43 2HB ASN 43 11.960 -21.253 -11.514 341 HB3 ASN 43 3HB ASN 43 11.321 -22.574 -12.488 342 HD21 ASN 43 1HD2 ASN 43 13.117 -22.547 -13.835 343 HD22 ASN 43 2HD2 ASN 43 13.364 -21.305 -15.010 344 H ARG 43 H ARG 43 10.348 -22.113 -9.935 345 HA ARG 43 HA ARG 43 8.083 -23.961 -10.225 346 HB2 ARG 43 2HB ARG 43 9.216 -25.254 -8.410 347 HB3 ARG 43 3HB ARG 43 10.164 -25.107 -9.884 348 HG2 ARG 43 2HG ARG 43 11.458 -23.293 -8.849 349 HG3 ARG 43 3HG ARG 43 10.530 -23.502 -7.363 350 HD2 ARG 43 2HD ARG 43 11.816 -25.201 -6.724 351 HD3 ARG 43 3HD ARG 43 11.585 -26.024 -8.266 352 HE ARG 43 HE ARG 43 13.848 -24.443 -7.465 353 HH11 ARG 43 1HH1 ARG 43 12.023 -25.675 -10.161 354 HH12 ARG 43 2HH1 ARG 43 13.351 -25.584 -11.270 355 HH21 ARG 43 1HH2 ARG 43 15.605 -24.318 -8.915 356 HH22 ARG 43 2HH2 ARG 43 15.388 -24.813 -10.560 357 H LEU 44 H LEU 44 7.065 -24.594 -8.062 358 HA LEU 44 HA LEU 44 5.995 -22.222 -6.877 359 HB2 LEU 44 2HB LEU 44 5.605 -25.156 -6.376 360 HB3 LEU 44 3HB LEU 44 4.835 -23.930 -5.371 361 HG LEU 44 HG LEU 44 4.422 -24.267 -8.342 362 HD11 LEU 44 1HD1 LEU 44 2.175 -25.034 -7.693 363 HD12 LEU 44 2HD1 LEU 44 2.669 -25.000 -6.001 364 HD13 LEU 44 3HD1 LEU 44 3.448 -26.114 -7.124 365 HD21 LEU 44 3HD2 LEU 44 4.106 -21.984 -7.795 366 HD22 LEU 44 1HD2 LEU 44 3.244 -22.386 -6.309 367 HD23 LEU 44 2HD2 LEU 44 2.498 -22.705 -7.875 368 H GLY 45 H GLY 45 7.321 -25.062 -5.182 369 HA2 GLY 45 2HA GLY 45 8.522 -25.216 -3.229 370 HA3 GLY 45 3HA GLY 45 9.426 -23.847 -3.861 371 H GLY 46 H GLY 46 9.380 -22.023 -2.720 372 HA2 GLY 46 2HA GLY 46 7.076 -21.033 -1.397 373 HA3 GLY 46 3HA GLY 46 8.143 -21.812 -0.237 374 HA PRO 47 HA PRO 47 9.400 -17.326 -1.200 375 HB2 PRO 47 2HB PRO 47 8.557 -16.185 1.115 376 HB3 PRO 47 3HB PRO 47 7.541 -16.296 -0.327 377 HG2 PRO 47 2HG PRO 47 7.564 -18.031 2.113 378 HG3 PRO 47 3HG PRO 47 6.179 -17.383 1.214 379 HD2 PRO 47 2HD PRO 47 7.046 -19.931 0.916 380 HD3 PRO 47 3HD PRO 47 6.314 -19.010 -0.414 381 H GLY 48 H GLY 48 11.381 -16.643 -0.575 382 HA2 GLY 48 2HA GLY 48 12.481 -17.758 1.930 383 HA3 GLY 48 3HA GLY 48 13.409 -17.756 0.437 384 H LEU 49 H LEU 49 15.074 -16.478 1.157 385 HA LEU 49 HA LEU 49 14.465 -13.639 1.345 386 HB2 LEU 49 2HB LEU 49 14.744 -15.005 3.662 387 HB3 LEU 49 3HB LEU 49 16.419 -14.556 3.349 388 HG LEU 49 HG LEU 49 14.447 -12.372 3.135 389 HD11 LEU 49 1HD1 LEU 49 14.432 -12.083 5.612 390 HD12 LEU 49 2HD1 LEU 49 15.077 -13.717 5.755 391 HD13 LEU 49 3HD1 LEU 49 13.489 -13.457 5.033 392 HD21 LEU 49 3HD2 LEU 49 17.145 -12.682 4.448 393 HD22 LEU 49 1HD2 LEU 49 16.233 -11.176 4.340 394 HD23 LEU 49 2HD2 LEU 49 16.818 -11.960 2.872 395 H VAL 50 H VAL 50 15.899 -12.466 0.239 396 HA VAL 50 HA VAL 50 18.621 -13.474 -0.131 397 HB VAL 50 HB VAL 50 17.368 -14.274 -2.085 398 HG11 VAL 50 1HG1 VAL 50 15.638 -12.507 -2.067 399 HG12 VAL 50 2HG1 VAL 50 16.837 -11.364 -2.676 400 HG13 VAL 50 3HG1 VAL 50 16.358 -12.749 -3.658 401 HG21 VAL 50 3HG2 VAL 50 19.296 -12.028 -2.666 402 HG22 VAL 50 1HG2 VAL 50 19.702 -13.720 -2.378 403 HG23 VAL 50 2HG2 VAL 50 18.804 -13.262 -3.826 404 HA PRO 51 HA PRO 51 19.492 -9.213 0.685 405 HB2 PRO 51 2HB PRO 51 22.137 -9.281 0.080 406 HB3 PRO 51 3HB PRO 51 21.475 -9.959 1.573 407 HG2 PRO 51 2HG PRO 51 22.239 -11.351 -0.965 408 HG3 PRO 51 3HG PRO 51 22.544 -11.837 0.713 409 HD2 PRO 51 2HD PRO 51 20.542 -12.898 -0.771 410 HD3 PRO 51 3HD PRO 51 20.417 -12.681 0.987 411 H VAL 52 H VAL 52 19.919 -7.297 -0.430 412 HA VAL 52 HA VAL 52 19.231 -7.236 -3.155 413 HB VAL 52 HB VAL 52 20.697 -5.041 -1.697 414 HG11 VAL 52 1HG1 VAL 52 18.544 -4.278 -3.469 415 HG12 VAL 52 2HG1 VAL 52 20.233 -3.768 -3.465 416 HG13 VAL 52 3HG1 VAL 52 19.758 -5.244 -4.306 417 HG21 VAL 52 3HG2 VAL 52 19.016 -4.981 -0.236 418 HG22 VAL 52 1HG2 VAL 52 17.974 -4.495 -1.574 419 HG23 VAL 52 2HG2 VAL 52 18.107 -6.197 -1.132 420 H SER 53 H SER 53 22.255 -7.673 -1.568 421 HA SER 53 HA SER 53 23.893 -6.834 -3.775 422 HB2 SER 53 2HB SER 53 24.800 -6.697 -1.530 423 HB3 SER 53 3HB SER 53 24.543 -8.424 -1.282 424 HG SER 53 HG SER 53 26.727 -7.456 -2.048 425 H TYR 54 H TYR 54 21.909 -9.422 -3.364 426 HA TYR 54 HA TYR 54 23.543 -11.102 -5.152 427 HB2 TYR 54 2HB TYR 54 21.802 -11.880 -2.829 428 HB3 TYR 54 3HB TYR 54 22.131 -13.021 -4.128 429 HD1 TYR 54 HD1 TYR 54 24.107 -10.608 -2.054 430 HD2 TYR 54 HD2 TYR 54 23.808 -14.528 -3.682 431 HE1 TYR 54 HE1 TYR 54 26.233 -11.212 -0.975 432 HE2 TYR 54 HE2 TYR 54 25.933 -15.143 -2.606 433 HH TYR 54 HH TYR 54 27.322 -13.444 -0.173 434 H VAL 55 H VAL 55 21.322 -9.013 -5.491 435 HA VAL 55 HA VAL 55 19.909 -10.472 -7.555 436 HB VAL 55 HB VAL 55 17.678 -9.542 -6.726 437 HG11 VAL 55 1HG1 VAL 55 17.232 -11.498 -5.388 438 HG12 VAL 55 2HG1 VAL 55 18.315 -11.934 -6.711 439 HG13 VAL 55 3HG1 VAL 55 18.954 -11.723 -5.080 440 HG21 VAL 55 3HG2 VAL 55 17.518 -8.512 -4.753 441 HG22 VAL 55 1HG2 VAL 55 18.481 -9.749 -3.946 442 HG23 VAL 55 2HG2 VAL 55 19.278 -8.409 -4.771 443 H ARG 56 H ARG 56 18.965 -9.131 -9.123 444 HA ARG 56 HA ARG 56 19.713 -6.289 -8.901 445 HB2 ARG 56 2HB ARG 56 21.075 -7.238 -10.590 446 HB3 ARG 56 3HB ARG 56 19.734 -8.153 -11.265 447 HG2 ARG 56 2HG ARG 56 18.699 -6.080 -12.033 448 HG3 ARG 56 3HG ARG 56 20.041 -5.159 -11.350 449 HD2 ARG 56 2HD ARG 56 20.693 -7.356 -13.235 450 HD3 ARG 56 3HD ARG 56 19.967 -5.896 -13.905 451 HE ARG 56 HE ARG 56 21.955 -4.908 -12.390 452 HH11 ARG 56 1HH1 ARG 56 21.863 -7.426 -14.792 453 HH12 ARG 56 2HH1 ARG 56 23.499 -7.175 -15.306 454 HH21 ARG 56 1HH2 ARG 56 24.109 -4.567 -13.058 455 HH22 ARG 56 2HH2 ARG 56 24.775 -5.549 -14.318 456 H ILE 57 H ILE 57 18.033 -4.972 -8.745 457 HA ILE 57 HA ILE 57 15.360 -5.817 -9.223 458 HB ILE 57 HB ILE 57 16.312 -2.973 -8.895 459 HG12 ILE 57 2HG1 ILE 57 17.178 -4.427 -7.084 460 HG13 ILE 57 3HG1 ILE 57 16.000 -3.257 -6.499 461 HG21 ILE 57 1HG2 ILE 57 13.673 -4.359 -8.697 462 HG22 ILE 57 2HG2 ILE 57 13.980 -2.911 -7.739 463 HG23 ILE 57 3HG2 ILE 57 14.088 -2.843 -9.498 464 HD11 ILE 57 3HD1 ILE 57 15.978 -5.870 -5.874 465 HD12 ILE 57 1HD1 ILE 57 14.543 -4.846 -5.884 466 HD13 ILE 57 2HD1 ILE 57 14.906 -5.870 -7.274 467 H ILE 58 H ILE 58 14.434 -6.025 -11.141 468 HA ILE 58 HA ILE 58 15.001 -4.021 -13.213 469 HB ILE 58 HB ILE 58 14.897 -5.813 -14.939 470 HG12 ILE 58 2HG1 ILE 58 15.454 -7.801 -12.761 471 HG13 ILE 58 3HG1 ILE 58 13.792 -7.422 -13.202 472 HG21 ILE 58 1HG2 ILE 58 17.190 -6.827 -13.593 473 HG22 ILE 58 2HG2 ILE 58 17.108 -5.653 -14.906 474 HG23 ILE 58 3HG2 ILE 58 17.037 -5.108 -13.230 475 HD11 ILE 58 3HD1 ILE 58 15.569 -9.231 -14.434 476 HD12 ILE 58 1HD1 ILE 58 13.913 -8.834 -14.893 477 HD13 ILE 58 2HD1 ILE 58 15.260 -7.926 -15.580 478 H ASP 59 H ASP 59 13.360 -4.277 -15.072 479 HA ASP 59 HA ASP 59 10.703 -4.757 -13.889 480 HB2 ASP 59 2HB ASP 59 11.416 -2.357 -14.544 481 HB3 ASP 59 3HB ASP 59 11.198 -2.902 -16.204 482 H LEU 60 H LEU 60 9.119 -5.757 -15.141 483 HA LEU 60 HA LEU 60 10.088 -7.674 -17.018 484 HB2 LEU 60 2HB LEU 60 7.462 -6.991 -15.812 485 HB3 LEU 60 3HB LEU 60 7.463 -7.936 -17.299 486 HG LEU 60 HG LEU 60 8.823 -8.715 -14.721 487 HD11 LEU 60 1HD1 LEU 60 7.090 -10.322 -14.443 488 HD12 LEU 60 2HD1 LEU 60 6.394 -9.933 -16.015 489 HD13 LEU 60 3HD1 LEU 60 6.321 -8.757 -14.704 490 HD21 LEU 60 3HD2 LEU 60 8.581 -10.085 -17.390 491 HD22 LEU 60 1HD2 LEU 60 9.024 -10.925 -15.904 492 HD23 LEU 60 2HD2 LEU 60 10.055 -9.638 -16.529 493 H MET 61 H MET 61 8.344 -4.633 -17.249 494 HA MET 61 HA MET 61 7.869 -4.914 -20.082 495 HB2 MET 61 2HB MET 61 7.608 -2.389 -18.457 496 HB3 MET 61 3HB MET 61 6.794 -2.795 -19.962 497 HG2 MET 61 2HG MET 61 6.337 -4.094 -17.286 498 HG3 MET 61 3HG MET 61 5.272 -2.940 -18.086 499 HE1 MET 61 3HE MET 61 5.845 -7.268 -18.409 500 HE2 MET 61 1HE MET 61 6.028 -6.087 -17.112 501 HE3 MET 61 2HE MET 61 4.430 -6.719 -17.509 502 H ASP 62 H ASP 62 10.313 -3.592 -18.024 503 HA ASP 62 HA ASP 62 11.945 -2.973 -20.339 504 HB2 ASP 62 2HB ASP 62 10.540 -0.893 -19.523 505 HB3 ASP 62 3HB ASP 62 11.783 -0.813 -18.278 506 HA PRO 63 HA PRO 63 14.184 -4.867 -16.742 507 HB2 PRO 63 2HB PRO 63 15.436 -6.766 -18.224 508 HB3 PRO 63 3HB PRO 63 13.820 -6.989 -17.543 509 HG2 PRO 63 2HG PRO 63 14.614 -6.216 -20.324 510 HG3 PRO 63 3HG PRO 63 13.367 -7.359 -19.794 511 HD2 PRO 63 2HD PRO 63 12.787 -4.839 -20.595 512 HD3 PRO 63 3HD PRO 63 11.843 -5.687 -19.353 513 H ALA 64 H ALA 64 14.953 -3.280 -19.635 514 HA ALA 64 HA ALA 64 17.834 -3.330 -19.163 515 HB1 ALA 64 1HB ALA 64 16.917 -3.583 -21.464 516 HB2 ALA 64 2HB ALA 64 16.331 -1.922 -21.362 517 HB3 ALA 64 3HB ALA 64 18.061 -2.252 -21.289 518 H LYS 65 H LYS 65 15.126 -1.449 -18.380 519 HA LYS 65 HA LYS 65 16.409 1.109 -18.290 520 HB2 LYS 65 2HB LYS 65 13.875 0.548 -18.429 521 HB3 LYS 65 3HB LYS 65 13.977 0.388 -16.680 522 HG2 LYS 65 2HG LYS 65 14.982 2.723 -16.682 523 HG3 LYS 65 3HG LYS 65 14.443 2.831 -18.359 524 HD2 LYS 65 2HD LYS 65 12.613 2.133 -16.069 525 HD3 LYS 65 3HD LYS 65 12.858 3.782 -16.649 526 HE2 LYS 65 2HE LYS 65 12.300 2.631 -18.977 527 HE3 LYS 65 3HE LYS 65 11.450 1.500 -17.925 528 HZ1 LYS 65 3HZ LYS 65 10.019 3.308 -18.685 529 HZ2 LYS 65 1HZ LYS 65 11.041 4.441 -17.954 530 HZ3 LYS 65 2HZ LYS 65 10.195 3.328 -17.002 531 H TYR 66 H TYR 66 15.410 -1.227 -15.792 532 HA TYR 66 HA TYR 66 17.039 0.197 -13.827 533 HB2 TYR 66 2HB TYR 66 15.040 -2.052 -13.553 534 HB3 TYR 66 3HB TYR 66 15.984 -1.418 -12.209 535 HD1 TYR 66 HD2 TYR 66 13.391 -0.566 -14.705 536 HD2 TYR 66 HD1 TYR 66 15.359 0.592 -11.115 537 HE1 TYR 66 HE2 TYR 66 11.690 1.172 -14.340 538 HE2 TYR 66 HE1 TYR 66 13.663 2.333 -10.739 539 HH TYR 66 HH TYR 66 10.749 2.460 -12.457 540 H ALA 67 H ALA 67 18.099 -1.505 -16.070 541 HA ALA 67 HA ALA 67 19.309 -3.753 -14.684 542 HB1 ALA 67 1HB ALA 67 18.634 -3.239 -17.336 543 HB2 ALA 67 2HB ALA 67 20.398 -3.237 -17.306 544 HB3 ALA 67 3HB ALA 67 19.508 -4.639 -16.713 545 H SER 68 H SER 68 20.055 -0.489 -15.454 546 HA SER 68 HA SER 68 22.921 -0.891 -15.050 547 HB2 SER 68 2HB SER 68 21.789 0.669 -16.840 548 HB3 SER 68 3HB SER 68 21.689 1.803 -15.494 549 HG SER 68 HG SER 68 23.711 1.557 -16.999 550 H VAL 69 H VAL 69 20.108 0.124 -13.368 551 HA VAL 69 HA VAL 69 21.051 1.911 -11.492 552 HB VAL 69 HB VAL 69 18.680 1.167 -11.715 553 HG11 VAL 69 1HG1 VAL 69 19.570 -1.339 -11.529 554 HG12 VAL 69 2HG1 VAL 69 19.154 -1.071 -9.835 555 HG13 VAL 69 3HG1 VAL 69 17.926 -0.880 -11.087 556 HG21 VAL 69 3HG2 VAL 69 19.920 2.227 -9.588 557 HG22 VAL 69 1HG2 VAL 69 18.189 1.890 -9.626 558 HG23 VAL 69 2HG2 VAL 69 19.292 0.752 -8.853 559 H ASP 70 H ASP 70 21.910 1.719 -9.403 560 HA ASP 70 HA ASP 70 23.544 -0.684 -9.021 561 HB2 ASP 70 2HB ASP 70 24.196 1.986 -8.865 562 HB3 ASP 70 3HB ASP 70 23.982 1.548 -7.173 563 H THR 71 H THR 71 22.488 -2.188 -7.883 564 HA THR 71 HA THR 71 20.486 -1.626 -5.954 565 HB THR 71 HB THR 71 21.276 -4.166 -5.329 566 HG1 THR 71 HG1 THR 71 22.801 -4.517 -6.824 567 HG21 THR 71 3HG2 THR 71 19.641 -3.963 -7.775 568 HG22 THR 71 1HG2 THR 71 19.090 -2.995 -6.408 569 HG23 THR 71 2HG2 THR 71 19.283 -4.739 -6.232 570 H TYR 72 H TYR 72 23.923 -2.405 -5.727 571 HA TYR 72 HA TYR 72 24.150 -2.824 -2.999 572 HB2 TYR 72 2HB TYR 72 26.005 -3.202 -4.532 573 HB3 TYR 72 3HB TYR 72 26.114 -1.478 -4.865 574 HD1 TYR 72 HD1 TYR 72 25.922 -3.539 -1.746 575 HD2 TYR 72 HD2 TYR 72 27.999 -0.541 -3.937 576 HE1 TYR 72 HE1 TYR 72 27.509 -3.288 0.116 577 HE2 TYR 72 HE2 TYR 72 29.593 -0.282 -2.081 578 HH TYR 72 HH TYR 72 29.403 -0.772 0.588 579 H ASP 73 H ASP 73 24.225 0.231 -4.795 580 HA ASP 73 HA ASP 73 24.753 1.901 -2.588 581 HB2 ASP 73 2HB ASP 73 23.613 2.333 -5.326 582 HB3 ASP 73 3HB ASP 73 23.559 3.641 -4.147 583 H ARG 74 H ARG 74 23.520 1.949 -0.824 584 HA ARG 74 HA ARG 74 20.857 1.188 -0.622 585 HB2 ARG 74 2HB ARG 74 20.891 2.055 1.573 586 HB3 ARG 74 3HB ARG 74 22.544 1.550 1.250 587 HG2 ARG 74 2HG ARG 74 21.583 4.382 0.941 588 HG3 ARG 74 3HG ARG 74 22.308 3.745 2.419 589 HD2 ARG 74 2HD ARG 74 23.580 3.988 -0.300 590 HD3 ARG 74 3HD ARG 74 24.024 4.846 1.175 591 HE ARG 74 HE ARG 74 24.331 2.213 1.809 592 HH11 ARG 74 1HH1 ARG 74 25.561 4.293 -0.698 593 HH12 ARG 74 2HH1 ARG 74 27.053 3.428 -0.864 594 HH21 ARG 74 1HH2 ARG 74 26.291 1.065 1.599 595 HH22 ARG 74 2HH2 ARG 74 27.467 1.591 0.442 596 H GLU 75 H GLU 75 22.240 4.169 -1.701 597 HA GLU 75 HA GLU 75 20.010 5.857 -1.285 598 HB2 GLU 75 2HB GLU 75 22.535 5.974 -2.812 599 HB3 GLU 75 3HB GLU 75 21.233 6.980 -3.431 600 HG2 GLU 75 2HG GLU 75 21.002 7.924 -1.115 601 HG3 GLU 75 3HG GLU 75 22.488 7.070 -0.703 602 H GLN 76 H GLN 76 21.158 4.211 -4.233 603 HA GLN 76 HA GLN 76 19.010 4.930 -5.870 604 HB2 GLN 76 2HB GLN 76 20.632 2.387 -6.044 605 HB3 GLN 76 3HB GLN 76 19.730 3.149 -7.347 606 HG2 GLN 76 2HG GLN 76 21.625 4.983 -6.178 607 HG3 GLN 76 3HG GLN 76 22.412 3.504 -6.729 608 HE21 GLN 76 1HE2 GLN 76 23.124 3.607 -8.722 609 HE22 GLN 76 2HE2 GLN 76 22.432 4.523 -10.012 610 H VAL 77 H VAL 77 19.550 1.831 -4.185 611 HA VAL 77 HA VAL 77 17.150 0.607 -4.803 612 HB VAL 77 HB VAL 77 19.250 -0.216 -3.416 613 HG11 VAL 77 1HG1 VAL 77 17.253 0.279 -1.217 614 HG12 VAL 77 2HG1 VAL 77 18.881 -0.387 -1.071 615 HG13 VAL 77 3HG1 VAL 77 18.655 1.307 -1.509 616 HG21 VAL 77 3HG2 VAL 77 16.510 -1.174 -3.725 617 HG22 VAL 77 1HG2 VAL 77 18.041 -2.019 -3.955 618 HG23 VAL 77 2HG2 VAL 77 17.347 -1.875 -2.340 619 H MET 78 H MET 78 17.830 3.073 -2.419 620 HA MET 78 HA MET 78 15.422 2.822 -0.944 621 HB2 MET 78 2HB MET 78 17.656 4.735 -1.106 622 HB3 MET 78 3HB MET 78 16.123 5.435 -0.606 623 HG2 MET 78 2HG MET 78 15.994 3.591 1.117 624 HG3 MET 78 3HG MET 78 17.673 3.234 0.718 625 HE1 MET 78 3HE MET 78 19.699 5.617 2.628 626 HE2 MET 78 1HE MET 78 19.484 4.047 1.852 627 HE3 MET 78 2HE MET 78 19.608 5.506 0.869 628 H LYS 79 H LYS 79 16.413 5.163 -3.446 629 HA LYS 79 HA LYS 79 14.009 6.541 -3.651 630 HB2 LYS 79 2HB LYS 79 16.033 5.949 -5.819 631 HB3 LYS 79 3HB LYS 79 14.767 7.165 -5.929 632 HG2 LYS 79 2HG LYS 79 15.818 8.593 -4.496 633 HG3 LYS 79 3HG LYS 79 16.635 7.294 -3.624 634 HD2 LYS 79 2HD LYS 79 18.166 6.973 -5.474 635 HD3 LYS 79 3HD LYS 79 17.308 8.185 -6.428 636 HE2 LYS 79 2HE LYS 79 18.448 8.888 -3.752 637 HE3 LYS 79 3HE LYS 79 19.485 8.844 -5.176 638 HZ1 LYS 79 3HZ LYS 79 17.347 10.280 -6.011 639 HZ2 LYS 79 1HZ LYS 79 18.815 10.932 -5.482 640 HZ3 LYS 79 2HZ LYS 79 17.518 10.789 -4.407 641 H ILE 80 H ILE 80 15.052 3.565 -5.241 642 HA ILE 80 HA ILE 80 12.855 3.317 -6.993 643 HB ILE 80 HB ILE 80 14.617 1.162 -5.821 644 HG12 ILE 80 2HG1 ILE 80 14.735 2.619 -8.471 645 HG13 ILE 80 3HG1 ILE 80 15.841 2.851 -7.121 646 HG21 ILE 80 1HG2 ILE 80 12.540 0.212 -6.626 647 HG22 ILE 80 2HG2 ILE 80 12.715 1.068 -8.158 648 HG23 ILE 80 3HG2 ILE 80 13.857 -0.204 -7.723 649 HD11 ILE 80 3HD1 ILE 80 15.841 0.101 -7.702 650 HD12 ILE 80 1HD1 ILE 80 15.959 0.953 -9.241 651 HD13 ILE 80 2HD1 ILE 80 17.132 1.273 -7.963 652 H ILE 81 H ILE 81 13.499 1.721 -3.869 653 HA ILE 81 HA ILE 81 11.044 0.394 -3.667 654 HB ILE 81 HB ILE 81 12.896 1.366 -1.492 655 HG12 ILE 81 2HG1 ILE 81 12.481 -1.412 -2.611 656 HG13 ILE 81 3HG1 ILE 81 13.766 -0.327 -3.129 657 HG21 ILE 81 1HG2 ILE 81 10.265 0.092 -1.355 658 HG22 ILE 81 2HG2 ILE 81 11.516 -0.725 -0.418 659 HG23 ILE 81 3HG2 ILE 81 11.164 0.978 -0.123 660 HD11 ILE 81 3HD1 ILE 81 13.695 -0.641 -0.251 661 HD12 ILE 81 1HD1 ILE 81 13.899 -2.177 -1.095 662 HD13 ILE 81 2HD1 ILE 81 15.030 -0.854 -1.384 663 H ASP 82 H ASP 82 11.946 3.686 -2.961 664 HA ASP 82 HA ASP 82 9.668 4.338 -1.384 665 HB2 ASP 82 2HB ASP 82 11.865 5.612 -1.480 666 HB3 ASP 82 3HB ASP 82 11.311 6.273 -3.016 667 H GLU 83 H GLU 83 10.502 5.010 -4.783 668 HA GLU 83 HA GLU 83 7.998 6.163 -5.426 669 HB2 GLU 83 2HB GLU 83 10.272 5.066 -7.050 670 HB3 GLU 83 3HB GLU 83 8.778 5.563 -7.831 671 HG2 GLU 83 2HG GLU 83 10.753 7.230 -7.622 672 HG3 GLU 83 3HG GLU 83 9.101 7.782 -7.355 673 H PHE 84 H PHE 84 9.201 2.885 -5.410 674 HA PHE 84 HA PHE 84 6.956 1.825 -6.878 675 HB2 PHE 84 2HB PHE 84 9.393 0.691 -5.582 676 HB3 PHE 84 3HB PHE 84 8.033 -0.386 -5.880 677 HD1 PHE 84 HD2 PHE 84 9.451 2.424 -7.875 678 HD2 PHE 84 HD1 PHE 84 8.568 -1.734 -7.665 679 HE1 PHE 84 HE2 PHE 84 10.181 2.155 -10.208 680 HE2 PHE 84 HE1 PHE 84 9.298 -2.011 -9.998 681 HZ PHE 84 HZ PHE 84 10.105 -0.065 -11.274 682 H LYS 85 H LYS 85 7.367 2.927 -3.778 683 HA LYS 85 HA LYS 85 6.260 2.660 -1.802 684 HB2 LYS 85 2HB LYS 85 4.146 1.996 -3.839 685 HB3 LYS 85 3HB LYS 85 3.787 2.022 -2.118 686 HG2 LYS 85 2HG LYS 85 3.175 4.139 -2.784 687 HG3 LYS 85 3HG LYS 85 4.817 4.397 -2.190 688 HD2 LYS 85 2HD LYS 85 5.660 4.773 -4.278 689 HD3 LYS 85 3HD LYS 85 4.481 3.719 -5.062 690 HE2 LYS 85 2HE LYS 85 3.877 6.435 -3.898 691 HE3 LYS 85 3HE LYS 85 4.160 6.109 -5.607 692 HZ1 LYS 85 3HZ LYS 85 1.834 5.499 -3.960 693 HZ2 LYS 85 1HZ LYS 85 2.251 4.355 -5.134 694 HZ3 LYS 85 2HZ LYS 85 1.919 5.950 -5.588 695 H ILE 86 H ILE 86 7.896 0.504 -2.384 696 HA ILE 86 HA ILE 86 6.446 -1.957 -1.991 697 HB ILE 86 HB ILE 86 9.409 -1.691 -1.616 698 HG12 ILE 86 2HG1 ILE 86 7.939 -1.785 -4.260 699 HG13 ILE 86 3HG1 ILE 86 8.902 -0.441 -3.655 700 HG21 ILE 86 1HG2 ILE 86 7.550 -3.821 -1.758 701 HG22 ILE 86 2HG2 ILE 86 8.581 -3.915 -3.184 702 HG23 ILE 86 3HG2 ILE 86 9.301 -3.906 -1.574 703 HD11 ILE 86 3HD1 ILE 86 10.688 -1.306 -4.616 704 HD12 ILE 86 1HD1 ILE 86 10.533 -2.749 -3.614 705 HD13 ILE 86 2HD1 ILE 86 9.732 -2.674 -5.184 706 HA PRO 87 HA PRO 87 6.307 -1.432 2.438 707 HB2 PRO 87 2HB PRO 87 5.039 -3.779 2.942 708 HB3 PRO 87 3HB PRO 87 4.202 -2.348 2.328 709 HG2 PRO 87 2HG PRO 87 5.185 -4.752 0.839 710 HG3 PRO 87 3HG PRO 87 3.648 -3.883 0.672 711 HD2 PRO 87 2HD PRO 87 5.718 -3.524 -1.037 712 HD3 PRO 87 3HD PRO 87 4.583 -2.222 -0.624 713 H THR 88 H THR 88 7.265 -2.407 4.268 714 HA THR 88 HA THR 88 9.638 -3.926 3.672 715 HB THR 88 HB THR 88 8.968 -3.602 6.508 716 HG1 THR 88 HG1 THR 88 8.636 -1.500 6.512 717 HG21 THR 88 3HG2 THR 88 11.276 -3.138 4.678 718 HG22 THR 88 1HG2 THR 88 11.191 -4.083 6.164 719 HG23 THR 88 2HG2 THR 88 11.256 -2.322 6.241 720 H VAL 89 H VAL 89 10.177 -5.702 5.423 721 HA VAL 89 HA VAL 89 8.605 -7.934 4.859 722 HB VAL 89 HB VAL 89 10.491 -7.538 7.187 723 HG11 VAL 89 1HG1 VAL 89 9.205 -9.992 6.022 724 HG12 VAL 89 2HG1 VAL 89 10.678 -10.065 6.991 725 HG13 VAL 89 3HG1 VAL 89 9.189 -9.434 7.694 726 HG21 VAL 89 3HG2 VAL 89 12.056 -8.823 5.667 727 HG22 VAL 89 1HG2 VAL 89 10.908 -8.500 4.368 728 HG23 VAL 89 2HG2 VAL 89 11.705 -7.161 5.193 729 H GLU 90 H GLU 90 8.808 -6.077 7.897 730 HA GLU 90 HA GLU 90 6.942 -7.461 9.382 731 HB2 GLU 90 2HB GLU 90 7.738 -4.564 9.352 732 HB3 GLU 90 3HB GLU 90 6.497 -5.146 10.454 733 HG2 GLU 90 2HG GLU 90 8.015 -6.570 11.566 734 HG3 GLU 90 3HG GLU 90 9.240 -6.358 10.316 735 H GLN 91 H GLN 91 6.363 -4.700 7.215 736 HA GLN 91 HA GLN 91 3.603 -4.510 7.594 737 HB2 GLN 91 2HB GLN 91 5.076 -3.921 5.025 738 HB3 GLN 91 3HB GLN 91 3.549 -3.228 5.556 739 HG2 GLN 91 2HG GLN 91 6.301 -2.718 6.629 740 HG3 GLN 91 3HG GLN 91 5.164 -1.571 5.923 741 HE21 GLN 91 1HE2 GLN 91 6.576 -2.142 8.664 742 HE22 GLN 91 2HE2 GLN 91 5.318 -1.803 9.799 743 H TRP 92 H TRP 92 5.486 -6.466 5.332 744 HA TRP 92 HA TRP 92 3.302 -7.477 3.860 745 HB2 TRP 92 2HB TRP 92 5.604 -7.608 3.036 746 HB3 TRP 92 3HB TRP 92 6.026 -8.701 4.352 747 HD1 TRP 92 HD1 TRP 92 3.243 -8.744 1.626 748 HE1 TRP 92 HE1 TRP 92 3.178 -11.110 0.614 749 HE3 TRP 92 HE3 TRP 92 6.980 -10.902 4.367 750 HZ2 TRP 92 HZ2 TRP 92 4.530 -13.566 0.936 751 HZ3 TRP 92 HZ3 TRP 92 7.532 -13.264 3.954 752 HH2 TRP 92 HH2 TRP 92 6.331 -14.567 2.274 753 H LYS 93 H LYS 93 4.999 -8.679 6.725 754 HA LYS 93 HA LYS 93 3.668 -11.143 6.934 755 HB2 LYS 93 2HB LYS 93 4.792 -9.443 9.168 756 HB3 LYS 93 3HB LYS 93 4.435 -11.163 9.254 757 HG2 LYS 93 2HG LYS 93 6.306 -10.239 7.145 758 HG3 LYS 93 3HG LYS 93 6.876 -10.258 8.816 759 HD2 LYS 93 2HD LYS 93 7.409 -12.396 8.326 760 HD3 LYS 93 3HD LYS 93 5.704 -12.684 8.681 761 HE2 LYS 93 2HE LYS 93 5.485 -12.033 6.104 762 HE3 LYS 93 3HE LYS 93 7.134 -12.656 6.084 763 HZ1 LYS 93 3HZ LYS 93 4.671 -14.088 6.902 764 HZ2 LYS 93 1HZ LYS 93 6.225 -14.680 7.211 765 HZ3 LYS 93 2HZ LYS 93 5.707 -14.459 5.617 766 H ASP 94 H ASP 94 2.998 -8.024 8.515 767 HA ASP 94 HA ASP 94 0.715 -8.856 9.920 768 HB2 ASP 94 2HB ASP 94 1.788 -6.203 9.041 769 HB3 ASP 94 3HB ASP 94 0.160 -6.293 9.709 770 H GLN 95 H GLN 95 1.097 -7.480 6.686 771 HA GLN 95 HA GLN 95 -1.611 -7.121 6.082 772 HB2 GLN 95 2HB GLN 95 0.799 -7.643 4.354 773 HB3 GLN 95 3HB GLN 95 -0.802 -7.403 3.667 774 HG2 GLN 95 2HG GLN 95 -0.850 -5.188 4.186 775 HG3 GLN 95 3HG GLN 95 0.201 -5.379 5.588 776 HE21 GLN 95 1HE2 GLN 95 1.172 -3.426 4.606 777 HE22 GLN 95 2HE2 GLN 95 2.408 -3.646 3.420 778 H THR 96 H THR 96 0.522 -9.881 5.372 779 HA THR 96 HA THR 96 -1.462 -11.485 4.176 780 HB THR 96 HB THR 96 0.182 -13.386 4.991 781 HG1 THR 96 HG1 THR 96 1.492 -12.304 6.375 782 HG21 THR 96 3HG2 THR 96 -0.159 -12.374 2.666 783 HG22 THR 96 1HG2 THR 96 1.397 -13.135 2.992 784 HG23 THR 96 2HG2 THR 96 1.250 -11.377 3.024 785 H ARG 97 H ARG 97 -0.214 -11.370 7.499 786 HA ARG 97 HA ARG 97 -1.616 -13.492 8.587 787 HB2 ARG 97 2HB ARG 97 -0.531 -10.938 9.683 788 HB3 ARG 97 3HB ARG 97 -1.600 -11.893 10.702 789 HG2 ARG 97 2HG ARG 97 0.692 -13.240 9.364 790 HG3 ARG 97 3HG ARG 97 0.993 -12.228 10.778 791 HD2 ARG 97 2HD ARG 97 0.634 -14.232 11.810 792 HD3 ARG 97 3HD ARG 97 -1.019 -13.620 11.766 793 HE ARG 97 HE ARG 97 -0.446 -15.129 9.438 794 HH11 ARG 97 1HH1 ARG 97 -1.139 -15.464 12.833 795 HH12 ARG 97 2HH1 ARG 97 -1.831 -17.043 12.670 796 HH21 ARG 97 1HH2 ARG 97 -1.356 -17.209 9.210 797 HH22 ARG 97 2HH2 ARG 97 -1.954 -18.035 10.608 798 H ARG 98 H ARG 98 -2.623 -10.074 8.470 799 HA ARG 98 HA ARG 98 -5.193 -10.543 9.561 800 HB2 ARG 98 2HB ARG 98 -4.131 -8.253 7.899 801 HB3 ARG 98 3HB ARG 98 -5.707 -8.258 8.679 802 HG2 ARG 98 2HG ARG 98 -4.377 -8.712 10.845 803 HG3 ARG 98 3HG ARG 98 -2.991 -8.134 9.917 804 HD2 ARG 98 2HD ARG 98 -4.595 -6.147 9.339 805 HD3 ARG 98 3HD ARG 98 -5.436 -6.667 10.799 806 HE ARG 98 HE ARG 98 -2.643 -6.378 11.253 807 HH11 ARG 98 1HH1 ARG 98 -5.606 -4.584 10.904 808 HH12 ARG 98 2HH1 ARG 98 -5.063 -3.247 11.863 809 HH21 ARG 98 1HH2 ARG 98 -1.917 -4.625 12.518 810 HH22 ARG 98 2HH2 ARG 98 -2.964 -3.271 12.780 811 H TYR 99 H TYR 99 -3.926 -10.511 6.289 812 HA TYR 99 HA TYR 99 -6.372 -10.448 4.904 813 HB2 TYR 99 2HB TYR 99 -4.343 -10.014 3.706 814 HB3 TYR 99 3HB TYR 99 -3.674 -11.580 4.151 815 HD1 TYR 99 HD1 TYR 99 -6.263 -9.914 2.096 816 HD2 TYR 99 HD2 TYR 99 -4.127 -13.514 2.859 817 HE1 TYR 99 HE1 TYR 99 -7.161 -10.880 0.020 818 HE2 TYR 99 HE2 TYR 99 -5.018 -14.489 0.784 819 HH TYR 99 HH TYR 99 -6.157 -12.941 -1.635 820 H LYS 100 H LYS 100 -4.485 -13.106 6.245 821 HA LYS 100 HA LYS 100 -6.138 -15.161 5.133 822 HB2 LYS 100 2HB LYS 100 -3.873 -15.039 7.065 823 HB3 LYS 100 3HB LYS 100 -4.901 -16.466 7.098 824 HG2 LYS 100 2HG LYS 100 -4.458 -16.346 4.474 825 HG3 LYS 100 3HG LYS 100 -2.988 -15.548 5.039 826 HD2 LYS 100 2HD LYS 100 -2.275 -17.716 5.079 827 HD3 LYS 100 3HD LYS 100 -2.952 -17.608 6.705 828 HE2 LYS 100 2HE LYS 100 -3.811 -19.607 5.836 829 HE3 LYS 100 3HE LYS 100 -5.128 -18.446 5.667 830 HZ1 LYS 100 3HZ LYS 100 -4.165 -20.016 3.688 831 HZ2 LYS 100 1HZ LYS 100 -3.386 -18.546 3.382 832 HZ3 LYS 100 2HZ LYS 100 -5.075 -18.609 3.458 833 H GLU 101 H GLU 101 -6.219 -13.198 7.984 834 HA GLU 101 HA GLU 101 -8.142 -14.919 9.324 835 HB2 GLU 101 2HB GLU 101 -6.974 -12.240 10.097 836 HB3 GLU 101 3HB GLU 101 -8.090 -13.165 11.091 837 HG2 GLU 101 2HG GLU 101 -5.563 -14.439 10.162 838 HG3 GLU 101 3HG GLU 101 -5.521 -13.296 11.503 839 H SER 102 H SER 102 -10.061 -13.628 10.353 840 HA SER 102 HA SER 102 -12.123 -12.743 9.963 841 HB2 SER 102 2HB SER 102 -10.476 -10.699 9.878 842 HB3 SER 102 3HB SER 102 -10.891 -10.685 8.164 843 HG SER 102 HG SER 102 -12.975 -10.259 8.661 844 H SER 103 H SER 103 -11.422 -14.856 8.267 845 HA SER 103 HA SER 103 -12.116 -14.180 5.555 846 HB2 SER 103 2HB SER 103 -11.928 -16.924 6.815 847 HB3 SER 103 3HB SER 103 -11.881 -16.543 5.094 848 HG SER 103 HG SER 103 -9.867 -15.842 5.281 849 H ILE 104 H ILE 104 -13.781 -16.134 4.707 850 HA ILE 104 HA ILE 104 -16.314 -15.154 5.177 851 HB ILE 104 HB ILE 104 -15.657 -18.001 4.411 852 HG12 ILE 104 2HG1 ILE 104 -14.504 -16.472 2.927 853 HG13 ILE 104 3HG1 ILE 104 -15.880 -17.166 2.076 854 HG21 ILE 104 1HG2 ILE 104 -17.930 -17.998 4.851 855 HG22 ILE 104 2HG2 ILE 104 -18.141 -16.341 4.289 856 HG23 ILE 104 3HG2 ILE 104 -17.879 -17.639 3.125 857 HD11 ILE 104 3HD1 ILE 104 -15.282 -14.402 2.717 858 HD12 ILE 104 1HD1 ILE 104 -16.378 -15.078 1.512 859 HD13 ILE 104 2HD1 ILE 104 -16.917 -14.873 3.179 860 H GLN 105 H GLN 105 -15.317 -18.390 6.289 861 HA GLN 105 HA GLN 105 -17.370 -18.765 8.104 862 HB2 GLN 105 2HB GLN 105 -15.768 -20.376 9.236 863 HB3 GLN 105 3HB GLN 105 -16.053 -20.643 7.522 864 HG2 GLN 105 2HG GLN 105 -13.950 -19.713 6.939 865 HG3 GLN 105 3HG GLN 105 -13.690 -19.120 8.579 866 HE21 GLN 105 1HE2 GLN 105 -11.979 -20.826 7.017 867 HE22 GLN 105 2HE2 GLN 105 -11.810 -22.304 7.895 868 H ILE 106 H ILE 106 -17.215 -18.878 10.496 869 HA ILE 106 HA ILE 106 -15.669 -16.600 11.552 870 HB ILE 106 HB ILE 106 -18.365 -17.582 12.495 871 HG12 ILE 106 2HG1 ILE 106 -18.313 -14.842 11.642 872 HG13 ILE 106 3HG1 ILE 106 -17.671 -15.858 10.356 873 HG21 ILE 106 1HG2 ILE 106 -16.586 -15.350 13.449 874 HG22 ILE 106 2HG2 ILE 106 -18.292 -15.483 13.871 875 HG23 ILE 106 3HG2 ILE 106 -17.161 -16.742 14.365 876 HD11 ILE 106 3HD1 ILE 106 -20.181 -15.374 10.392 877 HD12 ILE 106 1HD1 ILE 106 -19.658 -17.038 10.134 878 HD13 ILE 106 2HD1 ILE 106 -20.246 -16.534 11.719 879 H GLY 107 H GLY 107 -14.372 -16.958 13.253 880 HA2 GLY 107 2HA GLY 107 -14.528 -19.619 14.528 881 HA3 GLY 107 3HA GLY 107 -13.031 -18.735 14.275 882 H ASN 108 H ASN 108 -12.487 -17.036 15.651 883 HA ASN 108 HA ASN 108 -14.151 -16.835 18.076 884 HB2 ASN 108 2HB ASN 108 -12.073 -16.470 19.349 885 HB3 ASN 108 3HB ASN 108 -12.066 -18.030 18.532 886 HD21 ASN 108 1HD2 ASN 108 -10.741 -18.317 16.711 887 HD22 ASN 108 2HD2 ASN 108 -9.389 -17.284 16.412 888 H GLY 109 H GLY 109 -14.707 -14.846 18.773 889 HA2 GLY 109 2HA GLY 109 -14.339 -12.511 19.081 890 HA3 GLY 109 3HA GLY 109 -13.303 -12.518 17.661 891 H HIS 110 H HIS 110 -14.284 -10.953 16.473 892 HA HIS 110 HA HIS 110 -17.045 -10.563 16.215 893 HB2 HIS 110 2HB HIS 110 -14.702 -9.782 14.493 894 HB3 HIS 110 3HB HIS 110 -16.354 -9.371 14.039 895 HD1 HIS 110 HD1 HIS 110 -13.636 -8.470 16.409 896 HD2 HIS 110 HD2 HIS 110 -17.591 -7.429 15.679 897 HE1 HIS 110 HE1 HIS 110 -14.032 -6.367 17.730 898 H GLY 111 H GLY 111 -17.896 -10.550 13.723 899 HA2 GLY 111 2HA GLY 111 -17.390 -13.211 12.579 900 HA3 GLY 111 3HA GLY 111 -19.036 -12.763 13.002 901 H GLN 112 H GLN 112 -20.070 -11.076 11.831 902 HA GLN 112 HA GLN 112 -19.719 -11.155 9.085 903 HB2 GLN 112 2HB GLN 112 -21.094 -9.173 10.881 904 HB3 GLN 112 3HB GLN 112 -21.078 -8.965 9.135 905 HG2 GLN 112 2HG GLN 112 -23.059 -10.063 9.429 906 HG3 GLN 112 3HG GLN 112 -21.970 -11.415 9.123 907 HE21 GLN 112 1HE2 GLN 112 -23.322 -12.848 10.207 908 HE22 GLN 112 2HE2 GLN 112 -23.455 -12.859 11.929 909 H SER 113 H SER 113 -18.257 -10.311 7.766 910 HA SER 113 HA SER 113 -17.029 -7.741 8.402 911 HB2 SER 113 2HB SER 113 -15.443 -10.265 7.875 912 HB3 SER 113 3HB SER 113 -14.756 -8.642 7.903 913 HG SER 113 HG SER 113 -15.197 -10.262 9.950 914 H GLN 114 H GLN 114 -16.050 -6.705 6.588 915 HA GLN 114 HA GLN 114 -17.465 -6.894 4.213 916 HB2 GLN 114 2HB GLN 114 -16.144 -4.923 4.913 917 HB3 GLN 114 3HB GLN 114 -14.665 -5.812 4.575 918 HG2 GLN 114 2HG GLN 114 -15.379 -4.200 2.803 919 HG3 GLN 114 3HG GLN 114 -15.110 -5.854 2.254 920 HE21 GLN 114 1HE2 GLN 114 -17.693 -3.735 3.435 921 HE22 GLN 114 2HE2 GLN 114 -18.918 -4.355 2.386 922 H GLY 115 H GLY 115 -17.396 -8.224 2.521 923 HA2 GLY 115 2HA GLY 115 -15.387 -10.321 2.463 924 HA3 GLY 115 3HA GLY 115 -16.814 -10.212 1.443 925 H LEU 116 H LEU 116 -13.461 -9.672 1.672 926 HA LEU 116 HA LEU 116 -13.469 -8.308 -0.939 927 HB2 LEU 116 2HB LEU 116 -11.021 -7.773 -0.166 928 HB3 LEU 116 3HB LEU 116 -12.383 -6.789 0.367 929 HG LEU 116 HG LEU 116 -12.403 -8.120 2.489 930 HD11 LEU 116 1HD1 LEU 116 -11.306 -10.074 2.333 931 HD12 LEU 116 2HD1 LEU 116 -9.896 -9.099 2.748 932 HD13 LEU 116 3HD1 LEU 116 -10.231 -9.491 1.062 933 HD21 LEU 116 3HD2 LEU 116 -11.447 -5.999 2.666 934 HD22 LEU 116 1HD2 LEU 116 -10.054 -6.441 1.677 935 HD23 LEU 116 2HD2 LEU 116 -10.208 -7.074 3.316 936 H GLU 117 H GLU 117 -12.472 -11.070 0.847 937 HA GLU 117 HA GLU 117 -10.331 -11.931 -0.784 938 HB2 GLU 117 2HB GLU 117 -10.771 -12.812 1.484 939 HB3 GLU 117 3HB GLU 117 -12.224 -13.598 0.882 940 HG2 GLU 117 2HG GLU 117 -9.626 -14.197 -0.434 941 HG3 GLU 117 3HG GLU 117 -9.972 -14.911 1.140 942 H1 GLY -9 H GLY -9 8.378 -10.503 10.320 943 HA2 GLY -9 2HA GLY -9 6.222 -11.037 12.270 944 HA3 GLY -9 3HA GLY -9 6.199 -11.610 10.609 945 H LYS -8 H LYS -8 7.491 -13.369 10.011 946 HA LYS -8 HA LYS -8 8.495 -14.941 12.290 947 HB2 LYS -8 2HB LYS -8 8.070 -16.935 10.874 948 HB3 LYS -8 3HB LYS -8 6.611 -16.022 11.235 949 HG2 LYS -8 2HG LYS -8 6.327 -15.349 9.076 950 HG3 LYS -8 3HG LYS -8 8.054 -15.405 8.715 951 HD2 LYS -8 2HD LYS -8 8.012 -17.622 8.199 952 HD3 LYS -8 3HD LYS -8 6.721 -17.976 9.349 953 HE2 LYS -8 2HE LYS -8 6.383 -16.558 6.707 954 HE3 LYS -8 3HE LYS -8 5.988 -18.247 7.020 955 HZ1 LYS -8 3HZ LYS -8 3.985 -17.062 7.200 956 HZ2 LYS -8 1HZ LYS -8 4.681 -15.836 8.135 957 HZ3 LYS -8 2HZ LYS -8 4.451 -17.376 8.795 958 H PHE -7 H PHE -7 9.251 -13.582 9.197 959 HA PHE -7 HA PHE -7 11.599 -15.119 8.693 960 HB2 PHE -7 2HB PHE -7 10.503 -12.547 7.583 961 HB3 PHE -7 3HB PHE -7 12.101 -13.126 7.123 962 HD1 PHE -7 HD2 PHE -7 8.497 -13.816 6.976 963 HD2 PHE -7 HD1 PHE -7 12.371 -14.990 5.659 964 HE1 PHE -7 HE2 PHE -7 7.474 -15.261 5.267 965 HE2 PHE -7 HE1 PHE -7 11.354 -16.436 3.948 966 HZ PHE -7 HZ PHE -7 8.903 -16.574 3.751 967 H ILE -6 H ILE -6 11.478 -11.607 9.227 968 HA ILE -6 HA ILE -6 12.952 -10.187 10.234 969 HB ILE -6 HB ILE -6 13.304 -12.377 12.275 970 HG12 ILE -6 2HG1 ILE -6 10.923 -12.124 11.882 971 HG13 ILE -6 3HG1 ILE -6 11.337 -11.380 13.423 972 HG21 ILE -6 1HG2 ILE -6 14.605 -10.824 13.205 973 HG22 ILE -6 2HG2 ILE -6 14.047 -9.576 12.091 974 HG23 ILE -6 3HG2 ILE -6 13.120 -9.937 13.547 975 HD11 ILE -6 3HD1 ILE -6 10.229 -10.197 11.002 976 HD12 ILE -6 1HD1 ILE -6 10.146 -9.653 12.677 977 HD13 ILE -6 2HD1 ILE -6 11.565 -9.282 11.699 978 HA PRO -5 HA PRO -5 16.646 -12.341 8.468 979 HB2 PRO -5 2HB PRO -5 17.355 -10.274 6.858 980 HB3 PRO -5 3HB PRO -5 16.186 -11.509 6.377 981 HG2 PRO -5 2HG PRO -5 15.700 -8.752 7.436 982 HG3 PRO -5 3HG PRO -5 14.891 -9.597 6.104 983 HD2 PRO -5 2HD PRO -5 13.802 -9.392 8.575 984 HD3 PRO -5 3HD PRO -5 13.531 -10.798 7.526 985 H SER -4 H SER -4 17.636 -12.163 10.540 986 HA SER -4 HA SER -4 18.949 -9.602 11.119 987 HB2 SER -4 2HB SER -4 17.568 -10.699 12.909 988 HB3 SER -4 3HB SER -4 18.731 -12.025 12.918 989 HG SER -4 HG SER -4 19.910 -10.846 14.176 990 H ARG -3 H ARG -3 19.892 -11.293 9.002 991 HA ARG -3 HA ARG -3 22.338 -12.486 10.068 992 HB2 ARG -3 2HB ARG -3 21.874 -12.486 7.151 993 HB3 ARG -3 3HB ARG -3 22.401 -13.787 8.210 994 HG2 ARG -3 2HG ARG -3 19.944 -13.748 9.050 995 HG3 ARG -3 3HG ARG -3 19.634 -12.907 7.530 996 HD2 ARG -3 2HD ARG -3 19.269 -15.231 7.152 997 HD3 ARG -3 3HD ARG -3 20.778 -14.793 6.351 998 HE ARG -3 HE ARG -3 21.882 -16.227 7.745 999 HH11 ARG -3 1HH1 ARG -3 18.758 -15.517 9.106 1000 HH12 ARG -3 2HH1 ARG -3 18.908 -16.674 10.387 1001 HH21 ARG -3 1HH2 ARG -3 22.092 -17.754 9.426 1002 HH22 ARG -3 2HH2 ARG -3 20.805 -17.945 10.569 1003 HA PRO -2 HA PRO -2 25.031 -9.230 8.891 1004 HB2 PRO -2 2HB PRO -2 27.186 -10.571 7.928 1005 HB3 PRO -2 3HB PRO -2 26.772 -10.524 9.646 1006 HG2 PRO -2 2HG PRO -2 26.230 -12.665 7.625 1007 HG3 PRO -2 3HG PRO -2 26.797 -12.823 9.297 1008 HD2 PRO -2 2HD PRO -2 24.216 -13.235 8.589 1009 HD3 PRO -2 3HD PRO -2 24.679 -12.577 10.172 1010 H ALA -1 H ALA -1 24.115 -8.106 7.212 1011 HA ALA -1 HA ALA -1 23.632 -8.938 4.630 1012 HB1 ALA -1 1HB ALA -1 22.706 -6.886 5.219 1013 HB2 ALA -1 2HB ALA -1 24.250 -6.240 5.779 1014 HB3 ALA -1 3HB ALA -1 23.956 -6.453 4.053 1015 HA PRO 0 HA PRO 0 27.887 -9.624 3.341 1016 HB2 PRO 0 2HB PRO 0 27.223 -10.847 1.010 1017 HB3 PRO 0 3HB PRO 0 27.193 -11.675 2.572 1018 HG2 PRO 0 2HG PRO 0 24.931 -10.474 1.021 1019 HG3 PRO 0 3HG PRO 0 24.997 -12.019 1.889 1020 HD2 PRO 0 2HD PRO 0 23.814 -9.815 2.926 1021 HD3 PRO 0 3HD PRO 0 24.625 -11.029 3.936 1022 H LYS 1 H LYS 1 29.232 -8.692 1.801 1023 HA LYS 1 HA LYS 1 28.051 -6.446 0.339 1024 HB2 LYS 1 2HB LYS 1 30.729 -7.038 1.481 1025 HB3 LYS 1 3HB LYS 1 30.684 -6.052 0.026 1026 HG2 LYS 1 2HG LYS 1 30.692 -4.562 1.855 1027 HG3 LYS 1 3HG LYS 1 29.046 -4.561 1.217 1028 HD2 LYS 1 2HD LYS 1 28.262 -5.924 2.992 1029 HD3 LYS 1 3HD LYS 1 29.904 -6.301 3.519 1030 HE2 LYS 1 2HE LYS 1 28.734 -3.525 3.548 1031 HE3 LYS 1 3HE LYS 1 28.681 -4.619 4.929 1032 HZ1 LYS 1 3HZ LYS 1 30.550 -3.236 5.225 1033 HZ2 LYS 1 1HZ LYS 1 31.077 -3.455 3.632 1034 HZ3 LYS 1 2HZ LYS 1 31.164 -4.734 4.735 1035 HA PRO 2 HA PRO 2 28.677 -8.143 -3.658 1036 HB2 PRO 2 2HB PRO 2 29.572 -6.006 -5.073 1037 HB3 PRO 2 3HB PRO 2 27.900 -6.161 -4.521 1038 HG2 PRO 2 2HG PRO 2 30.154 -4.601 -3.319 1039 HG3 PRO 2 3HG PRO 2 28.461 -4.126 -3.547 1040 HD2 PRO 2 2HD PRO 2 29.428 -4.977 -1.165 1041 HD3 PRO 2 3HD PRO 2 27.755 -5.278 -1.680 1042 HA PRO 3 HA PRO 3 32.835 -9.353 -4.420 1043 HB2 PRO 3 2HB PRO 3 32.939 -9.480 -7.130 1044 HB3 PRO 3 3HB PRO 3 32.052 -10.650 -6.147 1045 HG2 PRO 3 2HG PRO 3 31.026 -8.270 -7.644 1046 HG3 PRO 3 3HG PRO 3 30.339 -9.900 -7.529 1047 HD2 PRO 3 2HD PRO 3 29.408 -7.821 -6.065 1048 HD3 PRO 3 3HD PRO 3 29.392 -9.493 -5.467 1049 H SER 4 H SER 4 34.887 -8.602 -4.939 1050 HA SER 4 HA SER 4 35.000 -5.788 -5.796 1051 HB2 SER 4 2HB SER 4 36.817 -7.407 -4.007 1052 HB3 SER 4 3HB SER 4 37.266 -5.824 -4.641 1053 HG SER 4 HG SER 4 35.916 -6.275 -2.482 1054 H SER 5 H SER 5 37.239 -5.237 -6.770 1055 HA SER 5 HA SER 5 37.887 -7.300 -8.774 1056 HB2 SER 5 2HB SER 5 36.740 -5.257 -9.667 1057 HB3 SER 5 3HB SER 5 38.119 -4.302 -9.123 1058 HG SER 5 HG SER 5 38.143 -5.044 -11.381 1059 H ALA 6 H ALA 6 39.321 -4.360 -7.344 1060 HA ALA 6 HA ALA 6 41.994 -5.237 -7.803 1061 HB1 ALA 6 1HB ALA 6 41.746 -2.922 -7.738 1062 HB2 ALA 6 2HB ALA 6 40.782 -2.970 -6.261 1063 HB3 ALA 6 3HB ALA 6 42.513 -3.300 -6.196 Start of MODEL 7 1 H1 MET -2 H MET -2 2.020 0.337 -3.806 2 HA MET -2 HA MET -2 4.613 1.235 -4.781 3 HB2 MET -2 2HB MET -2 5.256 -1.093 -4.724 4 HB3 MET -2 3HB MET -2 4.456 -0.682 -3.213 5 HG2 MET -2 2HG MET -2 2.481 -1.817 -3.842 6 HG3 MET -2 3HG MET -2 3.028 -1.986 -5.509 7 HE1 MET -2 3HE MET -2 5.051 -3.423 -6.236 8 HE2 MET -2 1HE MET -2 6.166 -2.899 -4.973 9 HE3 MET -2 2HE MET -2 5.868 -4.618 -5.228 10 H ALA -1 H ALA -1 5.274 -0.653 -6.626 11 HA ALA -1 HA ALA -1 3.238 -0.627 -8.715 12 HB1 ALA -1 1HB ALA -1 5.134 1.373 -8.653 13 HB2 ALA -1 2HB ALA -1 5.804 0.207 -9.794 14 HB3 ALA -1 3HB ALA -1 4.193 0.874 -10.059 15 HA PRO 1 HA PRO 1 4.930 -4.513 -9.848 16 HB2 PRO 1 2HB PRO 1 4.658 -4.504 -12.549 17 HB3 PRO 1 3HB PRO 1 3.285 -4.656 -11.446 18 HG2 PRO 1 2HG PRO 1 4.295 -2.236 -12.890 19 HG3 PRO 1 3HG PRO 1 2.625 -2.785 -12.659 20 HD2 PRO 1 2HD PRO 1 3.733 -0.820 -11.161 21 HD3 PRO 1 3HD PRO 1 2.508 -1.933 -10.520 22 H LEU 2 H LEU 2 7.112 -3.728 -9.155 23 HA LEU 2 HA LEU 2 8.919 -2.960 -11.296 24 HB2 LEU 2 2HB LEU 2 10.402 -2.342 -9.681 25 HB3 LEU 2 3HB LEU 2 8.888 -2.165 -8.796 26 HG LEU 2 HG LEU 2 9.488 -4.686 -8.120 27 HD11 LEU 2 1HD1 LEU 2 12.130 -4.122 -7.580 28 HD12 LEU 2 2HD1 LEU 2 11.929 -3.585 -9.247 29 HD13 LEU 2 3HD1 LEU 2 11.534 -5.245 -8.802 30 HD21 LEU 2 3HD2 LEU 2 10.628 -3.653 -6.093 31 HD22 LEU 2 1HD2 LEU 2 8.999 -3.090 -6.467 32 HD23 LEU 2 2HD2 LEU 2 10.393 -2.097 -6.891 33 H PHE 3 H PHE 3 10.874 -4.139 -11.752 34 HA PHE 3 HA PHE 3 10.787 -6.989 -11.049 35 HB2 PHE 3 2HB PHE 3 11.078 -5.834 -13.826 36 HB3 PHE 3 3HB PHE 3 11.460 -7.504 -13.424 37 HD1 PHE 3 HD2 PHE 3 8.791 -5.051 -13.872 38 HD2 PHE 3 HD1 PHE 3 9.716 -9.097 -12.926 39 HE1 PHE 3 HE2 PHE 3 6.435 -5.668 -14.221 40 HE2 PHE 3 HE1 PHE 3 7.361 -9.720 -13.275 41 HZ PHE 3 HZ PHE 3 5.717 -8.005 -13.922 42 H ALA 4 H ALA 4 12.747 -7.950 -10.739 43 HA ALA 4 HA ALA 4 15.101 -6.194 -10.962 44 HB1 ALA 4 1HB ALA 4 15.291 -6.608 -8.778 45 HB2 ALA 4 2HB ALA 4 14.135 -7.939 -8.843 46 HB3 ALA 4 3HB ALA 4 15.827 -8.221 -9.250 47 H VAL 5 H VAL 5 17.205 -7.473 -11.146 48 HA VAL 5 HA VAL 5 16.890 -9.858 -12.827 49 HB VAL 5 HB VAL 5 17.137 -8.019 -14.390 50 HG11 VAL 5 1HG1 VAL 5 19.766 -7.379 -13.065 51 HG12 VAL 5 2HG1 VAL 5 18.976 -6.501 -14.376 52 HG13 VAL 5 3HG1 VAL 5 18.273 -6.492 -12.758 53 HG21 VAL 5 3HG2 VAL 5 18.348 -10.253 -14.689 54 HG22 VAL 5 1HG2 VAL 5 18.872 -8.902 -15.693 55 HG23 VAL 5 2HG2 VAL 5 19.818 -9.369 -14.280 56 H THR 6 H THR 6 18.170 -11.450 -12.173 57 HA THR 6 HA THR 6 20.078 -11.058 -10.085 58 HB THR 6 HB THR 6 20.599 -13.584 -10.964 59 HG1 THR 6 HG1 THR 6 19.044 -14.249 -12.225 60 HG21 THR 6 3HG2 THR 6 18.260 -13.799 -9.405 61 HG22 THR 6 1HG2 THR 6 19.081 -12.330 -8.880 62 HG23 THR 6 2HG2 THR 6 19.934 -13.874 -8.857 63 H LEU 7 H LEU 7 22.316 -11.331 -10.140 64 HA LEU 7 HA LEU 7 23.526 -11.132 -12.820 65 HB2 LEU 7 2HB LEU 7 24.605 -9.957 -10.266 66 HB3 LEU 7 3HB LEU 7 25.242 -9.728 -11.893 67 HG LEU 7 HG LEU 7 22.504 -8.780 -11.086 68 HD11 LEU 7 1HD1 LEU 7 25.158 -7.609 -10.527 69 HD12 LEU 7 2HD1 LEU 7 23.630 -7.427 -9.667 70 HD13 LEU 7 3HD1 LEU 7 23.922 -6.514 -11.148 71 HD21 LEU 7 3HD2 LEU 7 22.562 -7.511 -13.050 72 HD22 LEU 7 1HD2 LEU 7 23.224 -9.076 -13.522 73 HD23 LEU 7 2HD2 LEU 7 24.305 -7.712 -13.236 74 H TYR 8 H TYR 8 23.300 -12.952 -10.002 75 HA TYR 8 HA TYR 8 25.589 -14.577 -10.833 76 HB2 TYR 8 2HB TYR 8 25.076 -13.795 -7.957 77 HB3 TYR 8 3HB TYR 8 26.370 -14.835 -8.541 78 HD1 TYR 8 HD2 TYR 8 25.081 -11.362 -8.607 79 HD2 TYR 8 HD1 TYR 8 28.402 -13.923 -9.325 80 HE1 TYR 8 HE2 TYR 8 26.533 -9.395 -8.876 81 HE2 TYR 8 HE1 TYR 8 29.863 -11.963 -9.595 82 HH TYR 8 HH TYR 8 29.537 -9.501 -10.256 83 H GLU 9 H GLU 9 25.565 -16.743 -9.712 84 HA GLU 9 HA GLU 9 22.843 -17.768 -9.779 85 HB2 GLU 9 2HB GLU 9 24.594 -18.922 -11.062 86 HB3 GLU 9 3HB GLU 9 25.485 -19.225 -9.577 87 HG2 GLU 9 2HG GLU 9 24.436 -21.225 -9.823 88 HG3 GLU 9 3HG GLU 9 23.239 -20.375 -8.848 89 H PHE 10 H PHE 10 21.732 -17.697 -7.941 90 HA PHE 10 HA PHE 10 23.104 -17.935 -5.383 91 HB2 PHE 10 2HB PHE 10 21.301 -16.197 -5.875 92 HB3 PHE 10 3HB PHE 10 20.147 -17.525 -5.810 93 HD1 PHE 10 HD1 PHE 10 22.984 -16.197 -3.777 94 HD2 PHE 10 HD2 PHE 10 19.055 -17.834 -3.824 95 HE1 PHE 10 HE1 PHE 10 22.861 -15.964 -1.331 96 HE2 PHE 10 HE2 PHE 10 18.925 -17.602 -1.378 97 HZ PHE 10 HZ PHE 10 20.829 -16.665 -0.128 98 H LYS 11 H LYS 11 23.395 -19.865 -4.510 99 HA LYS 11 HA LYS 11 21.713 -22.104 -5.308 100 HB2 LYS 11 2HB LYS 11 24.172 -22.015 -3.550 101 HB3 LYS 11 3HB LYS 11 23.347 -23.478 -4.071 102 HG2 LYS 11 2HG LYS 11 24.951 -23.445 -5.654 103 HG3 LYS 11 3HG LYS 11 23.800 -22.377 -6.462 104 HD2 LYS 11 2HD LYS 11 25.553 -20.973 -6.598 105 HD3 LYS 11 3HD LYS 11 25.162 -20.608 -4.915 106 HE2 LYS 11 2HE LYS 11 26.711 -22.669 -4.438 107 HE3 LYS 11 3HE LYS 11 27.347 -22.301 -6.040 108 HZ1 LYS 11 3HZ LYS 11 27.089 -20.137 -4.071 109 HZ2 LYS 11 1HZ LYS 11 28.185 -20.300 -5.349 110 HZ3 LYS 11 2HZ LYS 11 28.387 -21.214 -3.940 111 H ALA 12 H ALA 12 19.849 -22.297 -4.243 112 HA ALA 12 HA ALA 12 19.310 -21.261 -1.687 113 HB1 ALA 12 1HB ALA 12 17.370 -23.038 -1.863 114 HB2 ALA 12 2HB ALA 12 17.384 -21.590 -2.871 115 HB3 ALA 12 3HB ALA 12 17.923 -23.132 -3.535 116 H GLU 13 H GLU 13 18.759 -22.467 0.262 117 HA GLU 13 HA GLU 13 20.337 -24.937 0.557 118 HB2 GLU 13 2HB GLU 13 20.680 -24.135 2.968 119 HB3 GLU 13 3HB GLU 13 21.615 -23.343 1.707 120 HG2 GLU 13 2HG GLU 13 19.009 -22.166 2.532 121 HG3 GLU 13 3HG GLU 13 20.419 -21.953 3.567 122 H ARG 14 H ARG 14 17.547 -23.063 1.599 123 HA ARG 14 HA ARG 14 16.370 -25.542 2.673 124 HB2 ARG 14 2HB ARG 14 16.088 -22.707 3.669 125 HB3 ARG 14 3HB ARG 14 15.017 -24.010 4.167 126 HG2 ARG 14 2HG ARG 14 17.993 -24.184 4.496 127 HG3 ARG 14 3HG ARG 14 16.951 -23.437 5.708 128 HD2 ARG 14 2HD ARG 14 15.673 -25.529 5.873 129 HD3 ARG 14 3HD ARG 14 16.749 -26.269 4.689 130 HE ARG 14 HE ARG 14 18.256 -25.248 6.841 131 HH11 ARG 14 1HH1 ARG 14 16.053 -27.826 6.055 132 HH12 ARG 14 2HH1 ARG 14 16.701 -28.916 7.234 133 HH21 ARG 14 1HH2 ARG 14 19.119 -26.674 8.398 134 HH22 ARG 14 2HH2 ARG 14 18.445 -28.260 8.567 135 H ASP 15 H ASP 15 13.930 -25.462 2.694 136 HA ASP 15 HA ASP 15 12.929 -25.226 0.124 137 HB2 ASP 15 2HB ASP 15 11.249 -24.963 2.619 138 HB3 ASP 15 3HB ASP 15 10.757 -25.602 1.053 139 H ASP 16 H ASP 16 12.836 -22.897 2.778 140 HA ASP 16 HA ASP 16 11.177 -21.000 1.506 141 HB2 ASP 16 2HB ASP 16 13.122 -20.889 3.787 142 HB3 ASP 16 3HB ASP 16 12.415 -19.402 3.161 143 H GLU 17 H GLU 17 14.534 -21.766 1.188 144 HA GLU 17 HA GLU 17 15.144 -19.272 -0.183 145 HB2 GLU 17 2HB GLU 17 16.970 -21.649 0.119 146 HB3 GLU 17 3HB GLU 17 17.413 -19.974 -0.180 147 HG2 GLU 17 2HG GLU 17 16.343 -21.167 2.360 148 HG3 GLU 17 3HG GLU 17 17.934 -20.463 2.079 149 H LEU 18 H LEU 18 15.126 -19.013 -2.322 150 HA LEU 18 HA LEU 18 14.702 -21.397 -3.993 151 HB2 LEU 18 2HB LEU 18 12.902 -19.693 -3.969 152 HB3 LEU 18 3HB LEU 18 14.049 -18.520 -4.614 153 HG LEU 18 HG LEU 18 14.252 -20.417 -6.501 154 HD11 LEU 18 1HD1 LEU 18 11.445 -20.665 -6.576 155 HD12 LEU 18 2HD1 LEU 18 11.967 -21.183 -4.974 156 HD13 LEU 18 3HD1 LEU 18 12.650 -21.943 -6.411 157 HD21 LEU 18 3HD2 LEU 18 12.627 -17.983 -6.160 158 HD22 LEU 18 1HD2 LEU 18 12.163 -19.037 -7.496 159 HD23 LEU 18 2HD2 LEU 18 13.806 -18.401 -7.405 160 H ASP 19 H ASP 19 15.889 -21.701 -5.864 161 HA ASP 19 HA ASP 19 18.461 -20.345 -5.912 162 HB2 ASP 19 2HB ASP 19 18.701 -22.673 -6.117 163 HB3 ASP 19 3HB ASP 19 17.359 -22.802 -7.251 164 H VAL 20 H VAL 20 19.333 -19.336 -7.759 165 HA VAL 20 HA VAL 20 17.552 -18.787 -9.999 166 HB VAL 20 HB VAL 20 17.142 -17.006 -8.267 167 HG11 VAL 20 1HG1 VAL 20 19.670 -16.995 -7.677 168 HG12 VAL 20 2HG1 VAL 20 19.798 -15.858 -9.020 169 HG13 VAL 20 3HG1 VAL 20 18.765 -15.482 -7.641 170 HG21 VAL 20 3HG2 VAL 20 16.682 -15.526 -9.907 171 HG22 VAL 20 1HG2 VAL 20 18.329 -15.552 -10.536 172 HG23 VAL 20 2HG2 VAL 20 17.202 -16.840 -10.962 173 H SER 21 H SER 21 18.637 -17.837 -11.825 174 HA SER 21 HA SER 21 21.535 -18.358 -11.791 175 HB2 SER 21 2HB SER 21 21.415 -19.091 -14.013 176 HB3 SER 21 3HB SER 21 19.931 -19.728 -13.305 177 HG SER 21 HG SER 21 20.010 -18.360 -15.430 178 HA PRO 22 HA PRO 22 22.417 -14.171 -12.765 179 HB2 PRO 22 2HB PRO 22 24.604 -14.446 -14.349 180 HB3 PRO 22 3HB PRO 22 24.640 -14.726 -12.605 181 HG2 PRO 22 2HG PRO 22 24.441 -16.709 -14.839 182 HG3 PRO 22 3HG PRO 22 25.420 -16.782 -13.363 183 HD2 PRO 22 2HD PRO 22 23.082 -18.122 -13.627 184 HD3 PRO 22 3HD PRO 22 23.646 -17.483 -12.069 185 H GLY 23 H GLY 23 21.450 -12.801 -14.122 186 HA2 GLY 23 2HA GLY 23 21.140 -11.818 -16.263 187 HA3 GLY 23 3HA GLY 23 21.472 -13.379 -16.998 188 H GLU 24 H GLU 24 19.483 -14.093 -14.528 189 HA GLU 24 HA GLU 24 17.193 -14.307 -16.291 190 HB2 GLU 24 2HB GLU 24 17.994 -15.464 -13.673 191 HB3 GLU 24 3HB GLU 24 16.271 -15.325 -13.994 192 HG2 GLU 24 2HG GLU 24 18.191 -16.667 -15.875 193 HG3 GLU 24 3HG GLU 24 17.326 -17.520 -14.598 194 H ASN 25 H ASN 25 15.040 -13.644 -15.618 195 HA ASN 25 HA ASN 25 15.127 -11.065 -14.223 196 HB2 ASN 25 2HB ASN 25 12.999 -12.215 -16.043 197 HB3 ASN 25 3HB ASN 25 12.983 -10.601 -15.336 198 HD21 ASN 25 1HD2 ASN 25 13.421 -9.150 -16.817 199 HD22 ASN 25 2HD2 ASN 25 14.620 -9.281 -18.054 200 H LEU 26 H LEU 26 14.101 -10.740 -12.343 201 HA LEU 26 HA LEU 26 12.286 -12.849 -11.376 202 HB2 LEU 26 2HB LEU 26 14.375 -11.304 -9.855 203 HB3 LEU 26 3HB LEU 26 13.121 -12.270 -9.081 204 HG LEU 26 HG LEU 26 15.074 -13.590 -9.064 205 HD11 LEU 26 1HD1 LEU 26 14.460 -15.509 -10.365 206 HD12 LEU 26 2HD1 LEU 26 13.491 -14.518 -11.454 207 HD13 LEU 26 3HD1 LEU 26 12.989 -14.733 -9.777 208 HD21 LEU 26 3HD2 LEU 26 15.984 -12.111 -11.092 209 HD22 LEU 26 1HD2 LEU 26 15.503 -13.549 -11.992 210 HD23 LEU 26 2HD2 LEU 26 16.667 -13.682 -10.674 211 H SER 27 H SER 27 10.721 -12.131 -9.753 212 HA SER 27 HA SER 27 9.888 -9.353 -10.258 213 HB2 SER 27 2HB SER 27 8.462 -11.680 -10.633 214 HB3 SER 27 3HB SER 27 7.891 -11.133 -9.057 215 HG SER 27 HG SER 27 6.733 -10.285 -10.926 216 H ILE 28 H ILE 28 10.368 -8.026 -8.646 217 HA ILE 28 HA ILE 28 10.937 -8.914 -6.001 218 HB ILE 28 HB ILE 28 10.470 -6.121 -7.052 219 HG12 ILE 28 2HG1 ILE 28 12.399 -7.333 -8.045 220 HG13 ILE 28 3HG1 ILE 28 12.890 -5.939 -7.089 221 HG21 ILE 28 1HG2 ILE 28 10.125 -5.913 -4.764 222 HG22 ILE 28 2HG2 ILE 28 11.323 -7.146 -4.372 223 HG23 ILE 28 3HG2 ILE 28 11.844 -5.560 -4.941 224 HD11 ILE 28 3HD1 ILE 28 12.818 -8.283 -5.443 225 HD12 ILE 28 1HD1 ILE 28 13.804 -8.569 -6.877 226 HD13 ILE 28 2HD1 ILE 28 14.168 -7.210 -5.812 227 H CYS 29 H CYS 29 9.755 -8.716 -4.128 228 HA CYS 29 HA CYS 29 6.928 -7.948 -4.447 229 HB2 CYS 29 2HB CYS 29 7.949 -10.107 -2.596 230 HB3 CYS 29 3HB CYS 29 6.272 -9.719 -2.962 231 HG CYS 29 HG CYS 29 7.532 -10.356 -5.830 232 H ALA 30 H ALA 30 9.741 -8.061 -2.346 233 HA ALA 30 HA ALA 30 9.038 -5.644 -1.043 234 HB1 ALA 30 1HB ALA 30 8.061 -8.102 0.148 235 HB2 ALA 30 2HB ALA 30 9.099 -7.192 1.246 236 HB3 ALA 30 3HB ALA 30 7.677 -6.425 0.538 237 H HIS 31 H HIS 31 10.531 -5.308 0.948 238 HA HIS 31 HA HIS 31 13.114 -6.635 0.470 239 HB2 HIS 31 2HB HIS 31 14.288 -4.567 0.635 240 HB3 HIS 31 3HB HIS 31 12.978 -4.308 -0.513 241 HD1 HIS 31 HD1 HIS 31 14.583 -2.496 1.937 242 HD2 HIS 31 HD2 HIS 31 10.569 -3.342 1.278 243 HE1 HIS 31 HE1 HIS 31 13.309 -0.704 3.157 244 H TYR 32 H TYR 32 14.684 -5.959 2.356 245 HA TYR 32 HA TYR 32 13.243 -5.935 4.909 246 HB2 TYR 32 2HB TYR 32 13.834 -8.302 4.180 247 HB3 TYR 32 3HB TYR 32 15.521 -7.844 4.387 248 HD1 TYR 32 HD1 TYR 32 12.298 -7.755 6.282 249 HD2 TYR 32 HD2 TYR 32 16.517 -8.289 6.421 250 HE1 TYR 32 HE1 TYR 32 12.144 -8.300 8.675 251 HE2 TYR 32 HE2 TYR 32 16.374 -8.837 8.815 252 HH TYR 32 HH TYR 32 15.032 -9.174 10.550 253 H ASP 33 H ASP 33 13.931 -3.966 5.568 254 HA ASP 33 HA ASP 33 15.313 -2.308 6.294 255 HB2 ASP 33 2HB ASP 33 15.927 -4.186 7.852 256 HB3 ASP 33 3HB ASP 33 17.287 -4.542 6.790 257 H TYR 34 H TYR 34 15.472 -3.198 3.459 258 HA TYR 34 HA TYR 34 16.621 -2.635 1.579 259 HB2 TYR 34 2HB TYR 34 18.344 -0.934 3.388 260 HB3 TYR 34 3HB TYR 34 18.125 -0.750 1.652 261 HD1 TYR 34 HD1 TYR 34 16.562 -0.283 4.946 262 HD2 TYR 34 HD2 TYR 34 16.167 0.327 0.754 263 HE1 TYR 34 HE1 TYR 34 14.697 1.267 5.354 264 HE2 TYR 34 HE2 TYR 34 14.301 1.880 1.150 265 HH TYR 34 HH TYR 34 12.653 2.085 3.995 266 H GLU 35 H GLU 35 17.471 -4.870 3.341 267 HA GLU 35 HA GLU 35 20.277 -5.083 2.465 268 HB2 GLU 35 2HB GLU 35 19.083 -6.765 4.648 269 HB3 GLU 35 3HB GLU 35 20.776 -6.407 4.335 270 HG2 GLU 35 2HG GLU 35 18.709 -4.496 5.398 271 HG3 GLU 35 3HG GLU 35 20.023 -5.242 6.307 272 H TRP 36 H TRP 36 17.283 -6.925 2.964 273 HA TRP 36 HA TRP 36 18.220 -8.839 0.928 274 HB2 TRP 36 2HB TRP 36 16.251 -9.278 3.184 275 HB3 TRP 36 3HB TRP 36 16.685 -10.475 1.967 276 HD1 TRP 36 HD1 TRP 36 18.094 -8.703 5.057 277 HE1 TRP 36 HE1 TRP 36 20.136 -10.024 5.899 278 HE3 TRP 36 HE3 TRP 36 18.526 -12.059 1.225 279 HZ2 TRP 36 HZ2 TRP 36 21.721 -12.201 5.051 280 HZ3 TRP 36 HZ3 TRP 36 20.332 -13.728 1.317 281 HH2 TRP 36 HH2 TRP 36 21.896 -13.795 3.191 282 H PHE 37 H PHE 37 16.799 -9.493 -0.692 283 HA PHE 37 HA PHE 37 14.338 -7.891 -0.938 284 HB2 PHE 37 2HB PHE 37 16.625 -8.065 -2.715 285 HB3 PHE 37 3HB PHE 37 15.140 -8.533 -3.537 286 HD1 PHE 37 HD2 PHE 37 13.091 -6.857 -2.674 287 HD2 PHE 37 HD1 PHE 37 17.214 -5.896 -3.119 288 HE1 PHE 37 HE2 PHE 37 12.504 -4.485 -2.963 289 HE2 PHE 37 HE1 PHE 37 16.633 -3.523 -3.408 290 HZ PHE 37 HZ PHE 37 14.276 -2.815 -3.331 291 H ILE 38 H ILE 38 12.533 -8.897 -1.773 292 HA ILE 38 HA ILE 38 12.683 -11.825 -1.875 293 HB ILE 38 HB ILE 38 10.167 -10.174 -1.725 294 HG12 ILE 38 2HG1 ILE 38 11.533 -9.566 0.190 295 HG13 ILE 38 3HG1 ILE 38 10.215 -10.605 0.720 296 HG21 ILE 38 1HG2 ILE 38 9.866 -12.605 -0.399 297 HG22 ILE 38 2HG2 ILE 38 9.224 -12.170 -1.983 298 HG23 ILE 38 3HG2 ILE 38 10.781 -12.990 -1.857 299 HD11 ILE 38 3HD1 ILE 38 11.664 -11.985 1.646 300 HD12 ILE 38 1HD1 ILE 38 12.448 -12.241 0.087 301 HD13 ILE 38 2HD1 ILE 38 12.982 -10.930 1.139 302 H ALA 39 H ALA 39 13.225 -12.331 -3.944 303 HA ALA 39 HA ALA 39 11.532 -11.239 -6.093 304 HB1 ALA 39 1HB ALA 39 13.852 -12.648 -7.055 305 HB2 ALA 39 2HB ALA 39 13.360 -10.976 -7.328 306 HB3 ALA 39 3HB ALA 39 14.313 -11.394 -5.904 307 H LYS 40 H LYS 40 10.403 -12.587 -7.406 308 HA LYS 40 HA LYS 40 10.514 -15.458 -6.753 309 HB2 LYS 40 2HB LYS 40 8.134 -15.424 -7.743 310 HB3 LYS 40 3HB LYS 40 8.374 -14.749 -6.137 311 HG2 LYS 40 2HG LYS 40 8.167 -12.551 -6.901 312 HG3 LYS 40 3HG LYS 40 8.423 -13.019 -8.584 313 HD2 LYS 40 2HD LYS 40 6.122 -12.618 -8.443 314 HD3 LYS 40 3HD LYS 40 6.260 -14.375 -8.335 315 HE2 LYS 40 2HE LYS 40 6.430 -13.673 -5.720 316 HE3 LYS 40 3HE LYS 40 5.361 -12.414 -6.336 317 HZ1 LYS 40 3HZ LYS 40 3.710 -13.877 -6.714 318 HZ2 LYS 40 1HZ LYS 40 4.506 -14.795 -5.536 319 HZ3 LYS 40 2HZ LYS 40 4.752 -15.128 -7.176 320 HA PRO 41 HA PRO 41 11.579 -16.470 -10.888 321 HB2 PRO 41 2HB PRO 41 10.190 -18.770 -11.276 322 HB3 PRO 41 3HB PRO 41 11.611 -18.671 -10.229 323 HG2 PRO 41 2HG PRO 41 8.710 -18.628 -9.493 324 HG3 PRO 41 3HG PRO 41 10.049 -19.492 -8.715 325 HD2 PRO 41 2HD PRO 41 9.050 -17.172 -7.740 326 HD3 PRO 41 3HD PRO 41 10.760 -17.620 -7.575 327 H ILE 42 H ILE 42 10.945 -15.717 -12.808 328 HA ILE 42 HA ILE 42 8.142 -15.050 -13.217 329 HB ILE 42 HB ILE 42 10.473 -14.474 -15.046 330 HG12 ILE 42 2HG1 ILE 42 9.257 -12.740 -12.884 331 HG13 ILE 42 3HG1 ILE 42 10.850 -13.486 -12.827 332 HG21 ILE 42 1HG2 ILE 42 8.264 -12.607 -15.063 333 HG22 ILE 42 2HG2 ILE 42 9.016 -13.476 -16.399 334 HG23 ILE 42 3HG2 ILE 42 7.739 -14.243 -15.456 335 HD11 ILE 42 3HD1 ILE 42 11.374 -11.359 -13.472 336 HD12 ILE 42 1HD1 ILE 42 11.221 -12.150 -15.040 337 HD13 ILE 42 2HD1 ILE 42 9.899 -11.162 -14.417 338 H ASN 43 H ASN 43 10.583 -17.232 -14.449 339 HA ASN 43 HA ASN 43 8.844 -18.152 -16.596 340 HB2 ASN 43 2HB ASN 43 11.133 -17.980 -17.227 341 HB3 ASN 43 3HB ASN 43 11.668 -18.843 -15.787 342 HD21 ASN 43 1HD2 ASN 43 9.480 -19.331 -18.540 343 HD22 ASN 43 2HD2 ASN 43 9.958 -20.962 -18.847 344 H ARG 43 H ARG 43 10.528 -19.583 -13.798 345 HA ARG 43 HA ARG 43 9.309 -22.103 -13.954 346 HB2 ARG 43 2HB ARG 43 10.248 -20.759 -11.419 347 HB3 ARG 43 3HB ARG 43 10.137 -22.485 -11.736 348 HG2 ARG 43 2HG ARG 43 12.041 -20.542 -13.025 349 HG3 ARG 43 3HG ARG 43 12.436 -21.777 -11.828 350 HD2 ARG 43 2HD ARG 43 11.637 -23.498 -13.446 351 HD3 ARG 43 3HD ARG 43 11.447 -22.216 -14.641 352 HE ARG 43 HE ARG 43 14.023 -21.956 -13.842 353 HH11 ARG 43 1HH1 ARG 43 12.126 -24.625 -15.026 354 HH12 ARG 43 2HH1 ARG 43 13.473 -25.422 -15.768 355 HH21 ARG 43 1HH2 ARG 43 15.804 -22.997 -14.815 356 HH22 ARG 43 2HH2 ARG 43 15.565 -24.496 -15.647 357 H LEU 44 H LEU 44 8.177 -22.689 -11.549 358 HA LEU 44 HA LEU 44 5.588 -21.371 -11.799 359 HB2 LEU 44 2HB LEU 44 6.352 -23.762 -10.133 360 HB3 LEU 44 3HB LEU 44 4.719 -23.200 -10.485 361 HG LEU 44 HG LEU 44 6.479 -23.985 -12.759 362 HD11 LEU 44 1HD1 LEU 44 5.396 -26.324 -12.407 363 HD12 LEU 44 2HD1 LEU 44 5.324 -25.830 -10.716 364 HD13 LEU 44 3HD1 LEU 44 6.877 -25.903 -11.547 365 HD21 LEU 44 3HD2 LEU 44 3.532 -24.074 -12.152 366 HD22 LEU 44 1HD2 LEU 44 4.250 -24.822 -13.579 367 HD23 LEU 44 2HD2 LEU 44 4.368 -23.078 -13.345 368 H GLY 45 H GLY 45 4.498 -21.694 -9.322 369 HA2 GLY 45 2HA GLY 45 5.356 -19.419 -7.942 370 HA3 GLY 45 3HA GLY 45 4.305 -20.663 -7.282 371 H GLY 46 H GLY 46 7.328 -19.190 -7.082 372 HA2 GLY 46 2HA GLY 46 8.099 -20.965 -4.927 373 HA3 GLY 46 3HA GLY 46 9.172 -21.002 -6.318 374 HA PRO 47 HA PRO 47 9.443 -16.495 -4.592 375 HB2 PRO 47 2HB PRO 47 8.160 -16.001 -2.251 376 HB3 PRO 47 3HB PRO 47 7.396 -15.783 -3.829 377 HG2 PRO 47 2HG PRO 47 7.167 -18.072 -1.913 378 HG3 PRO 47 3HG PRO 47 5.896 -17.269 -2.854 379 HD2 PRO 47 2HD PRO 47 6.993 -19.628 -3.603 380 HD3 PRO 47 3HD PRO 47 6.411 -18.430 -4.777 381 H GLY 48 H GLY 48 11.500 -16.497 -3.927 382 HA2 GLY 48 2HA GLY 48 12.124 -17.812 -1.355 383 HA3 GLY 48 3HA GLY 48 13.244 -17.747 -2.708 384 H LEU 49 H LEU 49 14.651 -16.878 -0.951 385 HA LEU 49 HA LEU 49 14.260 -13.970 -0.683 386 HB2 LEU 49 2HB LEU 49 14.279 -15.695 1.380 387 HB3 LEU 49 3HB LEU 49 16.004 -15.356 1.255 388 HG LEU 49 HG LEU 49 14.205 -13.009 1.305 389 HD11 LEU 49 1HD1 LEU 49 13.040 -14.018 3.008 390 HD12 LEU 49 2HD1 LEU 49 14.348 -13.246 3.903 391 HD13 LEU 49 3HD1 LEU 49 14.425 -14.970 3.541 392 HD21 LEU 49 3HD2 LEU 49 16.932 -13.780 2.201 393 HD22 LEU 49 1HD2 LEU 49 16.108 -12.479 3.062 394 HD23 LEU 49 2HD2 LEU 49 16.388 -12.348 1.325 395 H VAL 50 H VAL 50 15.759 -12.758 -1.625 396 HA VAL 50 HA VAL 50 18.468 -13.841 -1.966 397 HB VAL 50 HB VAL 50 17.347 -14.151 -4.104 398 HG11 VAL 50 1HG1 VAL 50 16.885 -11.172 -4.120 399 HG12 VAL 50 2HG1 VAL 50 16.408 -12.331 -5.362 400 HG13 VAL 50 3HG1 VAL 50 15.642 -12.374 -3.773 401 HG21 VAL 50 3HG2 VAL 50 19.687 -13.614 -4.202 402 HG22 VAL 50 1HG2 VAL 50 18.865 -12.783 -5.523 403 HG23 VAL 50 2HG2 VAL 50 19.342 -11.889 -4.079 404 HA PRO 51 HA PRO 51 19.562 -9.912 -0.253 405 HB2 PRO 51 2HB PRO 51 22.229 -10.050 -0.743 406 HB3 PRO 51 3HB PRO 51 21.440 -10.967 0.546 407 HG2 PRO 51 2HG PRO 51 22.259 -11.866 -2.189 408 HG3 PRO 51 3HG PRO 51 22.435 -12.704 -0.637 409 HD2 PRO 51 2HD PRO 51 20.459 -13.290 -2.393 410 HD3 PRO 51 3HD PRO 51 20.246 -13.427 -0.636 411 H VAL 52 H VAL 52 20.229 -7.848 -0.922 412 HA VAL 52 HA VAL 52 19.703 -7.196 -3.619 413 HB VAL 52 HB VAL 52 21.158 -5.424 -1.663 414 HG11 VAL 52 1HG1 VAL 52 20.850 -3.796 -3.150 415 HG12 VAL 52 2HG1 VAL 52 20.382 -5.048 -4.303 416 HG13 VAL 52 3HG1 VAL 52 19.149 -4.214 -3.356 417 HG21 VAL 52 3HG2 VAL 52 19.395 -5.611 -0.307 418 HG22 VAL 52 1HG2 VAL 52 18.479 -4.750 -1.544 419 HG23 VAL 52 2HG2 VAL 52 18.470 -6.513 -1.509 420 H SER 53 H SER 53 22.573 -8.139 -1.978 421 HA SER 53 HA SER 53 24.410 -6.962 -3.850 422 HB2 SER 53 2HB SER 53 24.985 -9.200 -1.902 423 HB3 SER 53 3HB SER 53 26.133 -8.063 -2.608 424 HG SER 53 HG SER 53 24.872 -7.807 -0.340 425 H TYR 54 H TYR 54 22.272 -9.424 -4.146 426 HA TYR 54 HA TYR 54 23.977 -10.848 -6.084 427 HB2 TYR 54 2HB TYR 54 21.953 -11.884 -4.132 428 HB3 TYR 54 3HB TYR 54 22.243 -12.758 -5.632 429 HD1 TYR 54 HD1 TYR 54 24.254 -11.171 -2.902 430 HD2 TYR 54 HD2 TYR 54 23.764 -14.482 -5.528 431 HE1 TYR 54 HE1 TYR 54 26.205 -12.264 -1.878 432 HE2 TYR 54 HE2 TYR 54 25.713 -15.585 -4.511 433 HH TYR 54 HH TYR 54 26.986 -15.541 -2.451 434 H VAL 55 H VAL 55 21.583 -8.680 -5.870 435 HA VAL 55 HA VAL 55 20.466 -9.478 -8.459 436 HB VAL 55 HB VAL 55 18.208 -8.692 -7.718 437 HG11 VAL 55 1HG1 VAL 55 18.111 -10.944 -7.815 438 HG12 VAL 55 2HG1 VAL 55 19.561 -11.156 -6.832 439 HG13 VAL 55 3HG1 VAL 55 18.014 -10.808 -6.060 440 HG21 VAL 55 3HG2 VAL 55 17.779 -7.953 -5.644 441 HG22 VAL 55 1HG2 VAL 55 18.784 -9.192 -4.892 442 HG23 VAL 55 2HG2 VAL 55 19.523 -7.723 -5.529 443 H ARG 56 H ARG 56 19.431 -7.688 -9.610 444 HA ARG 56 HA ARG 56 20.414 -5.052 -8.742 445 HB2 ARG 56 2HB ARG 56 21.890 -5.706 -10.487 446 HB3 ARG 56 3HB ARG 56 20.568 -6.313 -11.474 447 HG2 ARG 56 2HG ARG 56 19.745 -4.021 -11.763 448 HG3 ARG 56 3HG ARG 56 21.101 -3.427 -10.802 449 HD2 ARG 56 2HD ARG 56 21.772 -5.177 -13.086 450 HD3 ARG 56 3HD ARG 56 21.136 -3.582 -13.484 451 HE ARG 56 HE ARG 56 23.043 -3.006 -11.679 452 HH11 ARG 56 1HH1 ARG 56 23.045 -4.980 -14.547 453 HH12 ARG 56 2HH1 ARG 56 24.718 -4.700 -14.896 454 HH21 ARG 56 1HH2 ARG 56 25.247 -2.629 -12.129 455 HH22 ARG 56 2HH2 ARG 56 25.970 -3.363 -13.520 456 H ILE 57 H ILE 57 18.856 -3.590 -8.566 457 HA ILE 57 HA ILE 57 16.178 -4.168 -9.388 458 HB ILE 57 HB ILE 57 17.220 -1.515 -8.404 459 HG12 ILE 57 2HG1 ILE 57 17.893 -3.319 -6.862 460 HG13 ILE 57 3HG1 ILE 57 16.677 -2.268 -6.143 461 HG21 ILE 57 1HG2 ILE 57 15.106 -0.889 -8.662 462 HG22 ILE 57 2HG2 ILE 57 14.635 -2.520 -9.136 463 HG23 ILE 57 3HG2 ILE 57 14.651 -2.067 -7.432 464 HD11 ILE 57 3HD1 ILE 57 14.989 -3.888 -6.398 465 HD12 ILE 57 1HD1 ILE 57 15.987 -4.869 -7.470 466 HD13 ILE 57 2HD1 ILE 57 16.395 -4.739 -5.759 467 H ILE 58 H ILE 58 15.590 -4.040 -11.452 468 HA ILE 58 HA ILE 58 16.467 -1.693 -13.003 469 HB ILE 58 HB ILE 58 16.261 -3.126 -15.046 470 HG12 ILE 58 2HG1 ILE 58 16.521 -5.525 -13.278 471 HG13 ILE 58 3HG1 ILE 58 14.917 -4.882 -13.609 472 HG21 ILE 58 1HG2 ILE 58 18.377 -4.599 -14.106 473 HG22 ILE 58 2HG2 ILE 58 18.467 -2.958 -14.743 474 HG23 ILE 58 3HG2 ILE 58 18.337 -3.223 -13.004 475 HD11 ILE 58 3HD1 ILE 58 15.880 -4.990 -16.104 476 HD12 ILE 58 1HD1 ILE 58 16.790 -6.311 -15.372 477 HD13 ILE 58 2HD1 ILE 58 15.027 -6.324 -15.329 478 H ASP 59 H ASP 59 14.950 -1.692 -15.131 479 HA ASP 59 HA ASP 59 12.168 -1.965 -14.210 480 HB2 ASP 59 2HB ASP 59 13.305 0.443 -14.331 481 HB3 ASP 59 3HB ASP 59 12.864 0.289 -16.029 482 H LEU 60 H LEU 60 10.644 -2.502 -15.768 483 HA LEU 60 HA LEU 60 11.639 -3.977 -18.002 484 HB2 LEU 60 2HB LEU 60 9.161 -3.693 -16.575 485 HB3 LEU 60 3HB LEU 60 8.874 -3.608 -18.312 486 HG LEU 60 HG LEU 60 10.098 -5.786 -18.530 487 HD11 LEU 60 1HD1 LEU 60 10.202 -5.440 -15.579 488 HD12 LEU 60 2HD1 LEU 60 11.400 -6.115 -16.683 489 HD13 LEU 60 3HD1 LEU 60 9.983 -7.064 -16.232 490 HD21 LEU 60 3HD2 LEU 60 7.526 -5.470 -17.042 491 HD22 LEU 60 1HD2 LEU 60 8.182 -7.081 -17.337 492 HD23 LEU 60 2HD2 LEU 60 7.808 -6.019 -18.695 493 H MET 61 H MET 61 10.020 -0.874 -17.582 494 HA MET 61 HA MET 61 9.738 -0.396 -20.397 495 HB2 MET 61 2HB MET 61 9.378 1.309 -17.944 496 HB3 MET 61 3HB MET 61 9.254 1.987 -19.562 497 HG2 MET 61 2HG MET 61 7.070 1.518 -19.186 498 HG3 MET 61 3HG MET 61 7.574 -0.014 -19.896 499 HE1 MET 61 3HE MET 61 7.167 -2.595 -17.423 500 HE2 MET 61 1HE MET 61 5.906 -2.012 -18.509 501 HE3 MET 61 2HE MET 61 7.587 -2.032 -19.041 502 H ASP 62 H ASP 62 12.198 0.102 -18.028 503 HA ASP 62 HA ASP 62 14.010 1.060 -20.065 504 HB2 ASP 62 2HB ASP 62 12.732 3.052 -18.872 505 HB3 ASP 62 3HB ASP 62 13.929 2.761 -17.613 506 HA PRO 63 HA PRO 63 15.854 -1.748 -16.875 507 HB2 PRO 63 2HB PRO 63 17.087 -3.358 -18.679 508 HB3 PRO 63 3HB PRO 63 15.413 -3.596 -18.166 509 HG2 PRO 63 2HG PRO 63 16.467 -2.282 -20.640 510 HG3 PRO 63 3HG PRO 63 15.110 -3.409 -20.464 511 HD2 PRO 63 2HD PRO 63 14.761 -0.734 -20.693 512 HD3 PRO 63 3HD PRO 63 13.671 -1.761 -19.739 513 H ALA 64 H ALA 64 16.944 0.390 -19.264 514 HA ALA 64 HA ALA 64 19.770 0.001 -18.635 515 HB1 ALA 64 1HB ALA 64 20.243 1.481 -20.453 516 HB2 ALA 64 2HB ALA 64 19.024 0.325 -20.992 517 HB3 ALA 64 3HB ALA 64 18.552 1.969 -20.563 518 H LYS 65 H LYS 65 17.129 1.892 -17.655 519 HA LYS 65 HA LYS 65 18.605 4.232 -16.883 520 HB2 LYS 65 2HB LYS 65 16.081 4.030 -17.431 521 HB3 LYS 65 3HB LYS 65 15.919 3.462 -15.775 522 HG2 LYS 65 2HG LYS 65 17.111 5.597 -15.087 523 HG3 LYS 65 3HG LYS 65 16.836 6.151 -16.740 524 HD2 LYS 65 2HD LYS 65 14.592 5.119 -15.032 525 HD3 LYS 65 3HD LYS 65 15.115 6.804 -14.954 526 HE2 LYS 65 2HE LYS 65 14.891 6.435 -17.637 527 HE3 LYS 65 3HE LYS 65 13.613 5.379 -17.039 528 HZ1 LYS 65 3HZ LYS 65 13.456 7.774 -15.624 529 HZ2 LYS 65 1HZ LYS 65 12.355 7.160 -16.753 530 HZ3 LYS 65 2HZ LYS 65 13.606 8.179 -17.260 531 H TYR 66 H TYR 66 17.085 1.546 -15.105 532 HA TYR 66 HA TYR 66 18.545 2.328 -12.698 533 HB2 TYR 66 2HB TYR 66 16.358 0.295 -13.162 534 HB3 TYR 66 3HB TYR 66 17.151 0.543 -11.610 535 HD1 TYR 66 HD2 TYR 66 15.129 2.275 -14.204 536 HD2 TYR 66 HD1 TYR 66 16.403 2.212 -10.145 537 HE1 TYR 66 HE2 TYR 66 13.528 4.067 -13.679 538 HE2 TYR 66 HE1 TYR 66 14.805 4.003 -9.609 539 HH TYR 66 HH TYR 66 13.565 5.744 -10.676 540 H ALA 67 H ALA 67 19.757 1.041 -15.130 541 HA ALA 67 HA ALA 67 20.582 -1.569 -14.158 542 HB1 ALA 67 1HB ALA 67 20.869 -2.008 -16.312 543 HB2 ALA 67 2HB ALA 67 20.376 -0.358 -16.695 544 HB3 ALA 67 3HB ALA 67 22.080 -0.732 -16.438 545 H SER 68 H SER 68 21.726 1.689 -14.182 546 HA SER 68 HA SER 68 24.461 0.906 -13.552 547 HB2 SER 68 2HB SER 68 24.795 3.432 -13.442 548 HB3 SER 68 3HB SER 68 24.340 2.777 -15.015 549 HG SER 68 HG SER 68 23.167 4.719 -13.991 550 H VAL 69 H VAL 69 21.588 1.413 -11.916 551 HA VAL 69 HA VAL 69 22.230 2.808 -9.627 552 HB VAL 69 HB VAL 69 20.438 0.403 -9.952 553 HG11 VAL 69 1HG1 VAL 69 21.070 0.474 -7.641 554 HG12 VAL 69 2HG1 VAL 69 20.788 2.215 -7.568 555 HG13 VAL 69 3HG1 VAL 69 19.431 1.109 -7.787 556 HG21 VAL 69 3HG2 VAL 69 20.195 3.135 -10.666 557 HG22 VAL 69 1HG2 VAL 69 18.992 1.853 -10.807 558 HG23 VAL 69 2HG2 VAL 69 19.076 2.825 -9.338 559 H ASP 70 H ASP 70 23.244 2.370 -7.721 560 HA ASP 70 HA ASP 70 24.965 0.009 -7.694 561 HB2 ASP 70 2HB ASP 70 24.979 2.464 -5.926 562 HB3 ASP 70 3HB ASP 70 26.169 1.166 -5.882 563 H THR 71 H THR 71 23.084 -1.376 -7.232 564 HA THR 71 HA THR 71 21.414 -1.280 -5.071 565 HB THR 71 HB THR 71 21.947 -3.940 -5.089 566 HG1 THR 71 HG1 THR 71 22.312 -4.229 -7.511 567 HG21 THR 71 3HG2 THR 71 19.850 -3.874 -5.834 568 HG22 THR 71 1HG2 THR 71 20.426 -3.412 -7.435 569 HG23 THR 71 2HG2 THR 71 20.045 -2.170 -6.242 570 H TYR 72 H TYR 72 24.807 -2.179 -5.116 571 HA TYR 72 HA TYR 72 25.023 -3.340 -2.590 572 HB2 TYR 72 2HB TYR 72 26.871 -3.498 -4.093 573 HB3 TYR 72 3HB TYR 72 27.002 -1.747 -4.221 574 HD1 TYR 72 HD2 TYR 72 26.830 -4.122 -1.334 575 HD2 TYR 72 HD1 TYR 72 28.967 -1.001 -3.282 576 HE1 TYR 72 HE2 TYR 72 28.476 -4.117 0.493 577 HE2 TYR 72 HE1 TYR 72 30.620 -0.988 -1.461 578 HH TYR 72 HH TYR 72 30.719 -1.646 0.941 579 H ASP 73 H ASP 73 25.293 0.060 -3.561 580 HA ASP 73 HA ASP 73 25.853 1.031 -0.949 581 HB2 ASP 73 2HB ASP 73 26.406 2.264 -3.037 582 HB3 ASP 73 3HB ASP 73 24.685 2.534 -3.300 583 H ARG 74 H ARG 74 24.493 0.980 0.705 584 HA ARG 74 HA ARG 74 21.777 0.404 0.577 585 HB2 ARG 74 2HB ARG 74 21.685 0.864 2.890 586 HB3 ARG 74 3HB ARG 74 23.324 0.296 2.598 587 HG2 ARG 74 2HG ARG 74 22.573 3.204 2.745 588 HG3 ARG 74 3HG ARG 74 23.137 2.261 4.127 589 HD2 ARG 74 2HD ARG 74 24.633 2.885 1.588 590 HD3 ARG 74 3HD ARG 74 25.012 3.432 3.221 591 HE ARG 74 HE ARG 74 25.088 0.698 3.353 592 HH11 ARG 74 1HH1 ARG 74 26.693 3.145 1.468 593 HH12 ARG 74 2HH1 ARG 74 28.148 2.226 1.273 594 HH21 ARG 74 1HH2 ARG 74 26.999 -0.523 3.103 595 HH22 ARG 74 2HH2 ARG 74 28.321 0.139 2.203 596 H GLU 75 H GLU 75 23.436 3.395 0.116 597 HA GLU 75 HA GLU 75 21.310 5.170 0.694 598 HB2 GLU 75 2HB GLU 75 23.946 5.328 -0.610 599 HB3 GLU 75 3HB GLU 75 22.773 6.509 -1.176 600 HG2 GLU 75 2HG GLU 75 22.386 7.085 1.258 601 HG3 GLU 75 3HG GLU 75 23.823 6.125 1.608 602 H GLN 76 H GLN 76 22.570 4.046 -2.450 603 HA GLN 76 HA GLN 76 20.573 5.173 -4.034 604 HB2 GLN 76 2HB GLN 76 22.103 2.620 -4.562 605 HB3 GLN 76 3HB GLN 76 21.271 3.597 -5.765 606 HG2 GLN 76 2HG GLN 76 23.093 5.253 -4.333 607 HG3 GLN 76 3HG GLN 76 23.936 3.805 -4.880 608 HE21 GLN 76 1HE2 GLN 76 25.000 4.278 -6.661 609 HE22 GLN 76 2HE2 GLN 76 24.385 5.164 -8.010 610 H VAL 77 H VAL 77 20.826 1.782 -2.949 611 HA VAL 77 HA VAL 77 18.418 0.849 -3.913 612 HB VAL 77 HB VAL 77 20.291 -0.436 -2.699 613 HG11 VAL 77 1HG1 VAL 77 20.148 0.861 -0.605 614 HG12 VAL 77 2HG1 VAL 77 18.539 0.195 -0.326 615 HG13 VAL 77 3HG1 VAL 77 19.945 -0.871 -0.346 616 HG21 VAL 77 3HG2 VAL 77 17.423 -0.952 -2.883 617 HG22 VAL 77 1HG2 VAL 77 18.790 -1.970 -3.334 618 HG23 VAL 77 2HG2 VAL 77 18.239 -1.926 -1.660 619 H MET 78 H MET 78 19.044 2.797 -1.074 620 HA MET 78 HA MET 78 16.514 2.455 0.158 621 HB2 MET 78 2HB MET 78 18.863 4.193 0.514 622 HB3 MET 78 3HB MET 78 17.339 4.912 1.017 623 HG2 MET 78 2HG MET 78 16.944 2.809 2.362 624 HG3 MET 78 3HG MET 78 18.625 2.398 2.030 625 HE1 MET 78 3HE MET 78 20.408 2.904 3.351 626 HE2 MET 78 1HE MET 78 20.665 4.530 2.716 627 HE3 MET 78 2HE MET 78 20.637 4.258 4.459 628 H LYS 79 H LYS 79 17.837 5.073 -1.864 629 HA LYS 79 HA LYS 79 15.573 6.683 -1.951 630 HB2 LYS 79 2HB LYS 79 17.676 6.248 -4.080 631 HB3 LYS 79 3HB LYS 79 16.511 7.565 -4.079 632 HG2 LYS 79 2HG LYS 79 17.573 8.693 -2.413 633 HG3 LYS 79 3HG LYS 79 18.208 7.223 -1.671 634 HD2 LYS 79 2HD LYS 79 19.696 7.018 -3.727 635 HD3 LYS 79 3HD LYS 79 19.221 8.676 -4.102 636 HE2 LYS 79 2HE LYS 79 20.346 7.922 -1.423 637 HE3 LYS 79 3HE LYS 79 21.392 8.314 -2.787 638 HZ1 LYS 79 3HZ LYS 79 21.151 10.422 -2.183 639 HZ2 LYS 79 1HZ LYS 79 19.915 10.059 -1.086 640 HZ3 LYS 79 2HZ LYS 79 19.547 10.336 -2.713 641 H ILE 80 H ILE 80 16.485 3.957 -4.017 642 HA ILE 80 HA ILE 80 14.335 4.180 -5.830 643 HB ILE 80 HB ILE 80 16.122 1.889 -5.064 644 HG12 ILE 80 2HG1 ILE 80 16.259 2.421 -7.798 645 HG13 ILE 80 3HG1 ILE 80 16.109 4.009 -7.053 646 HG21 ILE 80 1HG2 ILE 80 14.127 0.760 -5.590 647 HG22 ILE 80 2HG2 ILE 80 13.757 1.862 -6.914 648 HG23 ILE 80 3HG2 ILE 80 15.088 0.716 -7.067 649 HD11 ILE 80 3HD1 ILE 80 18.147 3.898 -6.091 650 HD12 ILE 80 1HD1 ILE 80 18.062 2.154 -5.846 651 HD13 ILE 80 2HD1 ILE 80 18.445 2.803 -7.440 652 H ILE 81 H ILE 81 14.779 1.978 -3.058 653 HA ILE 81 HA ILE 81 12.262 0.785 -3.149 654 HB ILE 81 HB ILE 81 14.086 1.280 -0.798 655 HG12 ILE 81 2HG1 ILE 81 13.512 -1.237 -2.376 656 HG13 ILE 81 3HG1 ILE 81 14.911 -0.199 -2.630 657 HG21 ILE 81 1HG2 ILE 81 12.324 0.789 0.486 658 HG22 ILE 81 2HG2 ILE 81 11.362 0.247 -0.888 659 HG23 ILE 81 3HG2 ILE 81 12.504 -0.857 -0.121 660 HD11 ILE 81 3HD1 ILE 81 14.583 -1.047 0.137 661 HD12 ILE 81 1HD1 ILE 81 14.819 -2.380 -0.994 662 HD13 ILE 81 2HD1 ILE 81 16.006 -1.079 -0.903 663 H ASP 82 H ASP 82 13.324 3.774 -1.617 664 HA ASP 82 HA ASP 82 10.893 4.255 -0.213 665 HB2 ASP 82 2HB ASP 82 12.825 5.351 0.619 666 HB3 ASP 82 3HB ASP 82 13.226 6.010 -0.965 667 H GLU 83 H GLU 83 12.266 5.637 -3.196 668 HA GLU 83 HA GLU 83 10.104 7.283 -3.843 669 HB2 GLU 83 2HB GLU 83 12.268 5.993 -5.477 670 HB3 GLU 83 3HB GLU 83 10.998 6.928 -6.255 671 HG2 GLU 83 2HG GLU 83 12.828 7.965 -4.103 672 HG3 GLU 83 3HG GLU 83 13.044 8.228 -5.832 673 H PHE 84 H PHE 84 10.841 3.988 -4.975 674 HA PHE 84 HA PHE 84 8.448 3.713 -6.473 675 HB2 PHE 84 2HB PHE 84 10.536 1.796 -5.483 676 HB3 PHE 84 3HB PHE 84 9.064 1.195 -6.238 677 HD1 PHE 84 HD2 PHE 84 11.637 3.823 -6.887 678 HD2 PHE 84 HD1 PHE 84 9.203 0.710 -8.468 679 HE1 PHE 84 HE2 PHE 84 12.641 4.170 -9.106 680 HE2 PHE 84 HE1 PHE 84 10.204 1.051 -10.689 681 HZ PHE 84 HZ PHE 84 11.925 2.783 -11.011 682 H LYS 85 H LYS 85 9.069 3.643 -3.153 683 HA LYS 85 HA LYS 85 7.816 3.134 -1.324 684 HB2 LYS 85 2HB LYS 85 5.737 3.487 -3.452 685 HB3 LYS 85 3HB LYS 85 5.258 2.930 -1.854 686 HG2 LYS 85 2HG LYS 85 5.053 5.109 -1.402 687 HG3 LYS 85 3HG LYS 85 6.808 5.062 -1.218 688 HD2 LYS 85 2HD LYS 85 7.108 6.370 -3.000 689 HD3 LYS 85 3HD LYS 85 6.034 5.378 -3.990 690 HE2 LYS 85 2HE LYS 85 5.251 7.705 -3.784 691 HE3 LYS 85 3HE LYS 85 4.101 6.544 -3.123 692 HZ1 LYS 85 3HZ LYS 85 5.907 7.403 -1.118 693 HZ2 LYS 85 1HZ LYS 85 4.220 7.525 -1.157 694 HZ3 LYS 85 2HZ LYS 85 5.172 8.742 -1.845 695 H ILE 86 H ILE 86 9.140 1.000 -2.093 696 HA ILE 86 HA ILE 86 7.409 -1.244 -2.640 697 HB ILE 86 HB ILE 86 10.297 -1.356 -1.779 698 HG12 ILE 86 2HG1 ILE 86 9.184 -1.115 -4.583 699 HG13 ILE 86 3HG1 ILE 86 10.046 0.152 -3.718 700 HG21 ILE 86 1HG2 ILE 86 8.734 -3.417 -1.858 701 HG22 ILE 86 2HG2 ILE 86 8.901 -3.268 -3.607 702 HG23 ILE 86 3HG2 ILE 86 10.329 -3.522 -2.604 703 HD11 ILE 86 3HD1 ILE 86 12.065 -1.112 -3.743 704 HD12 ILE 86 1HD1 ILE 86 11.232 -2.528 -4.384 705 HD13 ILE 86 2HD1 ILE 86 11.413 -1.085 -5.381 706 HA PRO 87 HA PRO 87 6.397 -2.035 1.598 707 HB2 PRO 87 2HB PRO 87 5.321 -4.500 1.229 708 HB3 PRO 87 3HB PRO 87 4.481 -3.009 0.788 709 HG2 PRO 87 2HG PRO 87 6.020 -4.901 -0.948 710 HG3 PRO 87 3HG PRO 87 4.467 -4.104 -1.263 711 HD2 PRO 87 2HD PRO 87 6.801 -3.211 -2.307 712 HD3 PRO 87 3HD PRO 87 5.466 -2.121 -1.880 713 H THR 88 H THR 88 6.993 -3.452 3.314 714 HA THR 88 HA THR 88 9.600 -4.656 2.927 715 HB THR 88 HB THR 88 8.533 -5.075 5.573 716 HG1 THR 88 HG1 THR 88 8.321 -2.456 4.478 717 HG21 THR 88 3HG2 THR 88 10.844 -4.998 5.406 718 HG22 THR 88 1HG2 THR 88 10.470 -3.392 6.031 719 HG23 THR 88 2HG2 THR 88 10.822 -3.611 4.317 720 H VAL 89 H VAL 89 10.023 -6.775 4.124 721 HA VAL 89 HA VAL 89 8.732 -8.866 2.874 722 HB VAL 89 HB VAL 89 10.035 -9.050 5.591 723 HG11 VAL 89 1HG1 VAL 89 9.909 -11.269 5.391 724 HG12 VAL 89 2HG1 VAL 89 8.739 -10.979 4.102 725 HG13 VAL 89 3HG1 VAL 89 10.441 -11.227 3.710 726 HG21 VAL 89 3HG2 VAL 89 11.707 -8.030 4.378 727 HG22 VAL 89 1HG2 VAL 89 12.036 -9.731 4.049 728 HG23 VAL 89 2HG2 VAL 89 11.188 -8.749 2.854 729 H GLU 90 H GLU 90 8.217 -7.725 6.212 730 HA GLU 90 HA GLU 90 6.164 -9.511 6.864 731 HB2 GLU 90 2HB GLU 90 6.964 -6.812 7.903 732 HB3 GLU 90 3HB GLU 90 5.511 -7.598 8.504 733 HG2 GLU 90 2HG GLU 90 6.847 -9.529 9.194 734 HG3 GLU 90 3HG GLU 90 8.301 -8.722 8.611 735 H GLN 91 H GLN 91 5.999 -6.206 5.570 736 HA GLN 91 HA GLN 91 3.226 -5.939 5.524 737 HB2 GLN 91 2HB GLN 91 5.106 -4.786 3.465 738 HB3 GLN 91 3HB GLN 91 3.550 -4.142 3.973 739 HG2 GLN 91 2HG GLN 91 6.134 -4.184 5.493 740 HG3 GLN 91 3HG GLN 91 5.172 -2.793 4.996 741 HE21 GLN 91 1HE2 GLN 91 6.155 -3.809 7.647 742 HE22 GLN 91 2HE2 GLN 91 4.746 -3.837 8.647 743 H TRP 92 H TRP 92 5.364 -7.697 3.426 744 HA TRP 92 HA TRP 92 3.528 -7.989 1.258 745 HB2 TRP 92 2HB TRP 92 5.927 -8.218 0.891 746 HB3 TRP 92 3HB TRP 92 5.987 -9.590 1.994 747 HD1 TRP 92 HD1 TRP 92 3.578 -8.943 -0.985 748 HE1 TRP 92 HE1 TRP 92 3.700 -10.980 -2.552 749 HE3 TRP 92 HE3 TRP 92 7.175 -11.632 1.458 750 HZ2 TRP 92 HZ2 TRP 92 5.131 -13.407 -2.729 751 HZ3 TRP 92 HZ3 TRP 92 7.863 -13.802 0.524 752 HH2 TRP 92 HH2 TRP 92 6.860 -14.670 -1.526 753 H LYS 93 H LYS 93 4.545 -10.105 3.927 754 HA LYS 93 HA LYS 93 2.870 -12.271 3.247 755 HB2 LYS 93 2HB LYS 93 4.217 -11.432 5.804 756 HB3 LYS 93 3HB LYS 93 3.190 -12.858 5.732 757 HG2 LYS 93 2HG LYS 93 4.646 -13.996 4.332 758 HG3 LYS 93 3HG LYS 93 5.451 -12.516 3.805 759 HD2 LYS 93 2HD LYS 93 5.587 -13.592 6.618 760 HD3 LYS 93 3HD LYS 93 6.790 -13.939 5.373 761 HE2 LYS 93 2HE LYS 93 7.728 -11.906 5.548 762 HE3 LYS 93 3HE LYS 93 6.169 -11.094 5.686 763 HZ1 LYS 93 3HZ LYS 93 7.354 -10.799 7.715 764 HZ2 LYS 93 1HZ LYS 93 7.670 -12.456 7.853 765 HZ3 LYS 93 2HZ LYS 93 6.089 -11.880 8.021 766 H ASP 94 H ASP 94 2.407 -9.463 5.335 767 HA ASP 94 HA ASP 94 -0.118 -10.285 6.355 768 HB2 ASP 94 2HB ASP 94 1.471 -8.548 7.351 769 HB3 ASP 94 3HB ASP 94 0.837 -7.432 6.144 770 H GLN 95 H GLN 95 0.876 -8.158 3.702 771 HA GLN 95 HA GLN 95 -1.680 -7.265 2.970 772 HB2 GLN 95 2HB GLN 95 0.955 -7.467 1.574 773 HB3 GLN 95 3HB GLN 95 -0.479 -7.082 0.631 774 HG2 GLN 95 2HG GLN 95 0.221 -5.538 3.098 775 HG3 GLN 95 3HG GLN 95 0.939 -5.155 1.535 776 HE21 GLN 95 1HE2 GLN 95 -1.051 -3.808 3.400 777 HE22 GLN 95 2HE2 GLN 95 -2.349 -3.350 2.355 778 H THR 96 H THR 96 0.227 -10.027 1.819 779 HA THR 96 HA THR 96 -1.694 -10.912 -0.072 780 HB THR 96 HB THR 96 -0.409 -13.130 0.144 781 HG1 THR 96 HG1 THR 96 1.477 -13.056 1.319 782 HG21 THR 96 3HG2 THR 96 0.056 -10.871 -1.311 783 HG22 THR 96 1HG2 THR 96 0.927 -12.390 -1.510 784 HG23 THR 96 2HG2 THR 96 1.611 -11.105 -0.514 785 H ARG 97 H ARG 97 -1.025 -11.768 3.294 786 HA ARG 97 HA ARG 97 -2.814 -13.929 3.481 787 HB2 ARG 97 2HB ARG 97 -1.522 -12.091 5.457 788 HB3 ARG 97 3HB ARG 97 -2.800 -13.171 5.999 789 HG2 ARG 97 2HG ARG 97 -0.425 -14.185 4.477 790 HG3 ARG 97 3HG ARG 97 -0.390 -13.968 6.228 791 HD2 ARG 97 2HD ARG 97 -2.484 -15.394 6.303 792 HD3 ARG 97 3HD ARG 97 -2.164 -15.782 4.613 793 HE ARG 97 HE ARG 97 -0.441 -17.146 5.280 794 HH11 ARG 97 1HH1 ARG 97 -1.463 -15.167 7.955 795 HH12 ARG 97 2HH1 ARG 97 -0.516 -16.027 9.123 796 HH21 ARG 97 1HH2 ARG 97 0.811 -18.287 6.808 797 HH22 ARG 97 2HH2 ARG 97 0.778 -17.801 8.469 798 H ARG 98 H ARG 98 -3.247 -10.460 3.904 799 HA ARG 98 HA ARG 98 -5.997 -10.763 4.756 800 HB2 ARG 98 2HB ARG 98 -6.028 -8.399 5.009 801 HB3 ARG 98 3HB ARG 98 -4.457 -8.943 5.581 802 HG2 ARG 98 2HG ARG 98 -3.414 -8.234 3.525 803 HG3 ARG 98 3HG ARG 98 -4.983 -7.794 2.850 804 HD2 ARG 98 2HD ARG 98 -4.500 -6.538 5.420 805 HD3 ARG 98 3HD ARG 98 -3.256 -6.133 4.238 806 HE ARG 98 HE ARG 98 -5.678 -5.810 2.952 807 HH11 ARG 98 1HH1 ARG 98 -4.061 -4.461 5.725 808 HH12 ARG 98 2HH1 ARG 98 -4.833 -2.917 5.587 809 HH21 ARG 98 1HH2 ARG 98 -6.702 -3.781 2.761 810 HH22 ARG 98 2HH2 ARG 98 -6.336 -2.531 3.901 811 H TYR 99 H TYR 99 -4.252 -10.294 1.817 812 HA TYR 99 HA TYR 99 -6.517 -9.282 0.337 813 HB2 TYR 99 2HB TYR 99 -4.358 -8.523 -0.372 814 HB3 TYR 99 3HB TYR 99 -3.753 -10.171 -0.495 815 HD1 TYR 99 HD2 TYR 99 -6.676 -8.256 -1.842 816 HD2 TYR 99 HD1 TYR 99 -3.442 -10.899 -2.653 817 HE1 TYR 99 HE2 TYR 99 -7.322 -8.308 -4.214 818 HE2 TYR 99 HE1 TYR 99 -4.077 -10.957 -5.028 819 HH TYR 99 HH TYR 99 -5.414 -9.242 -6.618 820 H LYS 100 H LYS 100 -5.159 -12.347 1.135 821 HA LYS 100 HA LYS 100 -6.693 -13.710 -0.951 822 HB2 LYS 100 2HB LYS 100 -4.411 -14.447 0.810 823 HB3 LYS 100 3HB LYS 100 -5.500 -15.737 0.317 824 HG2 LYS 100 2HG LYS 100 -3.589 -15.566 -1.177 825 HG3 LYS 100 3HG LYS 100 -5.096 -15.206 -2.023 826 HD2 LYS 100 2HD LYS 100 -4.623 -12.780 -1.682 827 HD3 LYS 100 3HD LYS 100 -3.050 -13.229 -1.018 828 HE2 LYS 100 2HE LYS 100 -2.562 -12.769 -3.238 829 HE3 LYS 100 3HE LYS 100 -2.746 -14.522 -3.234 830 HZ1 LYS 100 3HZ LYS 100 -5.127 -12.921 -3.781 831 HZ2 LYS 100 1HZ LYS 100 -4.660 -14.418 -4.416 832 HZ3 LYS 100 2HZ LYS 100 -3.950 -12.996 -4.995 833 H GLU 101 H GLU 101 -6.841 -12.904 2.367 834 HA GLU 101 HA GLU 101 -8.267 -14.998 3.484 835 HB2 GLU 101 2HB GLU 101 -8.905 -13.517 5.194 836 HB3 GLU 101 3HB GLU 101 -7.372 -12.884 4.609 837 HG2 GLU 101 2HG GLU 101 -8.876 -11.407 3.085 838 HG3 GLU 101 3HG GLU 101 -10.124 -11.791 4.270 839 H SER 102 H SER 102 -10.661 -14.678 4.237 840 HA SER 102 HA SER 102 -12.868 -14.730 3.686 841 HB2 SER 102 2HB SER 102 -12.259 -12.751 1.490 842 HB3 SER 102 3HB SER 102 -13.769 -12.964 2.375 843 HG SER 102 HG SER 102 -13.017 -11.772 3.947 844 H SER 103 H SER 103 -11.257 -16.710 2.611 845 HA SER 103 HA SER 103 -11.733 -17.041 -0.191 846 HB2 SER 103 2HB SER 103 -10.936 -19.148 1.830 847 HB3 SER 103 3HB SER 103 -10.734 -19.231 0.080 848 HG SER 103 HG SER 103 -8.791 -18.606 0.993 849 H ILE 104 H ILE 104 -12.554 -19.622 -0.502 850 HA ILE 104 HA ILE 104 -15.392 -19.368 -0.080 851 HB ILE 104 HB ILE 104 -13.975 -21.766 -1.228 852 HG12 ILE 104 2HG1 ILE 104 -15.006 -19.472 -2.878 853 HG13 ILE 104 3HG1 ILE 104 -13.357 -19.473 -2.262 854 HG21 ILE 104 1HG2 ILE 104 -16.766 -20.709 -1.254 855 HG22 ILE 104 2HG2 ILE 104 -16.192 -21.689 -2.602 856 HG23 ILE 104 3HG2 ILE 104 -16.188 -22.350 -0.968 857 HD11 ILE 104 3HD1 ILE 104 -14.076 -20.469 -4.649 858 HD12 ILE 104 1HD1 ILE 104 -12.675 -21.022 -3.734 859 HD13 ILE 104 2HD1 ILE 104 -14.190 -21.921 -3.656 860 H GLN 105 H GLN 105 -16.714 -21.076 0.850 861 HA GLN 105 HA GLN 105 -16.116 -21.693 3.455 862 HB2 GLN 105 2HB GLN 105 -18.034 -23.017 3.488 863 HB3 GLN 105 3HB GLN 105 -18.342 -21.907 2.160 864 HG2 GLN 105 2HG GLN 105 -17.388 -23.743 0.655 865 HG3 GLN 105 3HG GLN 105 -17.599 -24.804 2.046 866 HE21 GLN 105 1HE2 GLN 105 -19.112 -26.030 0.882 867 HE22 GLN 105 2HE2 GLN 105 -20.726 -25.469 0.632 868 H ILE 106 H ILE 106 -15.648 -23.731 4.514 869 HA ILE 106 HA ILE 106 -14.279 -25.748 2.919 870 HB ILE 106 HB ILE 106 -12.343 -25.707 4.575 871 HG12 ILE 106 2HG1 ILE 106 -13.744 -23.979 6.005 872 HG13 ILE 106 3HG1 ILE 106 -11.986 -23.903 5.962 873 HG21 ILE 106 1HG2 ILE 106 -11.201 -23.846 3.334 874 HG22 ILE 106 2HG2 ILE 106 -11.968 -25.066 2.319 875 HG23 ILE 106 3HG2 ILE 106 -12.751 -23.506 2.564 876 HD11 ILE 106 3HD1 ILE 106 -13.542 -22.325 3.979 877 HD12 ILE 106 1HD1 ILE 106 -13.437 -21.755 5.645 878 HD13 ILE 106 2HD1 ILE 106 -11.967 -21.997 4.700 879 H GLY 107 H GLY 107 -13.309 -27.443 4.622 880 HA2 GLY 107 2HA GLY 107 -15.469 -28.724 5.802 881 HA3 GLY 107 3HA GLY 107 -13.787 -29.038 6.201 882 H ASN 108 H ASN 108 -12.780 -27.615 7.820 883 HA ASN 108 HA ASN 108 -14.766 -26.746 9.815 884 HB2 ASN 108 2HB ASN 108 -13.245 -27.382 11.548 885 HB3 ASN 108 3HB ASN 108 -13.326 -28.730 10.418 886 HD21 ASN 108 1HD2 ASN 108 -11.264 -27.435 12.347 887 HD22 ASN 108 2HD2 ASN 108 -9.807 -27.473 11.420 888 H GLY 109 H GLY 109 -14.347 -24.858 11.025 889 HA2 GLY 109 2HA GLY 109 -12.052 -23.219 10.354 890 HA3 GLY 109 3HA GLY 109 -13.590 -22.605 9.767 891 H HIS 110 H HIS 110 -14.437 -21.108 11.035 892 HA HIS 110 HA HIS 110 -13.518 -20.414 13.556 893 HB2 HIS 110 2HB HIS 110 -16.091 -19.868 12.105 894 HB3 HIS 110 3HB HIS 110 -15.853 -19.291 13.752 895 HD1 HIS 110 HD1 HIS 110 -15.313 -16.887 13.628 896 HD2 HIS 110 HD2 HIS 110 -13.424 -19.045 10.622 897 HE1 HIS 110 HE1 HIS 110 -13.893 -15.218 12.394 898 H GLY 111 H GLY 111 -14.991 -20.336 15.563 899 HA2 GLY 111 2HA GLY 111 -16.729 -22.615 15.926 900 HA3 GLY 111 3HA GLY 111 -15.189 -22.755 16.760 901 H GLN 112 H GLN 112 -17.477 -22.803 18.221 902 HA GLN 112 HA GLN 112 -18.561 -20.439 19.130 903 HB2 GLN 112 2HB GLN 112 -19.614 -22.285 20.013 904 HB3 GLN 112 3HB GLN 112 -18.102 -23.113 20.364 905 HG2 GLN 112 2HG GLN 112 -17.836 -22.079 22.379 906 HG3 GLN 112 3HG GLN 112 -18.738 -20.646 21.887 907 HE21 GLN 112 1HE2 GLN 112 -20.135 -20.581 23.578 908 HE22 GLN 112 2HE2 GLN 112 -21.330 -21.790 23.886 909 H SER 113 H SER 113 -17.933 -18.810 20.428 910 HA SER 113 HA SER 113 -15.153 -18.843 21.354 911 HB2 SER 113 2HB SER 113 -15.612 -16.332 21.667 912 HB3 SER 113 3HB SER 113 -15.542 -16.939 20.013 913 HG SER 113 HG SER 113 -17.713 -16.001 21.480 914 H GLN 114 H GLN 114 -14.992 -17.173 23.362 915 HA GLN 114 HA GLN 114 -17.053 -17.736 25.338 916 HB2 GLN 114 2HB GLN 114 -15.283 -19.599 25.342 917 HB3 GLN 114 3HB GLN 114 -14.191 -18.389 26.001 918 HG2 GLN 114 2HG GLN 114 -15.590 -18.096 27.929 919 HG3 GLN 114 3HG GLN 114 -16.815 -19.165 27.249 920 HE21 GLN 114 1HE2 GLN 114 -13.975 -18.943 29.089 921 HE22 GLN 114 2HE2 GLN 114 -13.707 -20.633 29.324 922 H GLY 115 H GLY 115 -17.021 -16.335 27.130 923 HA2 GLY 115 2HA GLY 115 -15.316 -13.960 26.726 924 HA3 GLY 115 3HA GLY 115 -16.926 -13.922 27.428 925 H LEU 116 H LEU 116 -13.975 -13.302 28.285 926 HA LEU 116 HA LEU 116 -14.002 -14.789 30.815 927 HB2 LEU 116 2HB LEU 116 -11.772 -13.009 29.917 928 HB3 LEU 116 3HB LEU 116 -11.720 -14.388 31.013 929 HG LEU 116 HG LEU 116 -12.392 -15.681 28.785 930 HD11 LEU 116 1HD1 LEU 116 -10.504 -14.010 27.389 931 HD12 LEU 116 2HD1 LEU 116 -11.957 -13.107 27.815 932 HD13 LEU 116 3HD1 LEU 116 -12.086 -14.593 26.874 933 HD21 LEU 116 3HD2 LEU 116 -9.542 -14.827 29.196 934 HD22 LEU 116 1HD2 LEU 116 -10.158 -16.381 28.635 935 HD23 LEU 116 2HD2 LEU 116 -10.369 -15.905 30.320 936 H GLU 117 H GLU 117 -13.080 -11.497 29.784 937 HA GLU 117 HA GLU 117 -13.608 -10.393 32.360 938 HB2 GLU 117 2HB GLU 117 -11.943 -9.469 30.748 939 HB3 GLU 117 3HB GLU 117 -13.276 -8.942 29.730 940 HG2 GLU 117 2HG GLU 117 -13.258 -8.070 32.566 941 HG3 GLU 117 3HG GLU 117 -12.109 -7.325 31.455 942 H1 GLY -9 H GLY -9 6.834 -13.702 12.254 943 HA2 GLY -9 2HA GLY -9 6.404 -12.970 9.834 944 HA3 GLY -9 3HA GLY -9 8.129 -12.636 9.831 945 H LYS -8 H LYS -8 7.253 -14.303 7.946 946 HA LYS -8 HA LYS -8 7.562 -17.045 8.892 947 HB2 LYS -8 2HB LYS -8 7.061 -16.044 6.084 948 HB3 LYS -8 3HB LYS -8 6.935 -17.707 6.641 949 HG2 LYS -8 2HG LYS -8 5.050 -17.136 8.040 950 HG3 LYS -8 3HG LYS -8 5.210 -15.434 7.603 951 HD2 LYS -8 2HD LYS -8 3.424 -16.496 6.326 952 HD3 LYS -8 3HD LYS -8 4.741 -15.993 5.264 953 HE2 LYS -8 2HE LYS -8 3.849 -18.248 4.740 954 HE3 LYS -8 3HE LYS -8 5.568 -18.245 5.134 955 HZ1 LYS -8 3HZ LYS -8 5.222 -19.563 6.874 956 HZ2 LYS -8 1HZ LYS -8 3.668 -19.837 6.263 957 HZ3 LYS -8 2HZ LYS -8 3.918 -18.645 7.437 958 H PHE -7 H PHE -7 9.122 -14.776 6.653 959 HA PHE -7 HA PHE -7 11.315 -16.604 6.176 960 HB2 PHE -7 2HB PHE -7 10.725 -13.798 5.233 961 HB3 PHE -7 3HB PHE -7 12.223 -14.637 4.843 962 HD1 PHE -7 HD2 PHE -7 8.530 -15.079 4.642 963 HD2 PHE -7 HD1 PHE -7 12.336 -15.898 2.920 964 HE1 PHE -7 HE2 PHE -7 7.427 -16.145 2.719 965 HE2 PHE -7 HE1 PHE -7 11.238 -16.964 0.993 966 HZ PHE -7 HZ PHE -7 8.780 -17.090 0.892 967 H ILE -6 H ILE -6 11.440 -13.159 7.040 968 HA ILE -6 HA ILE -6 12.872 -11.995 8.380 969 HB ILE -6 HB ILE -6 12.695 -14.383 10.213 970 HG12 ILE -6 2HG1 ILE -6 10.441 -13.792 9.521 971 HG13 ILE -6 3HG1 ILE -6 10.702 -13.268 11.181 972 HG21 ILE -6 1HG2 ILE -6 13.879 -11.784 10.417 973 HG22 ILE -6 2HG2 ILE -6 12.586 -11.945 11.604 974 HG23 ILE -6 3HG2 ILE -6 13.905 -13.115 11.574 975 HD11 ILE -6 3HD1 ILE -6 10.355 -11.659 8.711 976 HD12 ILE -6 1HD1 ILE -6 9.661 -11.436 10.317 977 HD13 ILE -6 2HD1 ILE -6 11.345 -11.006 10.016 978 HA PRO -5 HA PRO -5 16.563 -14.401 6.943 979 HB2 PRO -5 2HB PRO -5 17.673 -12.323 5.594 980 HB3 PRO -5 3HB PRO -5 16.476 -13.406 4.874 981 HG2 PRO -5 2HG PRO -5 16.097 -10.682 6.055 982 HG3 PRO -5 3HG PRO -5 15.409 -11.363 4.569 983 HD2 PRO -5 2HD PRO -5 14.009 -11.197 6.881 984 HD3 PRO -5 3HD PRO -5 13.762 -12.505 5.707 985 H SER -4 H SER -4 17.633 -14.581 8.864 986 HA SER -4 HA SER -4 18.702 -12.169 10.126 987 HB2 SER -4 2HB SER -4 17.590 -13.676 11.644 988 HB3 SER -4 3HB SER -4 18.546 -15.040 11.066 989 HG SER -4 HG SER -4 19.730 -14.495 12.738 990 H ARG -3 H ARG -3 19.656 -14.041 7.705 991 HA ARG -3 HA ARG -3 22.168 -15.038 8.252 992 HB2 ARG -3 2HB ARG -3 20.728 -14.146 5.861 993 HB3 ARG -3 3HB ARG -3 22.475 -14.007 5.720 994 HG2 ARG -3 2HG ARG -3 21.644 -16.144 4.871 995 HG3 ARG -3 3HG ARG -3 22.736 -16.356 6.241 996 HD2 ARG -3 2HD ARG -3 20.924 -16.791 7.720 997 HD3 ARG -3 3HD ARG -3 19.739 -16.296 6.512 998 HE ARG -3 HE ARG -3 21.048 -18.854 6.719 999 HH11 ARG -3 1HH1 ARG -3 19.365 -16.640 4.624 1000 HH12 ARG -3 2HH1 ARG -3 18.851 -17.871 3.519 1001 HH21 ARG -3 1HH2 ARG -3 20.377 -20.484 5.271 1002 HH22 ARG -3 2HH2 ARG -3 19.427 -20.058 3.889 1003 HA PRO -2 HA PRO -2 24.920 -11.694 8.950 1004 HB2 PRO -2 2HB PRO -2 27.124 -12.421 7.542 1005 HB3 PRO -2 3HB PRO -2 26.628 -13.229 9.034 1006 HG2 PRO -2 2HG PRO -2 26.193 -14.064 6.192 1007 HG3 PRO -2 3HG PRO -2 26.678 -15.048 7.586 1008 HD2 PRO -2 2HD PRO -2 24.137 -14.997 6.653 1009 HD3 PRO -2 3HD PRO -2 24.519 -15.226 8.372 1010 H ALA -1 H ALA -1 24.040 -12.468 5.693 1011 HA ALA -1 HA ALA -1 23.798 -11.202 3.818 1012 HB1 ALA -1 1HB ALA -1 22.748 -9.642 5.495 1013 HB2 ALA -1 2HB ALA -1 24.291 -8.789 5.546 1014 HB3 ALA -1 3HB ALA -1 23.384 -8.879 4.037 1015 HA PRO 0 HA PRO 0 28.377 -10.969 3.369 1016 HB2 PRO 0 2HB PRO 0 28.436 -12.402 1.064 1017 HB3 PRO 0 3HB PRO 0 28.432 -13.155 2.663 1018 HG2 PRO 0 2HG PRO 0 26.158 -12.735 0.761 1019 HG3 PRO 0 3HG PRO 0 26.553 -14.163 1.736 1020 HD2 PRO 0 2HD PRO 0 24.641 -12.388 2.460 1021 HD3 PRO 0 3HD PRO 0 25.622 -13.272 3.647 1022 H LYS 1 H LYS 1 29.470 -9.487 2.187 1023 HA LYS 1 HA LYS 1 28.003 -7.649 0.574 1024 HB2 LYS 1 2HB LYS 1 30.829 -7.919 1.484 1025 HB3 LYS 1 3HB LYS 1 30.505 -6.876 0.106 1026 HG2 LYS 1 2HG LYS 1 28.744 -5.766 1.586 1027 HG3 LYS 1 3HG LYS 1 29.524 -6.609 2.925 1028 HD2 LYS 1 2HD LYS 1 31.067 -4.892 1.000 1029 HD3 LYS 1 3HD LYS 1 30.293 -4.225 2.439 1030 HE2 LYS 1 2HE LYS 1 32.293 -6.482 2.456 1031 HE3 LYS 1 3HE LYS 1 32.691 -4.792 2.762 1032 HZ1 LYS 1 3HZ LYS 1 30.767 -5.088 4.521 1033 HZ2 LYS 1 1HZ LYS 1 32.371 -5.492 4.879 1034 HZ3 LYS 1 2HZ LYS 1 31.269 -6.702 4.452 1035 HA PRO 2 HA PRO 2 28.576 -9.209 -3.486 1036 HB2 PRO 2 2HB PRO 2 29.092 -6.959 -4.915 1037 HB3 PRO 2 3HB PRO 2 27.494 -7.336 -4.260 1038 HG2 PRO 2 2HG PRO 2 29.604 -5.510 -3.175 1039 HG3 PRO 2 3HG PRO 2 27.852 -5.255 -3.285 1040 HD2 PRO 2 2HD PRO 2 29.076 -6.000 -0.987 1041 HD3 PRO 2 3HD PRO 2 27.426 -6.509 -1.399 1042 HA PRO 3 HA PRO 3 32.796 -9.863 -4.534 1043 HB2 PRO 3 2HB PRO 3 32.735 -9.952 -7.247 1044 HB3 PRO 3 3HB PRO 3 32.073 -11.236 -6.228 1045 HG2 PRO 3 2HG PRO 3 30.651 -8.997 -7.615 1046 HG3 PRO 3 3HG PRO 3 30.190 -10.704 -7.484 1047 HD2 PRO 3 2HD PRO 3 29.098 -8.776 -5.928 1048 HD3 PRO 3 3HD PRO 3 29.338 -10.440 -5.359 1049 H SER 4 H SER 4 33.534 -7.783 -3.747 1050 HA SER 4 HA SER 4 33.819 -5.651 -5.711 1051 HB2 SER 4 2HB SER 4 34.790 -4.372 -3.802 1052 HB3 SER 4 3HB SER 4 33.168 -4.981 -3.472 1053 HG SER 4 HG SER 4 34.883 -5.288 -1.805 1054 H SER 5 H SER 5 36.137 -4.473 -5.244 1055 HA SER 5 HA SER 5 38.055 -6.360 -6.325 1056 HB2 SER 5 2HB SER 5 38.768 -3.515 -5.754 1057 HB3 SER 5 3HB SER 5 39.223 -4.534 -7.120 1058 HG SER 5 HG SER 5 37.738 -3.144 -7.921 1059 H ALA 6 H ALA 6 37.532 -4.512 -3.395 1060 HA ALA 6 HA ALA 6 39.831 -5.899 -2.184 1061 HB1 ALA 6 1HB ALA 6 39.035 -3.228 -1.148 1062 HB2 ALA 6 2HB ALA 6 40.616 -4.012 -1.163 1063 HB3 ALA 6 3HB ALA 6 39.967 -3.306 -2.644 Start of MODEL 8 1 H1 MET -2 H MET -2 1.764 5.367 -0.785 2 HA MET -2 HA MET -2 4.323 4.192 -1.068 3 HB2 MET -2 2HB MET -2 3.267 3.003 0.982 4 HB3 MET -2 3HB MET -2 2.256 2.190 -0.205 5 HG2 MET -2 2HG MET -2 5.204 2.192 -0.594 6 HG3 MET -2 3HG MET -2 4.503 1.132 0.626 7 HE1 MET -2 3HE MET -2 6.212 0.067 -1.289 8 HE2 MET -2 1HE MET -2 5.252 -1.376 -0.961 9 HE3 MET -2 2HE MET -2 5.545 -0.871 -2.626 10 H ALA -1 H ALA -1 4.512 3.823 -3.172 11 HA ALA -1 HA ALA -1 2.074 3.345 -4.742 12 HB1 ALA -1 1HB ALA -1 3.926 3.873 -6.617 13 HB2 ALA -1 2HB ALA -1 2.965 5.118 -5.818 14 HB3 ALA -1 3HB ALA -1 4.602 4.773 -5.259 15 HA PRO 1 HA PRO 1 3.241 -0.723 -5.902 16 HB2 PRO 1 2HB PRO 1 2.522 -0.813 -8.518 17 HB3 PRO 1 3HB PRO 1 1.345 -0.793 -7.199 18 HG2 PRO 1 2HG PRO 1 2.287 1.460 -8.930 19 HG3 PRO 1 3HG PRO 1 0.641 1.071 -8.397 20 HD2 PRO 1 2HD PRO 1 2.136 2.998 -7.220 21 HD3 PRO 1 3HD PRO 1 0.952 2.027 -6.322 22 H LEU 2 H LEU 2 5.125 -1.669 -6.368 23 HA LEU 2 HA LEU 2 6.790 -0.554 -8.515 24 HB2 LEU 2 2HB LEU 2 8.750 -0.614 -7.201 25 HB3 LEU 2 3HB LEU 2 7.531 0.235 -6.253 26 HG LEU 2 HG LEU 2 7.298 -2.386 -5.407 27 HD11 LEU 2 1HD1 LEU 2 10.164 -1.731 -6.013 28 HD12 LEU 2 2HD1 LEU 2 9.258 -3.189 -6.414 29 HD13 LEU 2 3HD1 LEU 2 9.707 -2.863 -4.741 30 HD21 LEU 2 3HD2 LEU 2 8.352 -1.548 -3.350 31 HD22 LEU 2 1HD2 LEU 2 7.168 -0.415 -4.001 32 HD23 LEU 2 2HD2 LEU 2 8.891 -0.113 -4.224 33 H PHE 3 H PHE 3 8.054 -2.028 -9.630 34 HA PHE 3 HA PHE 3 7.724 -4.857 -8.888 35 HB2 PHE 3 2HB PHE 3 7.389 -3.601 -11.614 36 HB3 PHE 3 3HB PHE 3 7.618 -5.331 -11.378 37 HD1 PHE 3 HD2 PHE 3 5.456 -2.554 -10.141 38 HD2 PHE 3 HD1 PHE 3 5.752 -6.657 -11.234 39 HE1 PHE 3 HE2 PHE 3 3.037 -2.821 -9.784 40 HE2 PHE 3 HE1 PHE 3 3.333 -6.930 -10.880 41 HZ PHE 3 HZ PHE 3 1.972 -5.010 -10.152 42 H ALA 4 H ALA 4 9.428 -6.241 -9.426 43 HA ALA 4 HA ALA 4 11.907 -4.897 -10.287 44 HB1 ALA 4 1HB ALA 4 12.275 -5.287 -8.021 45 HB2 ALA 4 2HB ALA 4 11.458 -6.850 -8.059 46 HB3 ALA 4 3HB ALA 4 13.044 -6.666 -8.807 47 H VAL 5 H VAL 5 13.587 -6.517 -11.053 48 HA VAL 5 HA VAL 5 12.346 -8.794 -12.438 49 HB VAL 5 HB VAL 5 12.479 -7.042 -14.097 50 HG11 VAL 5 1HG1 VAL 5 14.508 -5.904 -14.674 51 HG12 VAL 5 2HG1 VAL 5 14.251 -5.728 -12.937 52 HG13 VAL 5 3HG1 VAL 5 15.437 -6.885 -13.542 53 HG21 VAL 5 3HG2 VAL 5 14.701 -9.045 -14.495 54 HG22 VAL 5 1HG2 VAL 5 12.988 -9.333 -14.805 55 HG23 VAL 5 2HG2 VAL 5 13.871 -8.146 -15.766 56 H THR 6 H THR 6 13.475 -10.626 -12.280 57 HA THR 6 HA THR 6 15.869 -10.710 -10.730 58 HB THR 6 HB THR 6 15.800 -13.199 -11.642 59 HG1 THR 6 HG1 THR 6 14.136 -13.524 -12.896 60 HG21 THR 6 3HG2 THR 6 14.247 -11.804 -9.542 61 HG22 THR 6 1HG2 THR 6 15.417 -13.115 -9.403 62 HG23 THR 6 2HG2 THR 6 13.765 -13.459 -9.916 63 H LEU 7 H LEU 7 17.957 -11.146 -11.347 64 HA LEU 7 HA LEU 7 18.493 -11.048 -14.243 65 HB2 LEU 7 2HB LEU 7 20.309 -10.059 -12.055 66 HB3 LEU 7 3HB LEU 7 20.515 -9.849 -13.793 67 HG LEU 7 HG LEU 7 18.106 -8.684 -12.475 68 HD11 LEU 7 1HD1 LEU 7 20.776 -8.066 -11.688 69 HD12 LEU 7 2HD1 LEU 7 19.263 -7.334 -11.155 70 HD13 LEU 7 3HD1 LEU 7 20.102 -6.694 -12.568 71 HD21 LEU 7 3HD2 LEU 7 18.994 -6.878 -14.245 72 HD22 LEU 7 1HD2 LEU 7 17.934 -8.219 -14.680 73 HD23 LEU 7 2HD2 LEU 7 19.672 -8.343 -14.957 74 H TYR 8 H TYR 8 18.884 -12.786 -11.343 75 HA TYR 8 HA TYR 8 20.742 -14.627 -12.692 76 HB2 TYR 8 2HB TYR 8 20.772 -13.967 -9.741 77 HB3 TYR 8 3HB TYR 8 21.858 -15.072 -10.576 78 HD1 TYR 8 HD1 TYR 8 20.884 -11.509 -10.281 79 HD2 TYR 8 HD2 TYR 8 23.809 -14.281 -11.647 80 HE1 TYR 8 HE1 TYR 8 22.439 -9.651 -10.702 81 HE2 TYR 8 HE2 TYR 8 25.372 -12.430 -12.070 82 HH TYR 8 HH TYR 8 24.619 -9.439 -12.457 83 H GLU 9 H GLU 9 20.713 -16.838 -11.636 84 HA GLU 9 HA GLU 9 17.928 -17.624 -11.286 85 HB2 GLU 9 2HB GLU 9 19.073 -18.935 -12.898 86 HB3 GLU 9 3HB GLU 9 20.459 -19.160 -11.840 87 HG2 GLU 9 2HG GLU 9 19.091 -21.181 -12.043 88 HG3 GLU 9 3HG GLU 9 19.175 -20.587 -10.385 89 H PHE 10 H PHE 10 17.151 -17.648 -9.288 90 HA PHE 10 HA PHE 10 18.930 -18.122 -7.029 91 HB2 PHE 10 2HB PHE 10 17.059 -16.290 -7.224 92 HB3 PHE 10 3HB PHE 10 15.994 -17.606 -6.739 93 HD1 PHE 10 HD2 PHE 10 19.406 -16.515 -5.687 94 HD2 PHE 10 HD1 PHE 10 15.411 -17.424 -4.534 95 HE1 PHE 10 HE2 PHE 10 20.000 -16.122 -3.332 96 HE2 PHE 10 HE1 PHE 10 15.999 -17.032 -2.177 97 HZ PHE 10 HZ PHE 10 18.296 -16.381 -1.574 98 H LYS 11 H LYS 11 19.133 -20.043 -6.106 99 HA LYS 11 HA LYS 11 17.156 -22.122 -6.724 100 HB2 LYS 11 2HB LYS 11 20.007 -22.290 -5.743 101 HB3 LYS 11 3HB LYS 11 18.945 -23.685 -5.886 102 HG2 LYS 11 2HG LYS 11 19.071 -23.726 -8.149 103 HG3 LYS 11 3HG LYS 11 19.255 -21.975 -8.283 104 HD2 LYS 11 2HD LYS 11 21.523 -22.055 -8.001 105 HD3 LYS 11 3HD LYS 11 21.457 -23.515 -7.010 106 HE2 LYS 11 2HE LYS 11 21.099 -24.886 -8.934 107 HE3 LYS 11 3HE LYS 11 20.878 -23.475 -9.967 108 HZ1 LYS 11 3HZ LYS 11 23.403 -24.200 -8.581 109 HZ2 LYS 11 1HZ LYS 11 23.182 -22.885 -9.622 110 HZ3 LYS 11 2HZ LYS 11 23.079 -24.464 -10.220 111 H ALA 12 H ALA 12 15.569 -21.984 -5.229 112 HA ALA 12 HA ALA 12 15.884 -21.234 -2.545 113 HB1 ALA 12 1HB ALA 12 13.638 -22.333 -2.238 114 HB2 ALA 12 2HB ALA 12 13.720 -21.106 -3.503 115 HB3 ALA 12 3HB ALA 12 13.733 -22.816 -3.932 116 H GLU 13 H GLU 13 15.698 -22.527 -0.622 117 HA GLU 13 HA GLU 13 16.714 -25.273 -0.957 118 HB2 GLU 13 2HB GLU 13 17.956 -24.946 1.171 119 HB3 GLU 13 3HB GLU 13 18.512 -23.899 -0.128 120 HG2 GLU 13 2HG GLU 13 17.068 -22.094 0.846 121 HG3 GLU 13 3HG GLU 13 16.805 -23.153 2.229 122 H ARG 14 H ARG 14 14.729 -23.067 0.925 123 HA ARG 14 HA ARG 14 13.406 -25.402 2.145 124 HB2 ARG 14 2HB ARG 14 14.011 -22.692 3.315 125 HB3 ARG 14 3HB ARG 14 12.778 -23.746 3.995 126 HG2 ARG 14 2HG ARG 14 15.607 -24.661 3.595 127 HG3 ARG 14 3HG ARG 14 15.086 -23.812 5.052 128 HD2 ARG 14 2HD ARG 14 13.279 -25.570 5.269 129 HD3 ARG 14 3HD ARG 14 14.121 -26.462 4.003 130 HE ARG 14 HE ARG 14 15.736 -27.045 5.525 131 HH11 ARG 14 1HH1 ARG 14 13.765 -24.495 6.843 132 HH12 ARG 14 2HH1 ARG 14 14.449 -24.610 8.431 133 HH21 ARG 14 1HH2 ARG 14 16.644 -27.206 7.612 134 HH22 ARG 14 2HH2 ARG 14 16.087 -26.152 8.867 135 H ASP 15 H ASP 15 11.167 -24.429 3.132 136 HA ASP 15 HA ASP 15 9.559 -23.941 0.847 137 HB2 ASP 15 2HB ASP 15 9.009 -23.990 3.805 138 HB3 ASP 15 3HB ASP 15 7.756 -23.542 2.651 139 H ASP 16 H ASP 16 10.782 -21.895 3.441 140 HA ASP 16 HA ASP 16 9.278 -19.591 2.838 141 HB2 ASP 16 2HB ASP 16 10.825 -18.396 4.235 142 HB3 ASP 16 3HB ASP 16 10.565 -19.983 4.954 143 H GLU 17 H GLU 17 12.255 -20.883 1.526 144 HA GLU 17 HA GLU 17 12.902 -18.499 0.050 145 HB2 GLU 17 2HB GLU 17 14.432 -20.503 0.905 146 HB3 GLU 17 3HB GLU 17 14.058 -21.143 -0.689 147 HG2 GLU 17 2HG GLU 17 16.059 -19.995 -0.979 148 HG3 GLU 17 3HG GLU 17 14.830 -18.890 -1.591 149 H LEU 18 H LEU 18 12.769 -18.200 -2.183 150 HA LEU 18 HA LEU 18 11.021 -20.082 -3.622 151 HB2 LEU 18 2HB LEU 18 10.101 -17.739 -2.799 152 HB3 LEU 18 3HB LEU 18 10.909 -17.181 -4.262 153 HG LEU 18 HG LEU 18 9.534 -18.789 -5.568 154 HD11 LEU 18 1HD1 LEU 18 9.070 -20.028 -3.210 155 HD12 LEU 18 2HD1 LEU 18 8.067 -20.221 -4.648 156 HD13 LEU 18 3HD1 LEU 18 7.588 -19.086 -3.386 157 HD21 LEU 18 3HD2 LEU 18 7.933 -16.849 -3.904 158 HD22 LEU 18 1HD2 LEU 18 7.511 -17.472 -5.499 159 HD23 LEU 18 2HD2 LEU 18 8.910 -16.415 -5.307 160 H ASP 19 H ASP 19 11.954 -20.868 -5.381 161 HA ASP 19 HA ASP 19 14.410 -19.767 -6.382 162 HB2 ASP 19 2HB ASP 19 14.440 -21.660 -7.884 163 HB3 ASP 19 3HB ASP 19 13.949 -22.215 -6.286 164 H VAL 20 H VAL 20 14.793 -18.797 -8.353 165 HA VAL 20 HA VAL 20 12.573 -18.285 -10.160 166 HB VAL 20 HB VAL 20 12.514 -16.447 -8.453 167 HG11 VAL 20 1HG1 VAL 20 15.012 -15.400 -9.738 168 HG12 VAL 20 2HG1 VAL 20 14.229 -14.880 -8.244 169 HG13 VAL 20 3HG1 VAL 20 15.081 -16.424 -8.304 170 HG21 VAL 20 3HG2 VAL 20 13.257 -15.123 -10.994 171 HG22 VAL 20 1HG2 VAL 20 11.994 -16.351 -11.070 172 HG23 VAL 20 2HG2 VAL 20 11.804 -14.955 -10.009 173 H SER 21 H SER 21 13.236 -17.448 -12.212 174 HA SER 21 HA SER 21 16.061 -18.022 -12.790 175 HB2 SER 21 2HB SER 21 13.576 -18.155 -14.495 176 HB3 SER 21 3HB SER 21 15.194 -18.192 -15.195 177 HG SER 21 HG SER 21 15.615 -20.068 -14.033 178 HA PRO 22 HA PRO 22 16.922 -13.871 -13.922 179 HB2 PRO 22 2HB PRO 22 18.650 -14.218 -15.986 180 HB3 PRO 22 3HB PRO 22 19.085 -14.544 -14.304 181 HG2 PRO 22 2HG PRO 22 18.249 -16.457 -16.450 182 HG3 PRO 22 3HG PRO 22 19.547 -16.617 -15.252 183 HD2 PRO 22 2HD PRO 22 17.143 -17.829 -14.965 184 HD3 PRO 22 3HD PRO 22 18.096 -17.259 -13.580 185 H GLY 23 H GLY 23 16.076 -12.293 -15.180 186 HA2 GLY 23 2HA GLY 23 15.303 -11.322 -17.186 187 HA3 GLY 23 3HA GLY 23 15.180 -12.928 -17.889 188 H GLU 24 H GLU 24 13.835 -13.327 -14.979 189 HA GLU 24 HA GLU 24 11.148 -13.061 -16.058 190 HB2 GLU 24 2HB GLU 24 12.290 -14.410 -13.622 191 HB3 GLU 24 3HB GLU 24 10.556 -14.212 -13.839 192 HG2 GLU 24 2HG GLU 24 12.208 -15.482 -15.978 193 HG3 GLU 24 3HG GLU 24 11.693 -16.412 -14.572 194 H ASN 25 H ASN 25 9.498 -11.865 -15.114 195 HA ASN 25 HA ASN 25 10.405 -9.561 -13.588 196 HB2 ASN 25 2HB ASN 25 7.852 -10.225 -15.044 197 HB3 ASN 25 3HB ASN 25 7.970 -8.828 -13.979 198 HD21 ASN 25 1HD2 ASN 25 8.170 -7.067 -15.146 199 HD22 ASN 25 2HD2 ASN 25 9.182 -6.872 -16.532 200 H LEU 26 H LEU 26 10.191 -9.400 -11.460 201 HA LEU 26 HA LEU 26 8.243 -11.150 -10.110 202 HB2 LEU 26 2HB LEU 26 10.945 -10.171 -9.221 203 HB3 LEU 26 3HB LEU 26 9.777 -10.896 -8.117 204 HG LEU 26 HG LEU 26 11.330 -12.589 -8.680 205 HD11 LEU 26 1HD1 LEU 26 8.915 -13.010 -10.432 206 HD12 LEU 26 2HD1 LEU 26 8.951 -13.251 -8.686 207 HD13 LEU 26 3HD1 LEU 26 9.949 -14.258 -9.735 208 HD21 LEU 26 3HD2 LEU 26 12.168 -11.384 -10.732 209 HD22 LEU 26 1HD2 LEU 26 10.816 -12.106 -11.605 210 HD23 LEU 26 2HD2 LEU 26 12.042 -13.139 -10.870 211 H SER 27 H SER 27 7.001 -10.307 -8.445 212 HA SER 27 HA SER 27 6.838 -7.378 -8.413 213 HB2 SER 27 2HB SER 27 4.837 -8.981 -8.941 214 HB3 SER 27 3HB SER 27 4.767 -9.171 -7.189 215 HG SER 27 HG SER 27 4.928 -6.581 -8.218 216 H ILE 28 H ILE 28 7.876 -6.423 -6.800 217 HA ILE 28 HA ILE 28 8.533 -7.812 -4.370 218 HB ILE 28 HB ILE 28 8.933 -4.919 -5.140 219 HG12 ILE 28 2HG1 ILE 28 10.820 -7.284 -5.127 220 HG13 ILE 28 3HG1 ILE 28 10.193 -6.461 -6.551 221 HG21 ILE 28 1HG2 ILE 28 8.851 -5.188 -2.721 222 HG22 ILE 28 2HG2 ILE 28 10.056 -6.472 -2.812 223 HG23 ILE 28 3HG2 ILE 28 10.491 -4.821 -3.256 224 HD11 ILE 28 3HD1 ILE 28 11.999 -5.249 -4.472 225 HD12 ILE 28 1HD1 ILE 28 12.485 -5.809 -6.072 226 HD13 ILE 28 2HD1 ILE 28 11.386 -4.439 -5.913 227 H CYS 29 H CYS 29 7.773 -7.418 -2.308 228 HA CYS 29 HA CYS 29 5.304 -5.818 -2.147 229 HB2 CYS 29 2HB CYS 29 5.967 -8.230 -0.453 230 HB3 CYS 29 3HB CYS 29 4.431 -7.378 -0.542 231 HG CYS 29 HG CYS 29 4.982 -10.061 -1.979 232 H ALA 30 H ALA 30 8.182 -6.907 -0.405 233 HA ALA 30 HA ALA 30 8.334 -4.382 0.983 234 HB1 ALA 30 1HB ALA 30 6.851 -5.403 2.513 235 HB2 ALA 30 2HB ALA 30 7.739 -6.927 2.472 236 HB3 ALA 30 3HB ALA 30 8.454 -5.511 3.242 237 H HIS 31 H HIS 31 10.256 -4.519 2.628 238 HA HIS 31 HA HIS 31 12.383 -6.188 1.462 239 HB2 HIS 31 2HB HIS 31 13.908 -4.395 1.437 240 HB3 HIS 31 3HB HIS 31 12.418 -3.711 0.793 241 HD1 HIS 31 HD1 HIS 31 15.013 -2.870 3.018 242 HD2 HIS 31 HD2 HIS 31 10.879 -2.469 3.140 243 HE1 HIS 31 HE1 HIS 31 14.561 -1.076 4.722 244 H TYR 32 H TYR 32 14.430 -5.938 3.002 245 HA TYR 32 HA TYR 32 13.697 -5.865 5.809 246 HB2 TYR 32 2HB TYR 32 13.222 -8.208 4.942 247 HB3 TYR 32 3HB TYR 32 14.957 -8.371 4.695 248 HD1 TYR 32 HD2 TYR 32 12.302 -8.020 7.220 249 HD2 TYR 32 HD1 TYR 32 16.450 -8.690 6.547 250 HE1 TYR 32 HE2 TYR 32 12.564 -8.715 9.564 251 HE2 TYR 32 HE1 TYR 32 16.723 -9.387 8.890 252 HH TYR 32 HH TYR 32 13.945 -9.554 11.093 253 H ASP 33 H ASP 33 15.189 -4.467 6.491 254 HA ASP 33 HA ASP 33 17.199 -3.501 6.942 255 HB2 ASP 33 2HB ASP 33 17.831 -6.402 6.715 256 HB3 ASP 33 3HB ASP 33 19.183 -5.274 6.760 257 H TYR 34 H TYR 34 16.203 -3.836 4.086 258 HA TYR 34 HA TYR 34 16.857 -3.242 1.991 259 HB2 TYR 34 2HB TYR 34 19.300 -2.084 3.341 260 HB3 TYR 34 3HB TYR 34 18.632 -1.623 1.780 261 HD1 TYR 34 HD2 TYR 34 18.063 -1.514 5.429 262 HD2 TYR 34 HD1 TYR 34 16.849 -0.057 1.620 263 HE1 TYR 34 HE2 TYR 34 16.701 0.212 6.530 264 HE2 TYR 34 HE1 TYR 34 15.484 1.674 2.711 265 HH TYR 34 HH TYR 34 15.447 2.871 4.915 266 H GLU 35 H GLU 35 17.856 -5.774 3.305 267 HA GLU 35 HA GLU 35 20.101 -6.292 1.467 268 HB2 GLU 35 2HB GLU 35 20.437 -8.279 3.189 269 HB3 GLU 35 3HB GLU 35 21.122 -6.685 3.476 270 HG2 GLU 35 2HG GLU 35 19.185 -6.130 4.884 271 HG3 GLU 35 3HG GLU 35 18.561 -7.759 4.635 272 H TRP 36 H TRP 36 16.969 -7.250 2.563 273 HA TRP 36 HA TRP 36 16.947 -9.380 0.533 274 HB2 TRP 36 2HB TRP 36 15.643 -9.507 3.261 275 HB3 TRP 36 3HB TRP 36 15.485 -10.722 1.996 276 HD1 TRP 36 HD1 TRP 36 17.791 -9.578 4.759 277 HE1 TRP 36 HE1 TRP 36 19.771 -11.212 4.948 278 HE3 TRP 36 HE3 TRP 36 17.004 -12.304 0.506 279 HZ2 TRP 36 HZ2 TRP 36 20.856 -13.370 3.487 280 HZ3 TRP 36 HZ3 TRP 36 18.559 -14.135 -0.026 281 HH2 TRP 36 HH2 TRP 36 20.445 -14.655 1.435 282 H PHE 37 H PHE 37 15.220 -9.405 -0.801 283 HA PHE 37 HA PHE 37 13.061 -7.480 -0.237 284 HB2 PHE 37 2HB PHE 37 14.757 -7.832 -2.581 285 HB3 PHE 37 3HB PHE 37 13.044 -7.886 -2.984 286 HD1 PHE 37 HD2 PHE 37 11.689 -5.981 -1.526 287 HD2 PHE 37 HD1 PHE 37 15.720 -5.785 -2.877 288 HE1 PHE 37 HE2 PHE 37 11.592 -3.524 -1.445 289 HE2 PHE 37 HE1 PHE 37 15.631 -3.327 -2.797 290 HZ PHE 37 HZ PHE 37 13.565 -2.194 -2.081 291 H ILE 38 H ILE 38 10.977 -8.135 -0.483 292 HA ILE 38 HA ILE 38 10.559 -11.001 -0.848 293 HB ILE 38 HB ILE 38 8.478 -8.973 -0.051 294 HG12 ILE 38 2HG1 ILE 38 10.390 -8.814 1.492 295 HG13 ILE 38 3HG1 ILE 38 8.982 -9.516 2.282 296 HG21 ILE 38 1HG2 ILE 38 7.347 -10.887 0.917 297 HG22 ILE 38 2HG2 ILE 38 7.688 -11.181 -0.788 298 HG23 ILE 38 3HG2 ILE 38 8.685 -11.938 0.454 299 HD11 ILE 38 3HD1 ILE 38 10.050 -11.416 2.719 300 HD12 ILE 38 1HD1 ILE 38 10.739 -11.508 1.099 301 HD13 ILE 38 2HD1 ILE 38 11.522 -10.524 2.336 302 H ALA 39 H ALA 39 10.636 -11.317 -3.049 303 HA ALA 39 HA ALA 39 8.659 -9.853 -4.668 304 HB1 ALA 39 1HB ALA 39 10.200 -9.660 -6.254 305 HB2 ALA 39 2HB ALA 39 11.374 -10.346 -5.131 306 HB3 ALA 39 3HB ALA 39 10.500 -11.399 -6.244 307 H LYS 40 H LYS 40 7.319 -10.997 -6.101 308 HA LYS 40 HA LYS 40 7.144 -13.896 -5.606 309 HB2 LYS 40 2HB LYS 40 4.616 -13.505 -6.030 310 HB3 LYS 40 3HB LYS 40 5.284 -13.110 -4.452 311 HG2 LYS 40 2HG LYS 40 5.332 -10.774 -4.991 312 HG3 LYS 40 3HG LYS 40 4.851 -11.107 -6.656 313 HD2 LYS 40 2HD LYS 40 2.790 -12.248 -5.516 314 HD3 LYS 40 3HD LYS 40 3.231 -11.222 -4.149 315 HE2 LYS 40 2HE LYS 40 1.700 -9.927 -5.333 316 HE3 LYS 40 3HE LYS 40 3.263 -9.308 -5.864 317 HZ1 LYS 40 3HZ LYS 40 3.056 -10.305 -7.919 318 HZ2 LYS 40 1HZ LYS 40 1.464 -9.826 -7.608 319 HZ3 LYS 40 2HZ LYS 40 1.919 -11.440 -7.389 320 HA PRO 41 HA PRO 41 7.126 -14.520 -9.950 321 HB2 PRO 41 2HB PRO 41 5.415 -16.612 -10.211 322 HB3 PRO 41 3HB PRO 41 7.034 -16.776 -9.521 323 HG2 PRO 41 2HG PRO 41 4.396 -16.536 -8.126 324 HG3 PRO 41 3HG PRO 41 5.759 -17.611 -7.765 325 HD2 PRO 41 2HD PRO 41 5.293 -15.334 -6.376 326 HD3 PRO 41 3HD PRO 41 6.929 -15.964 -6.656 327 H ILE 42 H ILE 42 5.948 -14.189 -11.862 328 HA ILE 42 HA ILE 42 3.236 -13.098 -11.478 329 HB ILE 42 HB ILE 42 5.189 -12.201 -13.595 330 HG12 ILE 42 2HG1 ILE 42 4.507 -10.863 -10.968 331 HG13 ILE 42 3HG1 ILE 42 6.038 -11.643 -11.347 332 HG21 ILE 42 1HG2 ILE 42 3.427 -11.173 -14.465 333 HG22 ILE 42 2HG2 ILE 42 2.400 -11.794 -13.174 334 HG23 ILE 42 3HG2 ILE 42 3.239 -10.256 -12.971 335 HD11 ILE 42 3HD1 ILE 42 5.792 -9.873 -13.399 336 HD12 ILE 42 1HD1 ILE 42 5.048 -8.995 -12.063 337 HD13 ILE 42 2HD1 ILE 42 6.701 -9.593 -11.913 338 H ASN 43 H ASN 43 5.073 -15.488 -12.932 339 HA ASN 43 HA ASN 43 3.005 -15.948 -14.981 340 HB2 ASN 43 2HB ASN 43 5.964 -16.244 -15.053 341 HB3 ASN 43 3HB ASN 43 5.014 -17.450 -15.917 342 HD21 ASN 43 1HD2 ASN 43 6.821 -15.304 -16.856 343 HD22 ASN 43 2HD2 ASN 43 5.885 -14.383 -17.980 344 H ARG 43 H ARG 43 5.314 -17.594 -12.832 345 HA ARG 43 HA ARG 43 4.421 -20.189 -13.096 346 HB2 ARG 43 2HB ARG 43 5.289 -18.955 -10.480 347 HB3 ARG 43 3HB ARG 43 5.424 -20.641 -10.962 348 HG2 ARG 43 2HG ARG 43 6.886 -19.634 -12.899 349 HG3 ARG 43 3HG ARG 43 7.074 -18.301 -11.757 350 HD2 ARG 43 2HD ARG 43 7.418 -20.944 -10.557 351 HD3 ARG 43 3HD ARG 43 8.597 -20.578 -11.817 352 HE ARG 43 HE ARG 43 9.500 -18.933 -10.470 353 HH11 ARG 43 1HH1 ARG 43 6.555 -20.157 -9.074 354 HH12 ARG 43 2HH1 ARG 43 6.808 -19.387 -7.543 355 HH21 ARG 43 1HH2 ARG 43 9.844 -17.915 -8.458 356 HH22 ARG 43 2HH2 ARG 43 8.678 -18.112 -7.194 357 H LEU 44 H LEU 44 3.539 -18.156 -10.304 358 HA LEU 44 HA LEU 44 0.752 -18.914 -10.568 359 HB2 LEU 44 2HB LEU 44 2.516 -19.841 -8.330 360 HB3 LEU 44 3HB LEU 44 0.787 -19.605 -8.083 361 HG LEU 44 HG LEU 44 0.620 -21.203 -10.178 362 HD11 LEU 44 1HD1 LEU 44 2.446 -22.322 -10.773 363 HD12 LEU 44 2HD1 LEU 44 2.849 -22.697 -9.098 364 HD13 LEU 44 3HD1 LEU 44 3.368 -21.169 -9.808 365 HD21 LEU 44 3HD2 LEU 44 0.141 -21.450 -7.530 366 HD22 LEU 44 1HD2 LEU 44 1.353 -22.710 -7.760 367 HD23 LEU 44 2HD2 LEU 44 -0.134 -22.734 -8.709 368 H GLY 45 H GLY 45 2.662 -17.813 -7.777 369 HA2 GLY 45 2HA GLY 45 2.675 -15.208 -7.703 370 HA3 GLY 45 3HA GLY 45 0.934 -15.443 -7.639 371 H GLY 46 H GLY 46 3.886 -16.615 -6.010 372 HA2 GLY 46 2HA GLY 46 2.399 -16.400 -3.463 373 HA3 GLY 46 3HA GLY 46 3.540 -17.697 -3.790 374 HA PRO 47 HA PRO 47 5.538 -13.760 -1.913 375 HB2 PRO 47 2HB PRO 47 5.513 -14.426 0.718 376 HB3 PRO 47 3HB PRO 47 4.222 -13.495 -0.049 377 HG2 PRO 47 2HG PRO 47 4.324 -16.416 0.599 378 HG3 PRO 47 3HG PRO 47 2.988 -15.269 0.810 379 HD2 PRO 47 2HD PRO 47 3.109 -16.998 -1.271 380 HD3 PRO 47 3HD PRO 47 2.367 -15.391 -1.406 381 H GLY 48 H GLY 48 7.602 -14.129 -2.472 382 HA2 GLY 48 2HA GLY 48 8.982 -16.406 -1.187 383 HA3 GLY 48 3HA GLY 48 9.320 -15.893 -2.834 384 H LEU 49 H LEU 49 11.336 -16.133 -0.958 385 HA LEU 49 HA LEU 49 11.975 -13.345 -0.267 386 HB2 LEU 49 2HB LEU 49 11.982 -15.453 1.384 387 HB3 LEU 49 3HB LEU 49 13.631 -15.566 0.771 388 HG LEU 49 HG LEU 49 12.607 -12.990 1.907 389 HD11 LEU 49 1HD1 LEU 49 14.110 -14.743 3.723 390 HD12 LEU 49 2HD1 LEU 49 12.452 -15.245 3.393 391 HD13 LEU 49 3HD1 LEU 49 12.773 -13.640 4.050 392 HD21 LEU 49 3HD2 LEU 49 14.744 -13.049 0.674 393 HD22 LEU 49 1HD2 LEU 49 15.350 -14.243 1.822 394 HD23 LEU 49 2HD2 LEU 49 14.949 -12.615 2.372 395 H VAL 50 H VAL 50 13.478 -12.334 -1.416 396 HA VAL 50 HA VAL 50 15.647 -13.863 -2.643 397 HB VAL 50 HB VAL 50 13.986 -13.714 -4.413 398 HG11 VAL 50 1HG1 VAL 50 14.161 -10.717 -4.186 399 HG12 VAL 50 2HG1 VAL 50 13.091 -11.665 -5.221 400 HG13 VAL 50 3HG1 VAL 50 12.862 -11.672 -3.472 401 HG21 VAL 50 3HG2 VAL 50 16.279 -13.598 -5.112 402 HG22 VAL 50 1HG2 VAL 50 15.339 -12.478 -6.098 403 HG23 VAL 50 2HG2 VAL 50 16.341 -11.867 -4.782 404 HA PRO 51 HA PRO 51 17.934 -10.427 -1.052 405 HB2 PRO 51 2HB PRO 51 20.298 -10.994 -2.260 406 HB3 PRO 51 3HB PRO 51 19.692 -11.894 -0.865 407 HG2 PRO 51 2HG PRO 51 19.580 -12.604 -3.771 408 HG3 PRO 51 3HG PRO 51 19.968 -13.635 -2.381 409 HD2 PRO 51 2HD PRO 51 17.532 -13.641 -3.564 410 HD3 PRO 51 3HD PRO 51 17.752 -13.939 -1.827 411 H VAL 52 H VAL 52 18.772 -8.445 -1.737 412 HA VAL 52 HA VAL 52 17.743 -7.413 -4.153 413 HB VAL 52 HB VAL 52 19.955 -6.155 -2.536 414 HG11 VAL 52 1HG1 VAL 52 18.513 -5.353 -4.828 415 HG12 VAL 52 2HG1 VAL 52 17.964 -4.348 -3.486 416 HG13 VAL 52 3HG1 VAL 52 19.679 -4.420 -3.891 417 HG21 VAL 52 3HG2 VAL 52 18.546 -6.292 -0.793 418 HG22 VAL 52 1HG2 VAL 52 17.663 -5.007 -1.617 419 HG23 VAL 52 2HG2 VAL 52 17.164 -6.686 -1.815 420 H SER 53 H SER 53 20.670 -9.043 -3.407 421 HA SER 53 HA SER 53 22.186 -7.990 -5.616 422 HB2 SER 53 2HB SER 53 22.756 -10.478 -3.993 423 HB3 SER 53 3HB SER 53 23.901 -9.551 -4.962 424 HG SER 53 HG SER 53 23.187 -9.185 -2.410 425 H TYR 54 H TYR 54 19.580 -9.935 -5.533 426 HA TYR 54 HA TYR 54 20.417 -11.373 -7.963 427 HB2 TYR 54 2HB TYR 54 18.890 -12.390 -5.586 428 HB3 TYR 54 3HB TYR 54 18.652 -13.115 -7.172 429 HD1 TYR 54 HD1 TYR 54 21.352 -12.238 -4.752 430 HD2 TYR 54 HD2 TYR 54 20.055 -14.831 -7.867 431 HE1 TYR 54 HE1 TYR 54 23.337 -13.646 -4.399 432 HE2 TYR 54 HE2 TYR 54 22.036 -16.247 -7.521 433 HH TYR 54 HH TYR 54 24.660 -15.271 -5.487 434 H VAL 55 H VAL 55 18.873 -8.818 -7.289 435 HA VAL 55 HA VAL 55 16.798 -9.238 -9.274 436 HB VAL 55 HB VAL 55 15.058 -8.135 -7.862 437 HG11 VAL 55 1HG1 VAL 55 16.114 -10.769 -6.836 438 HG12 VAL 55 2HG1 VAL 55 14.479 -10.151 -6.596 439 HG13 VAL 55 3HG1 VAL 55 15.043 -10.546 -8.219 440 HG21 VAL 55 3HG2 VAL 55 16.314 -7.053 -6.181 441 HG22 VAL 55 1HG2 VAL 55 15.431 -8.342 -5.363 442 HG23 VAL 55 2HG2 VAL 55 17.143 -8.544 -5.733 443 H ARG 56 H ARG 56 15.833 -7.205 -10.009 444 HA ARG 56 HA ARG 56 17.570 -4.885 -9.477 445 HB2 ARG 56 2HB ARG 56 18.174 -5.587 -11.646 446 HB3 ARG 56 3HB ARG 56 16.508 -5.938 -12.087 447 HG2 ARG 56 2HG ARG 56 15.976 -3.657 -12.313 448 HG3 ARG 56 3HG ARG 56 17.454 -3.153 -11.490 449 HD2 ARG 56 2HD ARG 56 17.537 -2.841 -13.948 450 HD3 ARG 56 3HD ARG 56 18.801 -3.906 -13.332 451 HE ARG 56 HE ARG 56 16.876 -5.646 -14.030 452 HH11 ARG 56 1HH1 ARG 56 18.340 -2.973 -15.713 453 HH12 ARG 56 2HH1 ARG 56 18.128 -3.676 -17.283 454 HH21 ARG 56 1HH2 ARG 56 16.591 -6.582 -16.090 455 HH22 ARG 56 2HH2 ARG 56 17.132 -5.729 -17.496 456 H ILE 57 H ILE 57 16.563 -3.069 -8.889 457 HA ILE 57 HA ILE 57 13.686 -3.069 -8.653 458 HB ILE 57 HB ILE 57 15.691 -0.930 -7.926 459 HG12 ILE 57 2HG1 ILE 57 15.963 -3.040 -6.664 460 HG13 ILE 57 3HG1 ILE 57 15.417 -1.719 -5.636 461 HG21 ILE 57 1HG2 ILE 57 13.723 -0.213 -6.427 462 HG22 ILE 57 2HG2 ILE 57 13.671 0.201 -8.140 463 HG23 ILE 57 3HG2 ILE 57 12.731 -1.162 -7.534 464 HD11 ILE 57 3HD1 ILE 57 13.746 -2.987 -4.954 465 HD12 ILE 57 1HD1 ILE 57 13.111 -3.014 -6.599 466 HD13 ILE 57 2HD1 ILE 57 14.231 -4.267 -6.065 467 H ILE 58 H ILE 58 12.464 -2.553 -10.340 468 HA ILE 58 HA ILE 58 13.248 -0.235 -11.974 469 HB ILE 58 HB ILE 58 12.125 -1.405 -13.920 470 HG12 ILE 58 2HG1 ILE 58 12.654 -3.913 -12.330 471 HG13 ILE 58 3HG1 ILE 58 11.069 -3.148 -12.373 472 HG21 ILE 58 1HG2 ILE 58 14.396 -3.136 -13.451 473 HG22 ILE 58 2HG2 ILE 58 14.190 -1.840 -14.628 474 HG23 ILE 58 3HG2 ILE 58 14.739 -1.468 -12.994 475 HD11 ILE 58 3HD1 ILE 58 12.460 -4.740 -14.407 476 HD12 ILE 58 1HD1 ILE 58 10.736 -4.553 -14.085 477 HD13 ILE 58 2HD1 ILE 58 11.600 -3.323 -15.009 478 H ASP 59 H ASP 59 11.182 0.240 -13.493 479 HA ASP 59 HA ASP 59 8.802 0.227 -11.762 480 HB2 ASP 59 2HB ASP 59 10.042 2.439 -11.764 481 HB3 ASP 59 3HB ASP 59 9.619 2.580 -13.468 482 H LEU 60 H LEU 60 6.987 -0.423 -12.731 483 HA LEU 60 HA LEU 60 6.946 -1.553 -15.265 484 HB2 LEU 60 2HB LEU 60 4.869 -0.692 -13.322 485 HB3 LEU 60 3HB LEU 60 4.354 -1.085 -14.962 486 HG LEU 60 HG LEU 60 5.807 -2.945 -13.080 487 HD11 LEU 60 1HD1 LEU 60 2.968 -3.135 -14.049 488 HD12 LEU 60 2HD1 LEU 60 3.412 -2.367 -12.525 489 HD13 LEU 60 3HD1 LEU 60 3.758 -4.076 -12.784 490 HD21 LEU 60 3HD2 LEU 60 6.407 -3.478 -15.327 491 HD22 LEU 60 1HD2 LEU 60 4.738 -3.315 -15.872 492 HD23 LEU 60 2HD2 LEU 60 5.191 -4.647 -14.808 493 H MET 61 H MET 61 6.500 1.743 -14.293 494 HA MET 61 HA MET 61 5.419 2.516 -16.887 495 HB2 MET 61 2HB MET 61 5.994 4.062 -14.361 496 HB3 MET 61 3HB MET 61 5.463 4.830 -15.851 497 HG2 MET 61 2HG MET 61 3.452 4.579 -14.850 498 HG3 MET 61 3HG MET 61 3.544 3.019 -15.664 499 HE1 MET 61 3HE MET 61 2.023 1.478 -14.120 500 HE2 MET 61 1HE MET 61 3.586 0.840 -14.633 501 HE3 MET 61 2HE MET 61 3.030 0.586 -12.979 502 H ASP 62 H ASP 62 8.399 2.620 -15.074 503 HA ASP 62 HA ASP 62 9.776 3.577 -17.471 504 HB2 ASP 62 2HB ASP 62 10.581 4.675 -14.795 505 HB3 ASP 62 3HB ASP 62 10.937 5.301 -16.402 506 HA PRO 63 HA PRO 63 11.792 -0.109 -15.497 507 HB2 PRO 63 2HB PRO 63 12.090 -1.481 -17.820 508 HB3 PRO 63 3HB PRO 63 10.620 -1.558 -16.840 509 HG2 PRO 63 2HG PRO 63 11.177 0.062 -19.296 510 HG3 PRO 63 3HG PRO 63 9.721 -0.854 -18.866 511 HD2 PRO 63 2HD PRO 63 9.895 1.832 -18.568 512 HD3 PRO 63 3HD PRO 63 8.931 0.811 -17.481 513 H ALA 64 H ALA 64 12.559 2.186 -17.923 514 HA ALA 64 HA ALA 64 15.339 1.292 -18.113 515 HB1 ALA 64 1HB ALA 64 13.947 3.526 -19.585 516 HB2 ALA 64 2HB ALA 64 15.567 2.906 -19.906 517 HB3 ALA 64 3HB ALA 64 14.159 1.882 -20.189 518 H LYS 65 H LYS 65 13.399 3.506 -16.413 519 HA LYS 65 HA LYS 65 15.367 5.538 -15.988 520 HB2 LYS 65 2HB LYS 65 12.801 5.715 -15.763 521 HB3 LYS 65 3HB LYS 65 13.030 5.004 -14.171 522 HG2 LYS 65 2HG LYS 65 14.685 6.895 -13.749 523 HG3 LYS 65 3HG LYS 65 14.007 7.648 -15.195 524 HD2 LYS 65 2HD LYS 65 12.370 6.766 -12.820 525 HD3 LYS 65 3HD LYS 65 12.972 8.409 -13.051 526 HE2 LYS 65 2HE LYS 65 11.786 8.003 -15.433 527 HE3 LYS 65 3HE LYS 65 10.781 6.973 -14.415 528 HZ1 LYS 65 3HZ LYS 65 10.128 8.774 -13.114 529 HZ2 LYS 65 1HZ LYS 65 10.095 9.391 -14.689 530 HZ3 LYS 65 2HZ LYS 65 11.385 9.766 -13.661 531 H TYR 66 H TYR 66 14.059 2.933 -13.938 532 HA TYR 66 HA TYR 66 16.268 3.318 -12.064 533 HB2 TYR 66 2HB TYR 66 13.720 1.708 -11.928 534 HB3 TYR 66 3HB TYR 66 14.987 1.584 -10.713 535 HD1 TYR 66 HD1 TYR 66 12.568 3.917 -12.271 536 HD2 TYR 66 HD2 TYR 66 15.190 3.200 -8.998 537 HE1 TYR 66 HE1 TYR 66 11.614 5.852 -11.091 538 HE2 TYR 66 HE2 TYR 66 14.242 5.132 -7.808 539 HH TYR 66 HH TYR 66 12.740 7.498 -9.046 540 H ALA 67 H ALA 67 16.495 2.082 -14.796 541 HA ALA 67 HA ALA 67 17.154 -0.687 -14.229 542 HB1 ALA 67 1HB ALA 67 18.027 0.277 -16.815 543 HB2 ALA 67 2HB ALA 67 16.879 -1.002 -16.415 544 HB3 ALA 67 3HB ALA 67 16.337 0.674 -16.503 545 H SER 68 H SER 68 18.720 2.352 -14.256 546 HA SER 68 HA SER 68 21.374 1.165 -14.561 547 HB2 SER 68 2HB SER 68 22.063 3.652 -14.311 548 HB3 SER 68 3HB SER 68 21.250 3.155 -15.795 549 HG SER 68 HG SER 68 19.998 4.352 -13.544 550 H VAL 69 H VAL 69 19.200 2.265 -12.145 551 HA VAL 69 HA VAL 69 20.837 3.103 -10.091 552 HB VAL 69 HB VAL 69 18.338 3.050 -10.033 553 HG11 VAL 69 1HG1 VAL 69 18.498 0.465 -10.667 554 HG12 VAL 69 2HG1 VAL 69 18.385 0.309 -8.913 555 HG13 VAL 69 3HG1 VAL 69 17.118 1.149 -9.808 556 HG21 VAL 69 3HG2 VAL 69 18.557 3.457 -7.858 557 HG22 VAL 69 1HG2 VAL 69 18.825 1.746 -7.520 558 HG23 VAL 69 2HG2 VAL 69 20.186 2.786 -7.940 559 H ASP 70 H ASP 70 21.946 2.107 -8.421 560 HA ASP 70 HA ASP 70 22.820 -0.622 -8.996 561 HB2 ASP 70 2HB ASP 70 24.228 1.625 -8.289 562 HB3 ASP 70 3HB ASP 70 24.092 0.778 -6.750 563 H THR 71 H THR 71 21.549 -2.122 -8.104 564 HA THR 71 HA THR 71 20.056 -1.723 -5.715 565 HB THR 71 HB THR 71 20.086 -4.432 -5.988 566 HG1 THR 71 HG1 THR 71 20.502 -4.996 -8.023 567 HG21 THR 71 3HG2 THR 71 18.376 -2.832 -7.847 568 HG22 THR 71 1HG2 THR 71 18.208 -2.614 -6.106 569 HG23 THR 71 2HG2 THR 71 17.943 -4.202 -6.825 570 H TYR 72 H TYR 72 23.141 -3.238 -6.458 571 HA TYR 72 HA TYR 72 23.553 -4.580 -4.033 572 HB2 TYR 72 2HB TYR 72 24.968 -5.058 -5.916 573 HB3 TYR 72 3HB TYR 72 25.519 -3.388 -5.995 574 HD1 TYR 72 HD2 TYR 72 25.187 -5.568 -2.999 575 HD2 TYR 72 HD1 TYR 72 27.828 -3.565 -5.666 576 HE1 TYR 72 HE2 TYR 72 27.082 -6.130 -1.535 577 HE2 TYR 72 HE1 TYR 72 29.731 -4.123 -4.211 578 HH TYR 72 HH TYR 72 30.295 -4.847 -2.114 579 H ASP 73 H ASP 73 24.295 -1.265 -5.014 580 HA ASP 73 HA ASP 73 25.709 -0.521 -2.692 581 HB2 ASP 73 2HB ASP 73 25.705 0.752 -4.841 582 HB3 ASP 73 3HB ASP 73 24.060 1.271 -4.486 583 H ARG 74 H ARG 74 24.881 -0.735 -0.713 584 HA ARG 74 HA ARG 74 22.205 -0.827 -0.005 585 HB2 ARG 74 2HB ARG 74 22.904 -0.672 2.248 586 HB3 ARG 74 3HB ARG 74 24.225 -1.464 1.399 587 HG2 ARG 74 2HG ARG 74 24.173 1.484 1.985 588 HG3 ARG 74 3HG ARG 74 24.899 0.287 3.059 589 HD2 ARG 74 2HD ARG 74 25.696 0.943 0.230 590 HD3 ARG 74 3HD ARG 74 26.633 1.212 1.699 591 HE ARG 74 HE ARG 74 26.487 -1.192 0.188 592 HH11 ARG 74 1HH1 ARG 74 26.800 0.041 3.428 593 HH12 ARG 74 2HH1 ARG 74 27.642 -1.354 4.017 594 HH21 ARG 74 1HH2 ARG 74 27.595 -3.035 0.951 595 HH22 ARG 74 2HH2 ARG 74 28.094 -3.103 2.607 596 H GLU 75 H GLU 75 24.238 1.916 -0.624 597 HA GLU 75 HA GLU 75 22.694 3.880 0.707 598 HB2 GLU 75 2HB GLU 75 24.792 3.922 -1.422 599 HB3 GLU 75 3HB GLU 75 23.861 5.381 -1.117 600 HG2 GLU 75 2HG GLU 75 24.539 5.260 1.261 601 HG3 GLU 75 3HG GLU 75 25.564 3.883 0.859 602 H GLN 76 H GLN 76 22.877 3.016 -2.748 603 HA GLN 76 HA GLN 76 20.813 4.695 -3.610 604 HB2 GLN 76 2HB GLN 76 21.717 2.060 -4.784 605 HB3 GLN 76 3HB GLN 76 20.723 3.252 -5.609 606 HG2 GLN 76 2HG GLN 76 22.879 4.739 -4.835 607 HG3 GLN 76 3HG GLN 76 23.608 3.174 -5.192 608 HE21 GLN 76 1HE2 GLN 76 24.601 3.590 -7.073 609 HE22 GLN 76 2HE2 GLN 76 23.803 4.117 -8.512 610 H VAL 77 H VAL 77 20.687 1.187 -2.968 611 HA VAL 77 HA VAL 77 17.977 0.798 -3.348 612 HB VAL 77 HB VAL 77 19.852 -0.917 -2.812 613 HG11 VAL 77 1HG1 VAL 77 18.748 -0.503 -0.037 614 HG12 VAL 77 2HG1 VAL 77 19.970 -1.674 -0.535 615 HG13 VAL 77 3HG1 VAL 77 20.334 0.051 -0.573 616 HG21 VAL 77 3HG2 VAL 77 18.029 -2.128 -3.263 617 HG22 VAL 77 1HG2 VAL 77 17.804 -2.230 -1.516 618 HG23 VAL 77 2HG2 VAL 77 16.966 -0.985 -2.442 619 H MET 78 H MET 78 19.658 2.168 -0.603 620 HA MET 78 HA MET 78 17.510 2.026 1.242 621 HB2 MET 78 2HB MET 78 20.147 3.336 1.106 622 HB3 MET 78 3HB MET 78 18.960 4.166 2.103 623 HG2 MET 78 2HG MET 78 18.576 1.992 3.287 624 HG3 MET 78 3HG MET 78 19.956 1.348 2.401 625 HE1 MET 78 3HE MET 78 22.579 3.062 2.701 626 HE2 MET 78 1HE MET 78 22.912 2.292 4.252 627 HE3 MET 78 2HE MET 78 22.092 1.390 2.978 628 H LYS 79 H LYS 79 18.778 4.770 -0.654 629 HA LYS 79 HA LYS 79 16.840 6.634 0.030 630 HB2 LYS 79 2HB LYS 79 18.360 6.323 -2.564 631 HB3 LYS 79 3HB LYS 79 17.422 7.747 -2.130 632 HG2 LYS 79 2HG LYS 79 18.899 8.347 -0.426 633 HG3 LYS 79 3HG LYS 79 19.635 6.743 -0.377 634 HD2 LYS 79 2HD LYS 79 20.576 7.128 -2.617 635 HD3 LYS 79 3HD LYS 79 19.870 8.745 -2.625 636 HE2 LYS 79 2HE LYS 79 21.675 7.907 -0.393 637 HE3 LYS 79 3HE LYS 79 22.361 8.415 -1.936 638 HZ1 LYS 79 3HZ LYS 79 20.493 10.325 -1.338 639 HZ2 LYS 79 1HZ LYS 79 22.171 10.477 -1.177 640 HZ3 LYS 79 2HZ LYS 79 21.235 10.000 0.148 641 H ILE 80 H ILE 80 16.774 4.115 -2.425 642 HA ILE 80 HA ILE 80 14.400 4.956 -3.716 643 HB ILE 80 HB ILE 80 15.595 2.188 -3.538 644 HG12 ILE 80 2HG1 ILE 80 15.759 3.978 -5.933 645 HG13 ILE 80 3HG1 ILE 80 16.874 4.232 -4.594 646 HG21 ILE 80 1HG2 ILE 80 14.271 2.107 -5.827 647 HG22 ILE 80 2HG2 ILE 80 13.501 1.698 -4.294 648 HG23 ILE 80 3HG2 ILE 80 13.262 3.295 -5.003 649 HD11 ILE 80 3HD1 ILE 80 18.174 2.722 -5.561 650 HD12 ILE 80 1HD1 ILE 80 16.996 1.512 -5.053 651 HD13 ILE 80 2HD1 ILE 80 16.894 2.220 -6.665 652 H ILE 81 H ILE 81 14.953 2.352 -1.341 653 HA ILE 81 HA ILE 81 12.259 1.666 -0.994 654 HB ILE 81 HB ILE 81 14.572 1.397 0.927 655 HG12 ILE 81 2HG1 ILE 81 13.255 -0.683 -0.826 656 HG13 ILE 81 3HG1 ILE 81 14.710 0.197 -1.281 657 HG21 ILE 81 1HG2 ILE 81 12.693 -0.560 1.512 658 HG22 ILE 81 2HG2 ILE 81 13.060 0.872 2.472 659 HG23 ILE 81 3HG2 ILE 81 11.746 0.912 1.297 660 HD11 ILE 81 3HD1 ILE 81 16.014 -1.086 -0.012 661 HD12 ILE 81 1HD1 ILE 81 14.880 -1.069 1.339 662 HD13 ILE 81 2HD1 ILE 81 14.647 -2.201 0.007 663 H ASP 82 H ASP 82 14.258 4.107 0.559 664 HA ASP 82 HA ASP 82 12.378 4.777 2.592 665 HB2 ASP 82 2HB ASP 82 14.901 5.264 2.545 666 HB3 ASP 82 3HB ASP 82 14.491 6.636 1.519 667 H GLU 83 H GLU 83 13.261 6.314 -0.496 668 HA GLU 83 HA GLU 83 11.389 8.406 -0.345 669 HB2 GLU 83 2HB GLU 83 12.884 7.113 -2.603 670 HB3 GLU 83 3HB GLU 83 11.666 8.337 -2.932 671 HG2 GLU 83 2HG GLU 83 13.932 8.816 -1.028 672 HG3 GLU 83 3HG GLU 83 14.079 9.103 -2.761 673 H PHE 84 H PHE 84 11.217 5.229 -1.923 674 HA PHE 84 HA PHE 84 8.572 5.597 -2.906 675 HB2 PHE 84 2HB PHE 84 10.410 3.244 -2.621 676 HB3 PHE 84 3HB PHE 84 8.723 2.992 -3.056 677 HD1 PHE 84 HD2 PHE 84 11.570 5.192 -4.053 678 HD2 PHE 84 HD1 PHE 84 8.241 2.845 -5.287 679 HE1 PHE 84 HE2 PHE 84 12.110 5.670 -6.405 680 HE2 PHE 84 HE1 PHE 84 8.776 3.318 -7.642 681 HZ PHE 84 HZ PHE 84 10.712 4.734 -8.203 682 H LYS 85 H LYS 85 9.809 4.945 0.170 683 HA LYS 85 HA LYS 85 8.865 4.401 2.167 684 HB2 LYS 85 2HB LYS 85 6.523 5.409 0.596 685 HB3 LYS 85 3HB LYS 85 6.260 4.708 2.187 686 HG2 LYS 85 2HG LYS 85 6.571 6.805 2.902 687 HG3 LYS 85 3HG LYS 85 8.285 6.425 2.717 688 HD2 LYS 85 2HD LYS 85 8.521 7.793 0.945 689 HD3 LYS 85 3HD LYS 85 6.958 7.339 0.262 690 HE2 LYS 85 2HE LYS 85 7.058 9.024 2.725 691 HE3 LYS 85 3HE LYS 85 7.366 9.765 1.155 692 HZ1 LYS 85 3HZ LYS 85 4.890 8.733 2.263 693 HZ2 LYS 85 1HZ LYS 85 5.154 8.387 0.628 694 HZ3 LYS 85 2HZ LYS 85 5.143 9.992 1.161 695 H ILE 86 H ILE 86 9.572 2.204 0.931 696 HA ILE 86 HA ILE 86 7.340 0.390 0.585 697 HB ILE 86 HB ILE 86 10.289 -0.256 0.593 698 HG12 ILE 86 2HG1 ILE 86 8.491 0.319 -1.772 699 HG13 ILE 86 3HG1 ILE 86 9.660 1.456 -1.111 700 HG21 ILE 86 1HG2 ILE 86 9.714 -2.300 -0.432 701 HG22 ILE 86 2HG2 ILE 86 8.596 -2.112 0.918 702 HG23 ILE 86 3HG2 ILE 86 8.056 -1.775 -0.726 703 HD11 ILE 86 3HD1 ILE 86 11.453 -0.168 -1.614 704 HD12 ILE 86 1HD1 ILE 86 10.251 -1.203 -2.384 705 HD13 ILE 86 2HD1 ILE 86 10.591 0.397 -3.044 706 HA PRO 87 HA PRO 87 7.242 -0.872 4.826 707 HB2 PRO 87 2HB PRO 87 5.677 -3.066 4.491 708 HB3 PRO 87 3HB PRO 87 5.043 -1.416 4.442 709 HG2 PRO 87 2HG PRO 87 5.752 -3.241 2.177 710 HG3 PRO 87 3HG PRO 87 4.342 -2.182 2.361 711 HD2 PRO 87 2HD PRO 87 6.483 -1.506 0.848 712 HD3 PRO 87 3HD PRO 87 5.511 -0.303 1.719 713 H THR 88 H THR 88 7.886 -2.668 6.163 714 HA THR 88 HA THR 88 9.992 -4.265 4.907 715 HB THR 88 HB THR 88 9.782 -4.556 7.790 716 HG1 THR 88 HG1 THR 88 9.653 -2.523 8.367 717 HG21 THR 88 3HG2 THR 88 12.154 -3.653 7.586 718 HG22 THR 88 1HG2 THR 88 11.881 -3.624 5.844 719 HG23 THR 88 2HG2 THR 88 11.804 -5.151 6.724 720 H VAL 89 H VAL 89 10.301 -6.508 5.772 721 HA VAL 89 HA VAL 89 8.177 -8.152 5.164 722 HB VAL 89 HB VAL 89 10.467 -8.766 7.037 723 HG11 VAL 89 1HG1 VAL 89 9.342 -10.656 7.434 724 HG12 VAL 89 2HG1 VAL 89 8.198 -10.351 6.125 725 HG13 VAL 89 3HG1 VAL 89 9.756 -11.104 5.780 726 HG21 VAL 89 3HG2 VAL 89 11.586 -9.672 5.104 727 HG22 VAL 89 1HG2 VAL 89 10.186 -9.328 4.088 728 HG23 VAL 89 2HG2 VAL 89 11.126 -8.002 4.773 729 H GLU 90 H GLU 90 9.307 -7.264 8.427 730 HA GLU 90 HA GLU 90 7.430 -8.631 9.920 731 HB2 GLU 90 2HB GLU 90 8.983 -6.117 10.372 732 HB3 GLU 90 3HB GLU 90 7.730 -6.561 11.523 733 HG2 GLU 90 2HG GLU 90 8.830 -8.708 11.898 734 HG3 GLU 90 3HG GLU 90 10.085 -8.266 10.743 735 H GLN 91 H GLN 91 7.207 -5.277 8.739 736 HA GLN 91 HA GLN 91 4.655 -4.721 9.716 737 HB2 GLN 91 2HB GLN 91 5.798 -3.639 7.141 738 HB3 GLN 91 3HB GLN 91 4.613 -2.873 8.190 739 HG2 GLN 91 2HG GLN 91 7.534 -3.316 8.729 740 HG3 GLN 91 3HG GLN 91 6.686 -1.782 8.538 741 HE21 GLN 91 1HE2 GLN 91 8.245 -3.306 10.750 742 HE22 GLN 91 2HE2 GLN 91 7.275 -3.032 12.154 743 H TRP 92 H TRP 92 5.663 -6.140 6.634 744 HA TRP 92 HA TRP 92 3.089 -6.259 5.479 745 HB2 TRP 92 2HB TRP 92 5.144 -6.464 4.152 746 HB3 TRP 92 3HB TRP 92 5.512 -7.993 4.946 747 HD1 TRP 92 HD1 TRP 92 2.711 -6.504 2.706 748 HE1 TRP 92 HE1 TRP 92 1.812 -8.394 1.207 749 HE3 TRP 92 HE3 TRP 92 5.475 -10.388 4.552 750 HZ2 TRP 92 HZ2 TRP 92 2.220 -11.164 0.855 751 HZ3 TRP 92 HZ3 TRP 92 5.161 -12.627 3.579 752 HH2 TRP 92 HH2 TRP 92 3.566 -13.005 1.770 753 H LYS 93 H LYS 93 4.879 -8.453 7.563 754 HA LYS 93 HA LYS 93 3.119 -10.662 7.307 755 HB2 LYS 93 2HB LYS 93 5.012 -9.943 9.553 756 HB3 LYS 93 3HB LYS 93 4.233 -11.506 9.345 757 HG2 LYS 93 2HG LYS 93 5.782 -10.511 7.041 758 HG3 LYS 93 3HG LYS 93 6.706 -10.952 8.479 759 HD2 LYS 93 2HD LYS 93 6.635 -13.003 7.518 760 HD3 LYS 93 3HD LYS 93 5.075 -13.074 8.341 761 HE2 LYS 93 2HE LYS 93 4.411 -11.842 6.004 762 HE3 LYS 93 3HE LYS 93 5.700 -12.924 5.478 763 HZ1 LYS 93 3HZ LYS 93 3.075 -13.592 5.882 764 HZ2 LYS 93 1HZ LYS 93 3.874 -14.235 7.228 765 HZ3 LYS 93 2HZ LYS 93 4.363 -14.668 5.668 766 H ASP 94 H ASP 94 3.259 -7.906 9.495 767 HA ASP 94 HA ASP 94 1.227 -8.820 11.261 768 HB2 ASP 94 2HB ASP 94 2.957 -7.041 11.760 769 HB3 ASP 94 3HB ASP 94 2.008 -5.946 10.758 770 H GLN 95 H GLN 95 1.208 -6.469 8.588 771 HA GLN 95 HA GLN 95 -1.515 -5.838 8.705 772 HB2 GLN 95 2HB GLN 95 -1.253 -4.986 6.437 773 HB3 GLN 95 3HB GLN 95 0.126 -4.529 7.428 774 HG2 GLN 95 2HG GLN 95 1.416 -6.377 6.446 775 HG3 GLN 95 3HG GLN 95 0.040 -6.762 5.413 776 HE21 GLN 95 1HE2 GLN 95 1.720 -3.779 6.360 777 HE22 GLN 95 2HE2 GLN 95 1.958 -3.201 4.749 778 H THR 96 H THR 96 0.198 -8.407 6.998 779 HA THR 96 HA THR 96 -2.063 -9.351 5.554 780 HB THR 96 HB THR 96 -0.677 -11.434 5.244 781 HG1 THR 96 HG1 THR 96 0.787 -11.639 6.777 782 HG21 THR 96 3HG2 THR 96 -0.511 -9.797 3.548 783 HG22 THR 96 1HG2 THR 96 1.151 -10.212 3.963 784 HG23 THR 96 2HG2 THR 96 0.437 -8.719 4.573 785 H ARG 97 H ARG 97 -0.556 -10.264 8.621 786 HA ARG 97 HA ARG 97 -2.087 -12.554 9.139 787 HB2 ARG 97 2HB ARG 97 -0.570 -10.625 10.859 788 HB3 ARG 97 3HB ARG 97 -1.572 -11.860 11.610 789 HG2 ARG 97 2HG ARG 97 0.315 -12.752 9.513 790 HG3 ARG 97 3HG ARG 97 1.000 -12.231 11.054 791 HD2 ARG 97 2HD ARG 97 -1.238 -14.233 10.842 792 HD3 ARG 97 3HD ARG 97 0.464 -14.693 10.847 793 HE ARG 97 HE ARG 97 0.101 -13.098 13.066 794 HH11 ARG 97 1HH1 ARG 97 -1.175 -16.105 11.862 795 HH12 ARG 97 2HH1 ARG 97 -1.468 -16.762 13.437 796 HH21 ARG 97 1HH2 ARG 97 -0.281 -13.953 15.146 797 HH22 ARG 97 2HH2 ARG 97 -0.960 -15.537 15.305 798 H ARG 98 H ARG 98 -2.625 -9.159 10.018 799 HA ARG 98 HA ARG 98 -5.089 -9.702 11.374 800 HB2 ARG 98 2HB ARG 98 -5.303 -7.299 11.566 801 HB3 ARG 98 3HB ARG 98 -3.648 -7.768 11.931 802 HG2 ARG 98 2HG ARG 98 -3.043 -7.154 9.586 803 HG3 ARG 98 3HG ARG 98 -4.674 -6.504 9.403 804 HD2 ARG 98 2HD ARG 98 -3.163 -5.595 11.771 805 HD3 ARG 98 3HD ARG 98 -2.564 -5.041 10.208 806 HE ARG 98 HE ARG 98 -5.386 -4.680 10.490 807 HH11 ARG 98 1HH1 ARG 98 -2.276 -3.323 11.269 808 HH12 ARG 98 2HH1 ARG 98 -2.872 -1.702 11.405 809 HH21 ARG 98 1HH2 ARG 98 -6.183 -2.550 10.665 810 HH22 ARG 98 2HH2 ARG 98 -5.094 -1.264 11.062 811 H TYR 99 H TYR 99 -4.152 -8.832 8.126 812 HA TYR 99 HA TYR 99 -6.746 -8.057 7.235 813 HB2 TYR 99 2HB TYR 99 -4.923 -7.236 5.967 814 HB3 TYR 99 3HB TYR 99 -4.210 -8.837 5.805 815 HD1 TYR 99 HD1 TYR 99 -7.190 -6.837 4.810 816 HD2 TYR 99 HD2 TYR 99 -4.643 -10.124 3.907 817 HE1 TYR 99 HE1 TYR 99 -8.327 -7.116 2.647 818 HE2 TYR 99 HE2 TYR 99 -5.772 -10.411 1.741 819 HH TYR 99 HH TYR 99 -8.251 -8.146 0.646 820 H LYS 100 H LYS 100 -4.922 -11.073 7.223 821 HA LYS 100 HA LYS 100 -6.724 -12.550 5.617 822 HB2 LYS 100 2HB LYS 100 -4.575 -13.307 7.577 823 HB3 LYS 100 3HB LYS 100 -5.598 -14.536 6.844 824 HG2 LYS 100 2HG LYS 100 -4.830 -13.172 4.648 825 HG3 LYS 100 3HG LYS 100 -3.418 -12.945 5.682 826 HD2 LYS 100 2HD LYS 100 -2.990 -14.917 4.468 827 HD3 LYS 100 3HD LYS 100 -3.492 -15.458 6.071 828 HE2 LYS 100 2HE LYS 100 -4.740 -16.841 4.723 829 HE3 LYS 100 3HE LYS 100 -5.869 -15.512 4.984 830 HZ1 LYS 100 3HZ LYS 100 -5.923 -15.937 2.700 831 HZ2 LYS 100 1HZ LYS 100 -4.241 -16.082 2.581 832 HZ3 LYS 100 2HZ LYS 100 -4.943 -14.566 2.844 833 H GLU 101 H GLU 101 -6.963 -11.388 8.788 834 HA GLU 101 HA GLU 101 -8.431 -13.401 10.063 835 HB2 GLU 101 2HB GLU 101 -8.732 -10.419 10.447 836 HB3 GLU 101 3HB GLU 101 -9.183 -11.673 11.593 837 HG2 GLU 101 2HG GLU 101 -6.384 -11.061 10.673 838 HG3 GLU 101 3HG GLU 101 -7.094 -10.583 12.213 839 H SER 102 H SER 102 -10.821 -12.390 10.876 840 HA SER 102 HA SER 102 -12.619 -13.234 8.984 841 HB2 SER 102 2HB SER 102 -14.354 -12.178 10.307 842 HB3 SER 102 3HB SER 102 -13.130 -12.832 11.395 843 HG SER 102 HG SER 102 -13.606 -10.144 10.677 844 H SER 103 H SER 103 -12.678 -12.502 6.950 845 HA SER 103 HA SER 103 -13.549 -9.799 6.465 846 HB2 SER 103 2HB SER 103 -10.987 -10.659 5.122 847 HB3 SER 103 3HB SER 103 -11.728 -9.059 5.129 848 HG SER 103 HG SER 103 -11.090 -8.755 7.190 849 H ILE 104 H ILE 104 -13.162 -9.602 3.777 850 HA ILE 104 HA ILE 104 -15.089 -11.458 2.773 851 HB ILE 104 HB ILE 104 -13.422 -9.507 1.185 852 HG12 ILE 104 2HG1 ILE 104 -16.207 -8.973 2.179 853 HG13 ILE 104 3HG1 ILE 104 -14.814 -8.612 3.191 854 HG21 ILE 104 1HG2 ILE 104 -14.456 -10.975 -0.316 855 HG22 ILE 104 2HG2 ILE 104 -15.942 -11.036 0.630 856 HG23 ILE 104 3HG2 ILE 104 -15.526 -9.574 -0.264 857 HD11 ILE 104 3HD1 ILE 104 -15.934 -6.881 1.456 858 HD12 ILE 104 1HD1 ILE 104 -14.255 -6.808 1.990 859 HD13 ILE 104 2HD1 ILE 104 -14.660 -7.574 0.454 860 H GLN 105 H GLN 105 -14.803 -12.847 0.923 861 HA GLN 105 HA GLN 105 -12.787 -14.697 1.146 862 HB2 GLN 105 2HB GLN 105 -14.059 -14.057 -1.506 863 HB3 GLN 105 3HB GLN 105 -13.521 -15.619 -0.904 864 HG2 GLN 105 2HG GLN 105 -15.326 -15.289 0.906 865 HG3 GLN 105 3HG GLN 105 -15.971 -14.066 -0.187 866 HE21 GLN 105 1HE2 GLN 105 -17.603 -14.833 -1.303 867 HE22 GLN 105 2HE2 GLN 105 -17.728 -16.419 -1.977 868 H ILE 106 H ILE 106 -11.120 -15.262 -0.536 869 HA ILE 106 HA ILE 106 -9.853 -12.889 -1.707 870 HB ILE 106 HB ILE 106 -8.302 -14.952 -0.144 871 HG12 ILE 106 2HG1 ILE 106 -9.762 -13.589 1.329 872 HG13 ILE 106 3HG1 ILE 106 -8.051 -13.283 1.603 873 HG21 ILE 106 1HG2 ILE 106 -7.061 -13.871 -1.946 874 HG22 ILE 106 2HG2 ILE 106 -7.494 -12.288 -1.303 875 HG23 ILE 106 3HG2 ILE 106 -6.457 -13.366 -0.368 876 HD11 ILE 106 3HD1 ILE 106 -10.074 -11.422 1.071 877 HD12 ILE 106 1HD1 ILE 106 -8.342 -11.128 1.220 878 HD13 ILE 106 2HD1 ILE 106 -9.046 -11.463 -0.362 879 H GLY 107 H GLY 107 -9.016 -16.337 -1.319 880 HA2 GLY 107 2HA GLY 107 -9.669 -17.460 -3.650 881 HA3 GLY 107 3HA GLY 107 -8.306 -16.463 -4.139 882 H ASN 108 H ASN 108 -6.863 -16.799 -1.641 883 HA ASN 108 HA ASN 108 -6.088 -19.629 -1.919 884 HB2 ASN 108 2HB ASN 108 -4.494 -17.743 -2.771 885 HB3 ASN 108 3HB ASN 108 -4.146 -17.508 -1.061 886 HD21 ASN 108 1HD2 ASN 108 -2.188 -18.323 -0.776 887 HD22 ASN 108 2HD2 ASN 108 -1.685 -19.911 -1.235 888 H GLY 109 H GLY 109 -5.390 -20.725 -0.046 889 HA2 GLY 109 2HA GLY 109 -5.595 -19.361 2.519 890 HA3 GLY 109 3HA GLY 109 -6.795 -20.609 2.215 891 H HIS 110 H HIS 110 -4.572 -20.403 4.197 892 HA HIS 110 HA HIS 110 -3.607 -23.111 3.864 893 HB2 HIS 110 2HB HIS 110 -1.816 -20.719 3.700 894 HB3 HIS 110 3HB HIS 110 -1.216 -22.189 4.461 895 HD1 HIS 110 HD1 HIS 110 -2.212 -20.773 1.151 896 HD2 HIS 110 HD2 HIS 110 -0.740 -24.330 2.716 897 HE1 HIS 110 HE1 HIS 110 -1.485 -22.133 -0.836 898 H GLY 111 H GLY 111 -1.955 -23.507 5.835 899 HA2 GLY 111 2HA GLY 111 -2.196 -22.078 8.208 900 HA3 GLY 111 3HA GLY 111 -3.534 -23.217 8.172 901 H GLN 112 H GLN 112 -1.097 -23.010 9.898 902 HA GLN 112 HA GLN 112 -0.376 -25.827 9.735 903 HB2 GLN 112 2HB GLN 112 1.532 -23.554 9.393 904 HB3 GLN 112 3HB GLN 112 2.074 -24.991 10.249 905 HG2 GLN 112 2HG GLN 112 0.803 -25.167 7.543 906 HG3 GLN 112 3HG GLN 112 2.524 -24.839 7.741 907 HE21 GLN 112 1HE2 GLN 112 3.818 -26.423 8.816 908 HE22 GLN 112 2HE2 GLN 112 3.354 -28.086 8.792 909 H SER 113 H SER 113 1.280 -26.232 11.684 910 HA SER 113 HA SER 113 0.843 -24.613 14.005 911 HB2 SER 113 2HB SER 113 -0.637 -27.226 13.708 912 HB3 SER 113 3HB SER 113 -0.284 -26.519 15.284 913 HG SER 113 HG SER 113 -1.303 -24.547 14.113 914 H GLN 114 H GLN 114 1.972 -25.432 15.892 915 HA GLN 114 HA GLN 114 3.755 -27.693 15.478 916 HB2 GLN 114 2HB GLN 114 4.643 -24.843 15.622 917 HB3 GLN 114 3HB GLN 114 5.651 -26.082 16.358 918 HG2 GLN 114 2HG GLN 114 5.975 -27.180 14.290 919 HG3 GLN 114 3HG GLN 114 4.717 -26.224 13.508 920 HE21 GLN 114 1HE2 GLN 114 8.009 -26.470 14.245 921 HE22 GLN 114 2HE2 GLN 114 8.510 -24.931 13.641 922 H GLY 115 H GLY 115 5.302 -27.771 17.539 923 HA2 GLY 115 2HA GLY 115 4.840 -26.776 19.984 924 HA3 GLY 115 3HA GLY 115 3.477 -27.870 19.797 925 H LEU 116 H LEU 116 6.519 -27.613 21.014 926 HA LEU 116 HA LEU 116 6.695 -30.408 21.568 927 HB2 LEU 116 2HB LEU 116 9.113 -30.433 20.560 928 HB3 LEU 116 3HB LEU 116 7.710 -30.828 19.570 929 HG LEU 116 HG LEU 116 7.748 -28.474 18.721 930 HD11 LEU 116 1HD1 LEU 116 10.367 -27.722 19.119 931 HD12 LEU 116 2HD1 LEU 116 9.861 -28.296 20.708 932 HD13 LEU 116 3HD1 LEU 116 8.951 -27.018 19.901 933 HD21 LEU 116 3HD2 LEU 116 9.580 -28.852 17.180 934 HD22 LEU 116 1HD2 LEU 116 8.709 -30.359 17.466 935 HD23 LEU 116 2HD2 LEU 116 10.262 -30.076 18.253 936 H GLU 117 H GLU 117 8.468 -30.922 23.022 937 HA GLU 117 HA GLU 117 9.338 -28.547 24.523 938 HB2 GLU 117 2HB GLU 117 9.635 -30.143 26.427 939 HB3 GLU 117 3HB GLU 117 7.975 -29.980 25.873 940 HG2 GLU 117 2HG GLU 117 8.064 -32.076 24.746 941 HG3 GLU 117 3HG GLU 117 9.800 -32.211 25.020 942 H1 GLY -9 H GLY -9 6.260 -13.091 12.445 943 HA2 GLY -9 2HA GLY -9 8.004 -13.077 10.951 944 HA3 GLY -9 3HA GLY -9 8.989 -13.784 12.223 945 H LYS -8 H LYS -8 7.069 -14.396 9.403 946 HA LYS -8 HA LYS -8 7.355 -17.275 9.604 947 HB2 LYS -8 2HB LYS -8 5.919 -15.383 7.826 948 HB3 LYS -8 3HB LYS -8 6.407 -16.914 7.113 949 HG2 LYS -8 2HG LYS -8 5.234 -18.093 8.945 950 HG3 LYS -8 3HG LYS -8 4.669 -16.530 9.541 951 HD2 LYS -8 2HD LYS -8 2.895 -17.356 8.244 952 HD3 LYS -8 3HD LYS -8 3.703 -16.181 7.203 953 HE2 LYS -8 2HE LYS -8 4.546 -17.793 5.810 954 HE3 LYS -8 3HE LYS -8 4.572 -19.024 7.071 955 HZ1 LYS -8 3HZ LYS -8 1.923 -18.132 6.431 956 HZ2 LYS -8 1HZ LYS -8 2.538 -19.705 6.528 957 HZ3 LYS -8 2HZ LYS -8 2.717 -18.814 5.102 958 H PHE -7 H PHE -7 8.693 -14.608 7.722 959 HA PHE -7 HA PHE -7 10.446 -16.442 6.278 960 HB2 PHE -7 2HB PHE -7 9.971 -13.469 6.007 961 HB3 PHE -7 3HB PHE -7 11.140 -14.368 5.045 962 HD1 PHE -7 HD2 PHE -7 7.526 -14.324 5.930 963 HD2 PHE -7 HD1 PHE -7 10.490 -15.299 3.035 964 HE1 PHE -7 HE2 PHE -7 5.758 -14.882 4.313 965 HE2 PHE -7 HE1 PHE -7 8.727 -15.857 1.413 966 HZ PHE -7 HZ PHE -7 6.357 -15.650 2.051 967 H ILE -6 H ILE -6 11.116 -13.213 7.590 968 HA ILE -6 HA ILE -6 12.953 -12.378 8.656 969 HB ILE -6 HB ILE -6 12.981 -14.992 10.155 970 HG12 ILE -6 2HG1 ILE -6 10.681 -14.208 10.102 971 HG13 ILE -6 3HG1 ILE -6 11.357 -13.936 11.705 972 HG21 ILE -6 1HG2 ILE -6 14.300 -12.431 10.438 973 HG22 ILE -6 2HG2 ILE -6 13.401 -12.871 11.888 974 HG23 ILE -6 3HG2 ILE -6 14.627 -13.963 11.246 975 HD11 ILE -6 3HD1 ILE -6 11.876 -11.591 10.312 976 HD12 ILE -6 1HD1 ILE -6 10.243 -12.055 9.835 977 HD13 ILE -6 2HD1 ILE -6 10.639 -11.851 11.542 978 HA PRO -5 HA PRO -5 15.923 -14.776 6.043 979 HB2 PRO -5 2HB PRO -5 16.954 -12.583 4.818 980 HB3 PRO -5 3HB PRO -5 15.503 -13.413 4.242 981 HG2 PRO -5 2HG PRO -5 15.734 -10.931 5.899 982 HG3 PRO -5 3HG PRO -5 14.655 -11.267 4.533 983 HD2 PRO -5 2HD PRO -5 13.833 -11.415 7.109 984 HD3 PRO -5 3HD PRO -5 13.173 -12.460 5.834 985 H SER -4 H SER -4 17.209 -15.345 7.804 986 HA SER -4 HA SER -4 18.933 -13.294 8.973 987 HB2 SER -4 2HB SER -4 17.887 -14.722 10.596 988 HB3 SER -4 3HB SER -4 18.397 -16.172 9.731 989 HG SER -4 HG SER -4 20.349 -15.992 10.550 990 H ARG -3 H ARG -3 19.034 -15.105 6.306 991 HA ARG -3 HA ARG -3 21.395 -16.528 6.275 992 HB2 ARG -3 2HB ARG -3 19.681 -15.243 4.278 993 HB3 ARG -3 3HB ARG -3 21.362 -15.366 3.779 994 HG2 ARG -3 2HG ARG -3 20.033 -17.278 3.033 995 HG3 ARG -3 3HG ARG -3 21.325 -17.761 4.134 996 HD2 ARG -3 2HD ARG -3 19.874 -18.309 5.815 997 HD3 ARG -3 3HD ARG -3 18.656 -17.148 5.288 998 HE ARG -3 HE ARG -3 18.936 -19.885 4.432 999 HH11 ARG -3 1HH1 ARG -3 17.641 -16.744 3.671 1000 HH12 ARG -3 2HH1 ARG -3 16.411 -17.362 2.620 1001 HH21 ARG -3 1HH2 ARG -3 17.320 -20.711 3.050 1002 HH22 ARG -3 2HH2 ARG -3 16.228 -19.618 2.268 1003 HA PRO -2 HA PRO -2 24.767 -13.733 6.514 1004 HB2 PRO -2 2HB PRO -2 26.483 -14.691 4.641 1005 HB3 PRO -2 3HB PRO -2 26.165 -15.523 6.168 1006 HG2 PRO -2 2HG PRO -2 25.029 -16.053 3.450 1007 HG3 PRO -2 3HG PRO -2 25.608 -17.207 4.665 1008 HD2 PRO -2 2HD PRO -2 22.979 -16.679 4.295 1009 HD3 PRO -2 3HD PRO -2 23.654 -17.100 5.882 1010 H ALA -1 H ALA -1 23.101 -14.080 3.509 1011 HA ALA -1 HA ALA -1 22.701 -12.642 1.790 1012 HB1 ALA -1 1HB ALA -1 22.589 -11.076 3.909 1013 HB2 ALA -1 2HB ALA -1 24.038 -10.380 3.181 1014 HB3 ALA -1 3HB ALA -1 22.526 -10.417 2.274 1015 HA PRO 0 HA PRO 0 27.018 -13.188 0.296 1016 HB2 PRO 0 2HB PRO 0 26.283 -14.360 -2.040 1017 HB3 PRO 0 3HB PRO 0 26.473 -15.261 -0.532 1018 HG2 PRO 0 2HG PRO 0 23.975 -14.233 -1.823 1019 HG3 PRO 0 3HG PRO 0 24.273 -15.803 -1.054 1020 HD2 PRO 0 2HD PRO 0 22.965 -13.791 0.200 1021 HD3 PRO 0 3HD PRO 0 23.979 -14.959 1.070 1022 H LYS 1 H LYS 1 28.103 -11.802 -0.998 1023 HA LYS 1 HA LYS 1 26.703 -9.591 -2.145 1024 HB2 LYS 1 2HB LYS 1 29.559 -10.401 -1.859 1025 HB3 LYS 1 3HB LYS 1 29.161 -9.180 -3.060 1026 HG2 LYS 1 2HG LYS 1 28.282 -7.720 -1.408 1027 HG3 LYS 1 3HG LYS 1 28.343 -8.980 -0.174 1028 HD2 LYS 1 2HD LYS 1 30.772 -7.875 -1.578 1029 HD3 LYS 1 3HD LYS 1 30.179 -7.289 -0.022 1030 HE2 LYS 1 2HE LYS 1 30.401 -9.615 0.852 1031 HE3 LYS 1 3HE LYS 1 31.160 -10.065 -0.674 1032 HZ1 LYS 1 3HZ LYS 1 32.182 -7.965 1.160 1033 HZ2 LYS 1 1HZ LYS 1 32.934 -8.527 -0.248 1034 HZ3 LYS 1 2HZ LYS 1 32.771 -9.549 1.090 1035 HA PRO 2 HA PRO 2 26.209 -10.829 -6.325 1036 HB2 PRO 2 2HB PRO 2 26.830 -8.564 -7.687 1037 HB3 PRO 2 3HB PRO 2 25.345 -8.741 -6.745 1038 HG2 PRO 2 2HG PRO 2 27.909 -7.387 -6.002 1039 HG3 PRO 2 3HG PRO 2 26.241 -6.847 -5.736 1040 HD2 PRO 2 2HD PRO 2 27.730 -7.994 -3.786 1041 HD3 PRO 2 3HD PRO 2 25.968 -8.192 -3.884 1042 HA PRO 3 HA PRO 3 29.975 -12.049 -8.239 1043 HB2 PRO 3 2HB PRO 3 29.376 -11.894 -10.883 1044 HB3 PRO 3 3HB PRO 3 28.714 -13.142 -9.820 1045 HG2 PRO 3 2HG PRO 3 27.455 -10.596 -10.766 1046 HG3 PRO 3 3HG PRO 3 26.743 -12.214 -10.633 1047 HD2 PRO 3 2HD PRO 3 26.318 -10.279 -8.787 1048 HD3 PRO 3 3HD PRO 3 26.376 -12.003 -8.367 1049 H SER 4 H SER 4 28.571 -9.025 -9.382 1050 HA SER 4 HA SER 4 31.182 -8.134 -10.360 1051 HB2 SER 4 2HB SER 4 28.501 -6.741 -10.555 1052 HB3 SER 4 3HB SER 4 29.986 -6.284 -11.390 1053 HG SER 4 HG SER 4 28.521 -8.692 -11.739 1054 H SER 5 H SER 5 31.707 -8.259 -7.916 1055 HA SER 5 HA SER 5 30.726 -6.202 -6.216 1056 HB2 SER 5 2HB SER 5 31.846 -8.395 -5.519 1057 HB3 SER 5 3HB SER 5 33.377 -7.605 -5.894 1058 HG SER 5 HG SER 5 31.646 -7.206 -3.781 1059 H ALA 6 H ALA 6 31.281 -4.129 -6.090 1060 HA ALA 6 HA ALA 6 33.301 -3.082 -7.872 1061 HB1 ALA 6 1HB ALA 6 32.530 -0.876 -7.041 1062 HB2 ALA 6 2HB ALA 6 31.229 -1.875 -7.690 1063 HB3 ALA 6 3HB ALA 6 31.430 -1.713 -5.945 Start of MODEL 9 1 H1 MET -2 H MET -2 -1.507 -4.500 -4.495 2 HA MET -2 HA MET -2 1.399 -4.234 -4.450 3 HB2 MET -2 2HB MET -2 0.358 -5.005 -2.164 4 HB3 MET -2 3HB MET -2 0.202 -6.552 -2.985 5 HG2 MET -2 2HG MET -2 2.833 -5.207 -3.123 6 HG3 MET -2 3HG MET -2 2.345 -5.880 -1.569 7 HE1 MET -2 3HE MET -2 4.795 -7.019 -4.168 8 HE2 MET -2 1HE MET -2 4.785 -6.739 -2.426 9 HE3 MET -2 2HE MET -2 4.933 -8.381 -3.054 10 H ALA -1 H ALA -1 2.497 -5.827 -5.635 11 HA ALA -1 HA ALA -1 0.842 -7.759 -7.097 12 HB1 ALA -1 1HB ALA -1 0.960 -6.503 -8.934 13 HB2 ALA -1 2HB ALA -1 2.167 -5.433 -8.220 14 HB3 ALA -1 3HB ALA -1 2.669 -6.935 -8.994 15 HA PRO 1 HA PRO 1 4.110 -10.616 -6.457 16 HB2 PRO 1 2HB PRO 1 4.106 -12.037 -8.770 17 HB3 PRO 1 3HB PRO 1 2.832 -12.178 -7.553 18 HG2 PRO 1 2HG PRO 1 2.853 -10.603 -10.098 19 HG3 PRO 1 3HG PRO 1 1.557 -11.597 -9.409 20 HD2 PRO 1 2HD PRO 1 1.592 -8.898 -9.197 21 HD3 PRO 1 3HD PRO 1 0.898 -9.945 -7.942 22 H LEU 2 H LEU 2 6.285 -10.747 -6.672 23 HA LEU 2 HA LEU 2 7.553 -9.657 -9.074 24 HB2 LEU 2 2HB LEU 2 9.053 -8.272 -7.843 25 HB3 LEU 2 3HB LEU 2 7.406 -7.857 -7.373 26 HG LEU 2 HG LEU 2 8.272 -9.770 -5.514 27 HD11 LEU 2 1HD1 LEU 2 10.545 -9.557 -5.948 28 HD12 LEU 2 2HD1 LEU 2 10.277 -8.427 -4.622 29 HD13 LEU 2 3HD1 LEU 2 10.422 -7.828 -6.274 30 HD21 LEU 2 3HD2 LEU 2 8.223 -7.777 -3.981 31 HD22 LEU 2 1HD2 LEU 2 6.766 -8.026 -4.944 32 HD23 LEU 2 2HD2 LEU 2 7.927 -6.781 -5.407 33 H PHE 3 H PHE 3 9.599 -10.488 -9.523 34 HA PHE 3 HA PHE 3 10.491 -12.688 -7.780 35 HB2 PHE 3 2HB PHE 3 10.269 -12.639 -10.789 36 HB3 PHE 3 3HB PHE 3 11.242 -13.826 -9.927 37 HD1 PHE 3 HD2 PHE 3 7.791 -12.515 -10.264 38 HD2 PHE 3 HD1 PHE 3 10.270 -15.756 -9.052 39 HE1 PHE 3 HE2 PHE 3 5.797 -13.924 -9.965 40 HE2 PHE 3 HE1 PHE 3 8.279 -17.170 -8.752 41 HZ PHE 3 HZ PHE 3 6.039 -16.255 -9.208 42 H ALA 4 H ALA 4 12.765 -13.201 -7.911 43 HA ALA 4 HA ALA 4 14.438 -11.046 -9.006 44 HB1 ALA 4 1HB ALA 4 14.519 -10.365 -6.826 45 HB2 ALA 4 2HB ALA 4 14.286 -11.994 -6.191 46 HB3 ALA 4 3HB ALA 4 15.857 -11.515 -6.835 47 H VAL 5 H VAL 5 16.655 -11.645 -9.387 48 HA VAL 5 HA VAL 5 17.056 -14.557 -9.623 49 HB VAL 5 HB VAL 5 16.681 -13.672 -11.838 50 HG11 VAL 5 1HG1 VAL 5 19.008 -11.808 -11.417 51 HG12 VAL 5 2HG1 VAL 5 17.907 -11.876 -12.795 52 HG13 VAL 5 3HG1 VAL 5 17.325 -11.318 -11.226 53 HG21 VAL 5 3HG2 VAL 5 19.521 -13.867 -12.231 54 HG22 VAL 5 1HG2 VAL 5 18.987 -15.042 -11.029 55 HG23 VAL 5 2HG2 VAL 5 18.255 -15.027 -12.633 56 H THR 6 H THR 6 18.725 -15.273 -8.491 57 HA THR 6 HA THR 6 20.505 -13.576 -7.109 58 HB THR 6 HB THR 6 21.818 -15.952 -7.057 59 HG1 THR 6 HG1 THR 6 20.035 -16.731 -8.507 60 HG21 THR 6 3HG2 THR 6 21.300 -15.463 -4.938 61 HG22 THR 6 1HG2 THR 6 19.786 -16.326 -5.203 62 HG23 THR 6 2HG2 THR 6 19.854 -14.577 -5.421 63 H LEU 7 H LEU 7 22.600 -12.983 -7.488 64 HA LEU 7 HA LEU 7 23.682 -13.645 -10.148 65 HB2 LEU 7 2HB LEU 7 24.433 -11.176 -8.634 66 HB3 LEU 7 3HB LEU 7 24.547 -11.497 -10.363 67 HG LEU 7 HG LEU 7 21.944 -11.108 -8.892 68 HD11 LEU 7 1HD1 LEU 7 22.364 -8.933 -8.861 69 HD12 LEU 7 2HD1 LEU 7 22.449 -8.958 -10.622 70 HD13 LEU 7 3HD1 LEU 7 23.914 -9.178 -9.666 71 HD21 LEU 7 3HD2 LEU 7 20.894 -11.279 -10.902 72 HD22 LEU 7 1HD2 LEU 7 22.262 -12.347 -11.220 73 HD23 LEU 7 2HD2 LEU 7 22.287 -10.684 -11.808 74 H TYR 8 H TYR 8 24.150 -13.864 -6.809 75 HA TYR 8 HA TYR 8 26.911 -14.767 -7.239 76 HB2 TYR 8 2HB TYR 8 26.070 -13.196 -4.803 77 HB3 TYR 8 3HB TYR 8 27.699 -13.679 -5.261 78 HD1 TYR 8 HD1 TYR 8 28.915 -12.477 -6.990 79 HD2 TYR 8 HD2 TYR 8 24.980 -11.307 -5.871 80 HE1 TYR 8 HE1 TYR 8 29.229 -10.333 -8.154 81 HE2 TYR 8 HE2 TYR 8 25.283 -9.160 -7.033 82 HH TYR 8 HH TYR 8 26.774 -8.321 -8.992 83 H GLU 9 H GLU 9 27.684 -16.260 -5.595 84 HA GLU 9 HA GLU 9 25.587 -18.081 -4.790 85 HB2 GLU 9 2HB GLU 9 27.528 -19.090 -5.740 86 HB3 GLU 9 3HB GLU 9 28.597 -18.210 -4.657 87 HG2 GLU 9 2HG GLU 9 28.459 -19.786 -3.108 88 HG3 GLU 9 3HG GLU 9 26.698 -19.796 -3.178 89 H PHE 10 H PHE 10 24.492 -17.522 -3.010 90 HA PHE 10 HA PHE 10 25.832 -16.250 -0.773 91 HB2 PHE 10 2HB PHE 10 23.501 -15.639 -1.613 92 HB3 PHE 10 3HB PHE 10 22.952 -17.142 -0.878 93 HD1 PHE 10 HD2 PHE 10 25.262 -14.415 0.204 94 HD2 PHE 10 HD1 PHE 10 21.808 -16.749 1.064 95 HE1 PHE 10 HE2 PHE 10 25.028 -13.266 2.367 96 HE2 PHE 10 HE1 PHE 10 21.568 -15.603 3.228 97 HZ PHE 10 HZ PHE 10 23.180 -13.860 3.883 98 H LYS 11 H LYS 11 26.430 -17.208 1.077 99 HA LYS 11 HA LYS 11 25.798 -20.068 1.391 100 HB2 LYS 11 2HB LYS 11 28.184 -18.577 2.497 101 HB3 LYS 11 3HB LYS 11 27.900 -20.311 2.578 102 HG2 LYS 11 2HG LYS 11 29.251 -20.358 0.791 103 HG3 LYS 11 3HG LYS 11 27.784 -19.925 -0.090 104 HD2 LYS 11 2HD LYS 11 29.046 -18.225 -0.862 105 HD3 LYS 11 3HD LYS 11 28.650 -17.479 0.688 106 HE2 LYS 11 2HE LYS 11 31.001 -19.292 0.572 107 HE3 LYS 11 3HE LYS 11 31.149 -17.701 -0.174 108 HZ1 LYS 11 3HZ LYS 11 30.173 -16.907 2.078 109 HZ2 LYS 11 1HZ LYS 11 31.818 -17.286 1.964 110 HZ3 LYS 11 2HZ LYS 11 30.741 -18.393 2.652 111 H ALA 12 H ALA 12 24.030 -20.029 2.694 112 HA ALA 12 HA ALA 12 23.438 -18.255 4.731 113 HB1 ALA 12 1HB ALA 12 21.735 -19.711 3.982 114 HB2 ALA 12 2HB ALA 12 22.686 -21.145 4.371 115 HB3 ALA 12 3HB ALA 12 22.037 -20.139 5.666 116 H GLU 13 H GLU 13 23.455 -18.579 7.070 117 HA GLU 13 HA GLU 13 25.874 -20.010 7.955 118 HB2 GLU 13 2HB GLU 13 26.060 -18.327 9.748 119 HB3 GLU 13 3HB GLU 13 26.160 -17.607 8.147 120 HG2 GLU 13 2HG GLU 13 24.738 -16.131 9.094 121 HG3 GLU 13 3HG GLU 13 23.553 -17.312 8.536 122 H ARG 14 H ARG 14 22.494 -19.501 8.418 123 HA ARG 14 HA ARG 14 22.479 -21.592 10.464 124 HB2 ARG 14 2HB ARG 14 21.278 -18.849 10.736 125 HB3 ARG 14 3HB ARG 14 20.624 -20.219 11.623 126 HG2 ARG 14 2HG ARG 14 23.540 -19.819 11.814 127 HG3 ARG 14 3HG ARG 14 22.525 -18.598 12.586 128 HD2 ARG 14 2HD ARG 14 22.274 -21.567 13.044 129 HD3 ARG 14 3HD ARG 14 23.178 -20.472 14.088 130 HE ARG 14 HE ARG 14 20.355 -20.847 14.042 131 HH11 ARG 14 1HH1 ARG 14 22.852 -18.485 14.597 132 HH12 ARG 14 2HH1 ARG 14 21.881 -17.515 15.654 133 HH21 ARG 14 1HH2 ARG 14 19.067 -19.578 15.433 134 HH22 ARG 14 2HH2 ARG 14 19.729 -18.139 16.130 135 H ASP 15 H ASP 15 19.937 -21.957 10.989 136 HA ASP 15 HA ASP 15 18.871 -23.175 8.715 137 HB2 ASP 15 2HB ASP 15 17.433 -22.299 11.230 138 HB3 ASP 15 3HB ASP 15 16.807 -23.441 10.043 139 H ASP 16 H ASP 16 18.036 -20.082 10.242 140 HA ASP 16 HA ASP 16 15.892 -19.343 8.664 141 HB2 ASP 16 2HB ASP 16 18.031 -17.429 9.606 142 HB3 ASP 16 3HB ASP 16 16.329 -17.079 9.316 143 H GLU 17 H GLU 17 19.333 -18.609 8.091 144 HA GLU 17 HA GLU 17 18.904 -17.373 5.581 145 HB2 GLU 17 2HB GLU 17 21.348 -18.559 6.887 146 HB3 GLU 17 3HB GLU 17 21.401 -17.826 5.289 147 HG2 GLU 17 2HG GLU 17 22.113 -16.200 6.867 148 HG3 GLU 17 3HG GLU 17 20.516 -15.730 6.290 149 H LEU 18 H LEU 18 19.368 -18.150 3.482 150 HA LEU 18 HA LEU 18 19.341 -21.082 3.217 151 HB2 LEU 18 2HB LEU 18 17.136 -19.948 2.751 152 HB3 LEU 18 3HB LEU 18 17.918 -19.178 1.372 153 HG LEU 18 HG LEU 18 18.448 -21.623 0.650 154 HD11 LEU 18 1HD1 LEU 18 17.320 -23.334 1.591 155 HD12 LEU 18 2HD1 LEU 18 15.908 -22.346 1.962 156 HD13 LEU 18 3HD1 LEU 18 17.331 -22.275 3.001 157 HD21 LEU 18 3HD2 LEU 18 17.024 -20.969 -0.921 158 HD22 LEU 18 1HD2 LEU 18 16.268 -19.828 0.192 159 HD23 LEU 18 2HD2 LEU 18 15.688 -21.492 0.107 160 H ASP 19 H ASP 19 20.357 -21.942 1.354 161 HA ASP 19 HA ASP 19 22.487 -20.224 0.330 162 HB2 ASP 19 2HB ASP 19 23.373 -22.240 1.154 163 HB3 ASP 19 3HB ASP 19 22.083 -23.203 0.436 164 H VAL 20 H VAL 20 22.821 -19.811 -1.824 165 HA VAL 20 HA VAL 20 21.102 -21.011 -3.829 166 HB VAL 20 HB VAL 20 19.746 -19.130 -2.970 167 HG11 VAL 20 1HG1 VAL 20 20.429 -16.894 -3.069 168 HG12 VAL 20 2HG1 VAL 20 21.831 -17.747 -2.420 169 HG13 VAL 20 3HG1 VAL 20 21.798 -17.264 -4.116 170 HG21 VAL 20 3HG2 VAL 20 20.532 -18.167 -5.647 171 HG22 VAL 20 1HG2 VAL 20 20.111 -19.875 -5.528 172 HG23 VAL 20 2HG2 VAL 20 18.950 -18.644 -5.030 173 H SER 21 H SER 21 21.837 -20.701 -5.959 174 HA SER 21 HA SER 21 24.613 -19.743 -6.114 175 HB2 SER 21 2HB SER 21 23.092 -21.891 -7.535 176 HB3 SER 21 3HB SER 21 24.441 -21.117 -8.366 177 HG SER 21 HG SER 21 24.531 -23.020 -6.525 178 HA PRO 22 HA PRO 22 23.622 -16.488 -8.883 179 HB2 PRO 22 2HB PRO 22 25.701 -16.560 -10.628 180 HB3 PRO 22 3HB PRO 22 25.866 -16.002 -8.959 181 HG2 PRO 22 2HG PRO 22 26.539 -18.669 -10.139 182 HG3 PRO 22 3HG PRO 22 27.461 -17.694 -8.980 183 HD2 PRO 22 2HD PRO 22 25.940 -19.804 -8.224 184 HD3 PRO 22 3HD PRO 22 26.178 -18.380 -7.191 185 H GLY 23 H GLY 23 22.025 -16.499 -10.332 186 HA2 GLY 23 2HA GLY 23 21.419 -16.730 -12.669 187 HA3 GLY 23 3HA GLY 23 22.291 -18.256 -12.687 188 H GLU 24 H GLU 24 20.686 -18.124 -9.813 189 HA GLU 24 HA GLU 24 18.605 -19.901 -10.818 190 HB2 GLU 24 2HB GLU 24 19.732 -19.315 -8.098 191 HB3 GLU 24 3HB GLU 24 18.185 -20.134 -8.261 192 HG2 GLU 24 2HG GLU 24 20.730 -21.097 -9.541 193 HG3 GLU 24 3HG GLU 24 20.151 -21.638 -7.967 194 H ASN 25 H ASN 25 16.388 -19.685 -10.107 195 HA ASN 25 HA ASN 25 15.594 -16.867 -9.937 196 HB2 ASN 25 2HB ASN 25 13.929 -19.291 -10.654 197 HB3 ASN 25 3HB ASN 25 13.405 -17.612 -10.737 198 HD21 ASN 25 1HD2 ASN 25 13.343 -16.895 -12.727 199 HD22 ASN 25 2HD2 ASN 25 14.446 -17.297 -13.995 200 H LEU 26 H LEU 26 14.594 -16.055 -8.198 201 HA LEU 26 HA LEU 26 13.563 -17.922 -6.172 202 HB2 LEU 26 2HB LEU 26 15.226 -15.460 -5.661 203 HB3 LEU 26 3HB LEU 26 14.444 -16.433 -4.417 204 HG LEU 26 HG LEU 26 15.938 -18.321 -5.647 205 HD11 LEU 26 1HD1 LEU 26 17.978 -17.548 -6.401 206 HD12 LEU 26 2HD1 LEU 26 17.801 -15.985 -5.603 207 HD13 LEU 26 3HD1 LEU 26 16.865 -16.346 -7.053 208 HD21 LEU 26 3HD2 LEU 26 17.675 -17.244 -3.771 209 HD22 LEU 26 1HD2 LEU 26 16.415 -18.442 -3.477 210 HD23 LEU 26 2HD2 LEU 26 16.075 -16.729 -3.234 211 H SER 27 H SER 27 11.785 -17.222 -4.991 212 HA SER 27 HA SER 27 10.367 -14.946 -6.179 213 HB2 SER 27 2HB SER 27 9.516 -17.514 -5.682 214 HB3 SER 27 3HB SER 27 8.874 -16.631 -4.296 215 HG SER 27 HG SER 27 7.350 -16.402 -5.836 216 H ILE 28 H ILE 28 10.447 -13.093 -5.113 217 HA ILE 28 HA ILE 28 11.204 -12.987 -2.333 218 HB ILE 28 HB ILE 28 10.325 -10.704 -4.100 219 HG12 ILE 28 2HG1 ILE 28 13.132 -11.705 -3.579 220 HG13 ILE 28 3HG1 ILE 28 12.231 -11.988 -5.064 221 HG21 ILE 28 1HG2 ILE 28 12.131 -9.694 -2.354 222 HG22 ILE 28 2HG2 ILE 28 10.386 -9.669 -2.105 223 HG23 ILE 28 3HG2 ILE 28 11.364 -10.934 -1.362 224 HD11 ILE 28 3HD1 ILE 28 12.419 -9.177 -4.266 225 HD12 ILE 28 1HD1 ILE 28 13.955 -9.944 -4.668 226 HD13 ILE 28 2HD1 ILE 28 12.640 -9.933 -5.844 227 H CYS 29 H CYS 29 9.973 -12.085 -0.643 228 HA CYS 29 HA CYS 29 7.069 -12.015 -1.130 229 HB2 CYS 29 2HB CYS 29 8.377 -12.991 1.413 230 HB3 CYS 29 3HB CYS 29 6.672 -13.081 0.985 231 HG CYS 29 HG CYS 29 8.909 -14.688 -0.993 232 H ALA 30 H ALA 30 9.742 -10.861 0.876 233 HA ALA 30 HA ALA 30 8.464 -8.276 1.112 234 HB1 ALA 30 1HB ALA 30 9.152 -8.671 3.748 235 HB2 ALA 30 2HB ALA 30 7.516 -8.702 3.087 236 HB3 ALA 30 3HB ALA 30 8.415 -10.206 3.289 237 H HIS 31 H HIS 31 9.955 -6.931 2.777 238 HA HIS 31 HA HIS 31 12.765 -7.581 2.225 239 HB2 HIS 31 2HB HIS 31 13.260 -5.378 1.468 240 HB3 HIS 31 3HB HIS 31 11.844 -5.907 0.564 241 HD1 HIS 31 HD1 HIS 31 13.017 -2.970 1.930 242 HD2 HIS 31 HD2 HIS 31 9.409 -4.988 2.344 243 HE1 HIS 31 HE1 HIS 31 11.362 -1.239 2.698 244 H TYR 32 H TYR 32 14.200 -5.898 3.465 245 HA TYR 32 HA TYR 32 13.015 -5.276 6.075 246 HB2 TYR 32 2HB TYR 32 14.226 -7.518 6.088 247 HB3 TYR 32 3HB TYR 32 15.711 -6.609 5.830 248 HD1 TYR 32 HD1 TYR 32 12.792 -6.810 8.143 249 HD2 TYR 32 HD2 TYR 32 16.902 -5.822 7.662 250 HE1 TYR 32 HE1 TYR 32 12.982 -6.446 10.568 251 HE2 TYR 32 HE2 TYR 32 17.104 -5.457 10.086 252 HH TYR 32 HH TYR 32 16.052 -5.422 12.037 253 H ASP 33 H ASP 33 13.139 -3.101 5.913 254 HA ASP 33 HA ASP 33 14.021 -1.005 5.802 255 HB2 ASP 33 2HB ASP 33 16.235 -2.649 6.954 256 HB3 ASP 33 3HB ASP 33 16.569 -0.978 6.508 257 H TYR 34 H TYR 34 14.162 -2.790 3.424 258 HA TYR 34 HA TYR 34 14.888 -2.671 1.272 259 HB2 TYR 34 2HB TYR 34 16.204 -0.068 2.065 260 HB3 TYR 34 3HB TYR 34 15.746 -0.578 0.444 261 HD1 TYR 34 HD1 TYR 34 14.504 0.663 3.670 262 HD2 TYR 34 HD2 TYR 34 13.459 -0.425 -0.309 263 HE1 TYR 34 HE1 TYR 34 12.317 1.753 3.953 264 HE2 TYR 34 HE2 TYR 34 11.269 0.663 -0.037 265 HH TYR 34 HH TYR 34 9.846 1.595 1.430 266 H GLU 35 H GLU 35 16.650 -3.576 3.639 267 HA GLU 35 HA GLU 35 19.257 -3.455 2.293 268 HB2 GLU 35 2HB GLU 35 18.852 -4.577 5.042 269 HB3 GLU 35 3HB GLU 35 20.286 -3.833 4.349 270 HG2 GLU 35 2HG GLU 35 17.756 -2.409 5.141 271 HG3 GLU 35 3HG GLU 35 19.280 -2.400 6.027 272 H TRP 36 H TRP 36 17.212 -5.792 4.044 273 HA TRP 36 HA TRP 36 18.479 -7.947 2.497 274 HB2 TRP 36 2HB TRP 36 16.810 -8.180 5.009 275 HB3 TRP 36 3HB TRP 36 17.724 -9.468 4.228 276 HD1 TRP 36 HD1 TRP 36 18.333 -6.159 6.133 277 HE1 TRP 36 HE1 TRP 36 20.641 -6.301 7.263 278 HE3 TRP 36 HE3 TRP 36 19.890 -10.643 4.235 279 HZ2 TRP 36 HZ2 TRP 36 22.833 -8.078 7.339 280 HZ3 TRP 36 HZ3 TRP 36 22.106 -11.493 4.885 281 HH2 TRP 36 HH2 TRP 36 23.545 -10.236 6.405 282 H PHE 37 H PHE 37 17.186 -9.581 1.546 283 HA PHE 37 HA PHE 37 14.373 -8.816 1.121 284 HB2 PHE 37 2HB PHE 37 16.517 -9.267 -0.823 285 HB3 PHE 37 3HB PHE 37 15.063 -10.200 -1.160 286 HD1 PHE 37 HD1 PHE 37 12.866 -8.555 -0.520 287 HD2 PHE 37 HD2 PHE 37 16.626 -7.407 -2.150 288 HE1 PHE 37 HE1 PHE 37 11.820 -6.565 -1.522 289 HE2 PHE 37 HE2 PHE 37 15.587 -5.415 -3.154 290 HZ PHE 37 HZ PHE 37 13.182 -4.992 -2.840 291 H ILE 38 H ILE 38 12.879 -10.399 1.292 292 HA ILE 38 HA ILE 38 13.820 -13.014 2.181 293 HB ILE 38 HB ILE 38 10.973 -12.020 2.119 294 HG12 ILE 38 2HG1 ILE 38 12.348 -10.489 3.456 295 HG13 ILE 38 3HG1 ILE 38 11.272 -11.429 4.485 296 HG21 ILE 38 1HG2 ILE 38 12.271 -14.483 2.917 297 HG22 ILE 38 2HG2 ILE 38 11.334 -13.774 4.232 298 HG23 ILE 38 3HG2 ILE 38 10.558 -14.132 2.689 299 HD11 ILE 38 3HD1 ILE 38 13.213 -12.971 4.905 300 HD12 ILE 38 1HD1 ILE 38 14.228 -11.776 4.100 301 HD13 ILE 38 2HD1 ILE 38 13.360 -11.346 5.574 302 H ALA 39 H ALA 39 14.387 -14.129 0.356 303 HA ALA 39 HA ALA 39 12.276 -14.528 -1.662 304 HB1 ALA 39 1HB ALA 39 14.495 -13.476 -2.364 305 HB2 ALA 39 2HB ALA 39 15.189 -15.080 -2.127 306 HB3 ALA 39 3HB ALA 39 13.906 -14.841 -3.313 307 H LYS 40 H LYS 40 12.002 -16.650 -2.528 308 HA LYS 40 HA LYS 40 13.051 -18.804 -0.815 309 HB2 LYS 40 2HB LYS 40 10.785 -19.937 -1.318 310 HB3 LYS 40 3HB LYS 40 10.832 -18.667 -0.102 311 HG2 LYS 40 2HG LYS 40 9.658 -17.193 -1.391 312 HG3 LYS 40 3HG LYS 40 10.208 -17.910 -2.907 313 HD2 LYS 40 2HD LYS 40 8.480 -19.538 -1.109 314 HD3 LYS 40 3HD LYS 40 7.734 -18.239 -2.044 315 HE2 LYS 40 2HE LYS 40 8.699 -19.209 -4.098 316 HE3 LYS 40 3HE LYS 40 9.360 -20.533 -3.139 317 HZ1 LYS 40 3HZ LYS 40 6.686 -20.133 -4.103 318 HZ2 LYS 40 1HZ LYS 40 6.737 -20.514 -2.455 319 HZ3 LYS 40 2HZ LYS 40 7.446 -21.553 -3.586 320 HA PRO 41 HA PRO 41 14.237 -20.926 -4.469 321 HB2 PRO 41 2HB PRO 41 13.787 -23.514 -3.783 322 HB3 PRO 41 3HB PRO 41 15.113 -22.558 -3.110 323 HG2 PRO 41 2HG PRO 41 12.439 -23.188 -1.921 324 HG3 PRO 41 3HG PRO 41 14.035 -23.193 -1.149 325 HD2 PRO 41 2HD PRO 41 12.288 -21.143 -0.870 326 HD3 PRO 41 3HD PRO 41 14.047 -20.905 -0.872 327 H ILE 42 H ILE 42 13.282 -21.216 -6.381 328 HA ILE 42 HA ILE 42 10.429 -21.878 -6.443 329 HB ILE 42 HB ILE 42 12.203 -20.781 -8.628 330 HG12 ILE 42 2HG1 ILE 42 10.007 -19.380 -7.097 331 HG13 ILE 42 3HG1 ILE 42 11.710 -19.265 -6.665 332 HG21 ILE 42 1HG2 ILE 42 9.669 -22.058 -8.755 333 HG22 ILE 42 2HG2 ILE 42 9.445 -20.348 -9.120 334 HG23 ILE 42 3HG2 ILE 42 10.591 -21.308 -10.057 335 HD11 ILE 42 3HD1 ILE 42 12.152 -18.360 -8.937 336 HD12 ILE 42 1HD1 ILE 42 10.410 -18.332 -9.209 337 HD13 ILE 42 2HD1 ILE 42 11.121 -17.340 -7.935 338 H ASN 43 H ASN 43 13.545 -22.922 -7.719 339 HA ASN 43 HA ASN 43 12.259 -25.246 -8.965 340 HB2 ASN 43 2HB ASN 43 13.901 -23.768 -10.249 341 HB3 ASN 43 3HB ASN 43 15.159 -24.457 -9.227 342 HD21 ASN 43 1HD2 ASN 43 15.273 -24.746 -11.929 343 HD22 ASN 43 2HD2 ASN 43 14.983 -26.394 -12.358 344 H ARG 43 H ARG 43 14.652 -24.324 -6.558 345 HA ARG 43 HA ARG 43 15.522 -26.972 -5.979 346 HB2 ARG 43 2HB ARG 43 15.661 -24.584 -4.138 347 HB3 ARG 43 3HB ARG 43 16.688 -26.011 -4.121 348 HG2 ARG 43 2HG ARG 43 16.589 -24.027 -6.381 349 HG3 ARG 43 3HG ARG 43 17.768 -23.989 -5.068 350 HD2 ARG 43 2HD ARG 43 18.919 -25.132 -6.710 351 HD3 ARG 43 3HD ARG 43 18.228 -26.449 -5.763 352 HE ARG 43 HE ARG 43 16.579 -25.621 -7.967 353 HH11 ARG 43 1HH1 ARG 43 19.222 -27.658 -6.974 354 HH12 ARG 43 2HH1 ARG 43 19.002 -28.794 -8.265 355 HH21 ARG 43 1HH2 ARG 43 16.280 -27.108 -9.670 356 HH22 ARG 43 2HH2 ARG 43 17.329 -28.479 -9.798 357 H LEU 44 H LEU 44 15.385 -27.490 -3.406 358 HA LEU 44 HA LEU 44 12.534 -27.399 -2.678 359 HB2 LEU 44 2HB LEU 44 14.396 -29.741 -2.780 360 HB3 LEU 44 3HB LEU 44 13.028 -29.732 -1.669 361 HG LEU 44 HG LEU 44 12.472 -30.963 -3.675 362 HD11 LEU 44 1HD1 LEU 44 10.381 -30.100 -3.931 363 HD12 LEU 44 2HD1 LEU 44 10.960 -28.441 -4.080 364 HD13 LEU 44 3HD1 LEU 44 10.883 -29.208 -2.494 365 HD21 LEU 44 3HD2 LEU 44 12.861 -30.282 -5.793 366 HD22 LEU 44 1HD2 LEU 44 14.105 -29.305 -5.012 367 HD23 LEU 44 2HD2 LEU 44 12.548 -28.585 -5.424 368 H GLY 45 H GLY 45 12.219 -26.515 -0.750 369 HA2 GLY 45 2HA GLY 45 13.484 -27.208 1.616 370 HA3 GLY 45 3HA GLY 45 14.375 -25.835 0.976 371 H GLY 46 H GLY 46 13.643 -23.843 1.406 372 HA2 GLY 46 2HA GLY 46 10.899 -23.182 1.695 373 HA3 GLY 46 3HA GLY 46 11.644 -23.370 3.276 374 HA PRO 47 HA PRO 47 12.310 -19.039 1.497 375 HB2 PRO 47 2HB PRO 47 10.780 -17.696 3.293 376 HB3 PRO 47 3HB PRO 47 10.143 -18.325 1.769 377 HG2 PRO 47 2HG PRO 47 9.967 -19.491 4.521 378 HG3 PRO 47 3HG PRO 47 8.714 -19.378 3.271 379 HD2 PRO 47 2HD PRO 47 10.098 -21.656 3.744 380 HD3 PRO 47 3HD PRO 47 9.510 -21.214 2.129 381 H GLY 48 H GLY 48 14.193 -18.235 2.170 382 HA2 GLY 48 2HA GLY 48 14.807 -18.358 5.058 383 HA3 GLY 48 3HA GLY 48 16.018 -18.513 3.794 384 H LEU 49 H LEU 49 17.258 -16.779 3.644 385 HA LEU 49 HA LEU 49 16.069 -14.145 3.488 386 HB2 LEU 49 2HB LEU 49 16.865 -14.991 5.960 387 HB3 LEU 49 3HB LEU 49 18.313 -14.176 5.372 388 HG LEU 49 HG LEU 49 15.756 -12.703 5.118 389 HD11 LEU 49 1HD1 LEU 49 15.207 -12.687 7.263 390 HD12 LEU 49 2HD1 LEU 49 16.837 -12.179 7.705 391 HD13 LEU 49 3HD1 LEU 49 16.453 -13.896 7.577 392 HD21 LEU 49 3HD2 LEU 49 18.636 -12.101 5.673 393 HD22 LEU 49 1HD2 LEU 49 17.383 -10.911 6.026 394 HD23 LEU 49 2HD2 LEU 49 17.598 -11.502 4.378 395 H VAL 50 H VAL 50 17.069 -13.058 1.933 396 HA VAL 50 HA VAL 50 19.928 -13.544 1.459 397 HB VAL 50 HB VAL 50 18.699 -14.863 -0.197 398 HG11 VAL 50 1HG1 VAL 50 17.160 -13.945 -1.729 399 HG12 VAL 50 2HG1 VAL 50 16.678 -13.327 -0.148 400 HG13 VAL 50 3HG1 VAL 50 17.566 -12.292 -1.268 401 HG21 VAL 50 3HG2 VAL 50 20.051 -12.411 -1.321 402 HG22 VAL 50 1HG2 VAL 50 20.823 -13.930 -0.864 403 HG23 VAL 50 2HG2 VAL 50 19.711 -13.882 -2.233 404 HA PRO 51 HA PRO 51 20.032 -9.122 1.544 405 HB2 PRO 51 2HB PRO 51 22.575 -8.819 0.642 406 HB3 PRO 51 3HB PRO 51 22.195 -9.350 2.285 407 HG2 PRO 51 2HG PRO 51 22.978 -10.982 -0.100 408 HG3 PRO 51 3HG PRO 51 23.523 -11.126 1.582 409 HD2 PRO 51 2HD PRO 51 21.636 -12.751 0.518 410 HD3 PRO 51 3HD PRO 51 21.632 -12.275 2.228 411 H VAL 52 H VAL 52 19.921 -7.384 0.125 412 HA VAL 52 HA VAL 52 18.977 -7.860 -2.458 413 HB VAL 52 HB VAL 52 20.192 -5.298 -1.415 414 HG11 VAL 52 1HG1 VAL 52 18.295 -4.496 -3.114 415 HG12 VAL 52 2HG1 VAL 52 19.960 -4.795 -3.616 416 HG13 VAL 52 3HG1 VAL 52 18.724 -6.025 -3.880 417 HG21 VAL 52 3HG2 VAL 52 17.316 -5.364 -1.484 418 HG22 VAL 52 1HG2 VAL 52 17.943 -6.678 -0.489 419 HG23 VAL 52 2HG2 VAL 52 18.396 -5.011 -0.135 420 H SER 53 H SER 53 22.198 -7.597 -1.269 421 HA SER 53 HA SER 53 23.410 -6.926 -3.786 422 HB2 SER 53 2HB SER 53 24.648 -8.021 -1.248 423 HB3 SER 53 3HB SER 53 25.539 -7.373 -2.625 424 HG SER 53 HG SER 53 24.405 -5.374 -2.243 425 H TYR 54 H TYR 54 21.940 -9.663 -2.696 426 HA TYR 54 HA TYR 54 23.601 -11.378 -4.425 427 HB2 TYR 54 2HB TYR 54 22.379 -11.906 -1.752 428 HB3 TYR 54 3HB TYR 54 22.492 -13.237 -2.897 429 HD1 TYR 54 HD1 TYR 54 24.581 -10.579 -1.320 430 HD2 TYR 54 HD2 TYR 54 24.449 -14.482 -3.007 431 HE1 TYR 54 HE1 TYR 54 26.924 -10.936 -0.662 432 HE2 TYR 54 HE2 TYR 54 26.791 -14.851 -2.353 433 HH TYR 54 HH TYR 54 28.355 -13.829 -0.458 434 H VAL 55 H VAL 55 21.071 -9.698 -4.797 435 HA VAL 55 HA VAL 55 19.678 -11.671 -6.396 436 HB VAL 55 HB VAL 55 17.435 -10.903 -5.441 437 HG11 VAL 55 1HG1 VAL 55 19.188 -12.576 -3.646 438 HG12 VAL 55 2HG1 VAL 55 17.429 -12.638 -3.770 439 HG13 VAL 55 3HG1 VAL 55 18.428 -13.152 -5.129 440 HG21 VAL 55 3HG2 VAL 55 19.003 -9.214 -3.950 441 HG22 VAL 55 1HG2 VAL 55 17.320 -9.619 -3.613 442 HG23 VAL 55 2HG2 VAL 55 18.617 -10.498 -2.804 443 H ARG 56 H ARG 56 18.677 -10.791 -8.152 444 HA ARG 56 HA ARG 56 18.825 -7.859 -8.400 445 HB2 ARG 56 2HB ARG 56 20.324 -8.854 -9.966 446 HB3 ARG 56 3HB ARG 56 19.123 -10.038 -10.463 447 HG2 ARG 56 2HG ARG 56 17.772 -8.233 -11.440 448 HG3 ARG 56 3HG ARG 56 19.022 -7.075 -10.982 449 HD2 ARG 56 2HD ARG 56 19.882 -9.434 -12.550 450 HD3 ARG 56 3HD ARG 56 18.912 -8.226 -13.393 451 HE ARG 56 HE ARG 56 20.797 -6.724 -12.199 452 HH11 ARG 56 1HH1 ARG 56 20.974 -9.597 -14.158 453 HH12 ARG 56 2HH1 ARG 56 22.526 -9.207 -14.822 454 HH21 ARG 56 1HH2 ARG 56 22.840 -6.199 -13.066 455 HH22 ARG 56 2HH2 ARG 56 23.587 -7.274 -14.199 456 H ILE 57 H ILE 57 16.921 -6.884 -8.344 457 HA ILE 57 HA ILE 57 14.452 -8.254 -8.534 458 HB ILE 57 HB ILE 57 14.891 -5.279 -8.798 459 HG12 ILE 57 2HG1 ILE 57 15.985 -6.183 -6.773 460 HG13 ILE 57 3HG1 ILE 57 14.610 -5.157 -6.378 461 HG21 ILE 57 1HG2 ILE 57 12.568 -5.476 -7.539 462 HG22 ILE 57 2HG2 ILE 57 12.682 -5.525 -9.298 463 HG23 ILE 57 3HG2 ILE 57 12.526 -7.024 -8.383 464 HD11 ILE 57 3HD1 ILE 57 14.612 -7.083 -4.952 465 HD12 ILE 57 1HD1 ILE 57 13.243 -7.186 -6.059 466 HD13 ILE 57 2HD1 ILE 57 14.684 -8.163 -6.345 467 H ILE 58 H ILE 58 13.751 -9.131 -10.371 468 HA ILE 58 HA ILE 58 13.760 -7.459 -12.791 469 HB ILE 58 HB ILE 58 14.057 -9.560 -14.131 470 HG12 ILE 58 2HG1 ILE 58 15.323 -10.867 -11.782 471 HG13 ILE 58 3HG1 ILE 58 13.565 -10.899 -11.857 472 HG21 ILE 58 1HG2 ILE 58 16.587 -9.639 -12.867 473 HG22 ILE 58 2HG2 ILE 58 16.120 -8.773 -14.330 474 HG23 ILE 58 3HG2 ILE 58 15.987 -7.985 -12.758 475 HD11 ILE 58 3HD1 ILE 58 15.535 -12.384 -13.398 476 HD12 ILE 58 1HD1 ILE 58 13.841 -12.743 -13.069 477 HD13 ILE 58 2HD1 ILE 58 14.272 -11.651 -14.386 478 H ASP 59 H ASP 59 12.207 -8.387 -14.475 479 HA ASP 59 HA ASP 59 9.761 -9.291 -13.100 480 HB2 ASP 59 2HB ASP 59 9.576 -7.007 -13.979 481 HB3 ASP 59 3HB ASP 59 10.015 -7.583 -15.585 482 H LEU 60 H LEU 60 8.578 -10.951 -13.961 483 HA LEU 60 HA LEU 60 9.935 -12.834 -15.575 484 HB2 LEU 60 2HB LEU 60 7.306 -12.613 -14.273 485 HB3 LEU 60 3HB LEU 60 7.357 -13.658 -15.692 486 HG LEU 60 HG LEU 60 7.653 -14.870 -13.555 487 HD11 LEU 60 1HD1 LEU 60 10.278 -15.186 -14.853 488 HD12 LEU 60 2HD1 LEU 60 8.874 -15.306 -15.912 489 HD13 LEU 60 3HD1 LEU 60 9.021 -16.377 -14.519 490 HD21 LEU 60 3HD2 LEU 60 10.308 -13.455 -13.387 491 HD22 LEU 60 1HD2 LEU 60 9.631 -14.616 -12.245 492 HD23 LEU 60 2HD2 LEU 60 8.897 -13.021 -12.419 493 H MET 61 H MET 61 7.808 -10.206 -16.299 494 HA MET 61 HA MET 61 7.289 -11.158 -19.001 495 HB2 MET 61 2HB MET 61 6.434 -8.632 -17.577 496 HB3 MET 61 3HB MET 61 5.953 -9.072 -19.211 497 HG2 MET 61 2HG MET 61 4.142 -9.832 -18.091 498 HG3 MET 61 3HG MET 61 5.150 -11.273 -17.990 499 HE1 MET 61 3HE MET 61 4.960 -12.510 -16.350 500 HE2 MET 61 1HE MET 61 5.304 -12.183 -14.651 501 HE3 MET 61 2HE MET 61 3.652 -12.058 -15.256 502 H ASP 62 H ASP 62 9.317 -8.895 -17.305 503 HA ASP 62 HA ASP 62 10.812 -8.415 -19.753 504 HB2 ASP 62 2HB ASP 62 8.978 -6.579 -19.291 505 HB3 ASP 62 3HB ASP 62 10.155 -5.999 -18.116 506 HA PRO 63 HA PRO 63 13.390 -9.063 -15.947 507 HB2 PRO 63 2HB PRO 63 15.028 -10.903 -17.087 508 HB3 PRO 63 3HB PRO 63 13.496 -11.328 -16.315 509 HG2 PRO 63 2HG PRO 63 14.115 -10.960 -19.221 510 HG3 PRO 63 3HG PRO 63 13.142 -12.217 -18.435 511 HD2 PRO 63 2HD PRO 63 12.035 -10.081 -19.678 512 HD3 PRO 63 3HD PRO 63 11.292 -10.853 -18.262 513 H ALA 64 H ALA 64 13.842 -8.006 -19.152 514 HA ALA 64 HA ALA 64 16.652 -7.327 -18.775 515 HB1 ALA 64 1HB ALA 64 16.640 -6.648 -21.080 516 HB2 ALA 64 2HB ALA 64 15.847 -8.218 -20.946 517 HB3 ALA 64 3HB ALA 64 14.881 -6.757 -21.146 518 H LYS 65 H LYS 65 13.625 -5.955 -18.202 519 HA LYS 65 HA LYS 65 14.279 -3.216 -18.707 520 HB2 LYS 65 2HB LYS 65 11.943 -4.366 -18.503 521 HB3 LYS 65 3HB LYS 65 12.148 -4.080 -16.780 522 HG2 LYS 65 2HG LYS 65 12.522 -1.658 -17.332 523 HG3 LYS 65 3HG LYS 65 12.027 -2.038 -18.983 524 HD2 LYS 65 2HD LYS 65 10.317 -2.711 -16.604 525 HD3 LYS 65 3HD LYS 65 10.235 -1.140 -17.405 526 HE2 LYS 65 2HE LYS 65 10.110 -3.430 -19.226 527 HE3 LYS 65 3HE LYS 65 8.766 -3.340 -18.088 528 HZ1 LYS 65 3HZ LYS 65 8.997 -1.952 -20.429 529 HZ2 LYS 65 1HZ LYS 65 9.367 -0.800 -19.246 530 HZ3 LYS 65 2HZ LYS 65 7.896 -1.632 -19.185 531 H TYR 66 H TYR 66 13.943 -5.146 -15.730 532 HA TYR 66 HA TYR 66 15.316 -3.030 -14.242 533 HB2 TYR 66 2HB TYR 66 13.799 -5.476 -13.319 534 HB3 TYR 66 3HB TYR 66 14.635 -4.370 -12.233 535 HD1 TYR 66 HD1 TYR 66 11.883 -4.606 -14.705 536 HD2 TYR 66 HD2 TYR 66 13.624 -2.351 -11.545 537 HE1 TYR 66 HE1 TYR 66 9.879 -3.183 -14.625 538 HE2 TYR 66 HE2 TYR 66 11.624 -0.922 -11.455 539 HH TYR 66 HH TYR 66 8.725 -1.719 -12.973 540 H ALA 67 H ALA 67 16.590 -4.987 -16.139 541 HA ALA 67 HA ALA 67 18.199 -6.698 -14.463 542 HB1 ALA 67 1HB ALA 67 18.305 -7.818 -16.376 543 HB2 ALA 67 2HB ALA 67 17.632 -6.455 -17.270 544 HB3 ALA 67 3HB ALA 67 19.372 -6.559 -16.998 545 H SER 68 H SER 68 18.381 -3.493 -15.700 546 HA SER 68 HA SER 68 21.262 -3.328 -15.212 547 HB2 SER 68 2HB SER 68 19.997 -2.312 -17.267 548 HB3 SER 68 3HB SER 68 19.592 -1.014 -16.143 549 HG SER 68 HG SER 68 21.992 -1.061 -15.718 550 H VAL 69 H VAL 69 18.338 -2.788 -13.627 551 HA VAL 69 HA VAL 69 18.704 -0.500 -12.132 552 HB VAL 69 HB VAL 69 17.447 -3.118 -11.315 553 HG11 VAL 69 1HG1 VAL 69 16.326 -1.795 -9.534 554 HG12 VAL 69 2HG1 VAL 69 18.065 -1.971 -9.296 555 HG13 VAL 69 3HG1 VAL 69 17.407 -0.453 -9.907 556 HG21 VAL 69 3HG2 VAL 69 16.634 -1.227 -13.149 557 HG22 VAL 69 1HG2 VAL 69 15.601 -2.420 -12.360 558 HG23 VAL 69 2HG2 VAL 69 15.738 -0.793 -11.693 559 H ASP 70 H ASP 70 19.764 0.038 -10.265 560 HA ASP 70 HA ASP 70 21.998 -1.685 -9.537 561 HB2 ASP 70 2HB ASP 70 21.374 1.115 -8.578 562 HB3 ASP 70 3HB ASP 70 22.896 0.249 -8.387 563 H THR 71 H THR 71 20.546 -3.258 -8.510 564 HA THR 71 HA THR 71 18.853 -2.857 -6.399 565 HB THR 71 HB THR 71 20.109 -5.143 -5.584 566 HG1 THR 71 HG1 THR 71 20.938 -6.171 -7.362 567 HG21 THR 71 3HG2 THR 71 17.790 -5.140 -6.001 568 HG22 THR 71 1HG2 THR 71 18.457 -6.296 -7.153 569 HG23 THR 71 2HG2 THR 71 18.010 -4.675 -7.687 570 H TYR 72 H TYR 72 22.365 -2.849 -6.367 571 HA TYR 72 HA TYR 72 22.780 -2.965 -3.602 572 HB2 TYR 72 2HB TYR 72 24.648 -3.258 -5.066 573 HB3 TYR 72 3HB TYR 72 24.393 -1.683 -5.809 574 HD1 TYR 72 HD1 TYR 72 24.950 -3.080 -2.381 575 HD2 TYR 72 HD2 TYR 72 25.858 -0.020 -5.194 576 HE1 TYR 72 HE1 TYR 72 26.517 -2.076 -0.773 577 HE2 TYR 72 HE2 TYR 72 27.428 0.993 -3.594 578 HH TYR 72 HH TYR 72 27.680 -0.147 -0.295 579 H ASP 73 H ASP 73 22.277 -0.190 -5.748 580 HA ASP 73 HA ASP 73 22.621 1.810 -3.794 581 HB2 ASP 73 2HB ASP 73 22.607 2.136 -6.300 582 HB3 ASP 73 3HB ASP 73 20.852 2.001 -6.235 583 H ARG 74 H ARG 74 21.457 2.043 -2.010 584 HA ARG 74 HA ARG 74 19.009 0.842 -1.472 585 HB2 ARG 74 2HB ARG 74 18.954 2.106 0.522 586 HB3 ARG 74 3HB ARG 74 20.660 1.861 0.173 587 HG2 ARG 74 2HG ARG 74 19.160 4.356 -0.577 588 HG3 ARG 74 3HG ARG 74 20.039 4.160 0.940 589 HD2 ARG 74 2HD ARG 74 21.155 4.104 -1.856 590 HD3 ARG 74 3HD ARG 74 21.472 5.295 -0.595 591 HE ARG 74 HE ARG 74 22.300 2.935 0.487 592 HH11 ARG 74 1HH1 ARG 74 23.026 4.680 -2.437 593 HH12 ARG 74 2HH1 ARG 74 24.650 4.084 -2.544 594 HH21 ARG 74 1HH2 ARG 74 24.435 2.144 0.357 595 HH22 ARG 74 2HH2 ARG 74 25.450 2.641 -0.955 596 H GLU 75 H GLU 75 19.726 3.746 -3.197 597 HA GLU 75 HA GLU 75 17.238 5.058 -2.913 598 HB2 GLU 75 2HB GLU 75 19.629 5.329 -4.602 599 HB3 GLU 75 3HB GLU 75 18.140 5.872 -5.364 600 HG2 GLU 75 2HG GLU 75 17.742 7.225 -3.247 601 HG3 GLU 75 3HG GLU 75 19.425 6.883 -2.851 602 H GLN 76 H GLN 76 18.522 3.146 -5.639 603 HA GLN 76 HA GLN 76 16.181 3.099 -7.150 604 HB2 GLN 76 2HB GLN 76 18.265 0.916 -7.025 605 HB3 GLN 76 3HB GLN 76 17.159 1.241 -8.353 606 HG2 GLN 76 2HG GLN 76 18.680 3.593 -7.737 607 HG3 GLN 76 3HG GLN 76 19.754 2.220 -8.002 608 HE21 GLN 76 1HE2 GLN 76 20.482 2.265 -9.997 609 HE22 GLN 76 2HE2 GLN 76 19.555 2.607 -11.415 610 H VAL 77 H VAL 77 17.431 0.563 -4.973 611 HA VAL 77 HA VAL 77 15.301 -1.196 -5.139 612 HB VAL 77 HB VAL 77 17.606 -1.280 -3.804 613 HG11 VAL 77 1HG1 VAL 77 17.348 -1.123 -1.442 614 HG12 VAL 77 2HG1 VAL 77 16.743 0.383 -2.134 615 HG13 VAL 77 3HG1 VAL 77 15.611 -0.855 -1.589 616 HG21 VAL 77 3HG2 VAL 77 16.744 -3.351 -4.056 617 HG22 VAL 77 1HG2 VAL 77 16.275 -3.137 -2.370 618 HG23 VAL 77 2HG2 VAL 77 15.106 -2.834 -3.655 619 H MET 78 H MET 78 15.593 1.777 -3.325 620 HA MET 78 HA MET 78 13.375 1.372 -1.606 621 HB2 MET 78 2HB MET 78 15.165 3.595 -2.320 622 HB3 MET 78 3HB MET 78 13.548 4.088 -1.835 623 HG2 MET 78 2HG MET 78 13.865 2.643 0.213 624 HG3 MET 78 3HG MET 78 15.561 2.527 -0.250 625 HE1 MET 78 3HE MET 78 17.164 5.548 1.043 626 HE2 MET 78 1HE MET 78 17.215 3.846 0.584 627 HE3 MET 78 2HE MET 78 17.043 5.089 -0.656 628 H LYS 79 H LYS 79 13.717 3.349 -4.556 629 HA LYS 79 HA LYS 79 11.076 4.162 -4.787 630 HB2 LYS 79 2HB LYS 79 12.980 3.524 -7.049 631 HB3 LYS 79 3HB LYS 79 11.551 4.545 -7.155 632 HG2 LYS 79 2HG LYS 79 12.551 6.297 -6.105 633 HG3 LYS 79 3HG LYS 79 13.613 5.263 -5.147 634 HD2 LYS 79 2HD LYS 79 15.032 4.861 -7.033 635 HD3 LYS 79 3HD LYS 79 13.900 5.667 -8.121 636 HE2 LYS 79 2HE LYS 79 14.336 7.789 -7.113 637 HE3 LYS 79 3HE LYS 79 15.274 7.043 -5.820 638 HZ1 LYS 79 3HZ LYS 79 16.058 6.855 -8.670 639 HZ2 LYS 79 1HZ LYS 79 16.998 6.510 -7.307 640 HZ3 LYS 79 2HZ LYS 79 16.581 8.110 -7.664 641 H ILE 80 H ILE 80 12.613 1.178 -5.872 642 HA ILE 80 HA ILE 80 10.421 0.178 -7.347 643 HB ILE 80 HB ILE 80 12.637 -1.340 -5.966 644 HG12 ILE 80 2HG1 ILE 80 12.403 -0.653 -8.894 645 HG13 ILE 80 3HG1 ILE 80 13.238 0.391 -7.748 646 HG21 ILE 80 1HG2 ILE 80 11.193 -3.044 -6.383 647 HG22 ILE 80 2HG2 ILE 80 10.383 -2.185 -7.692 648 HG23 ILE 80 3HG2 ILE 80 11.950 -2.944 -7.973 649 HD11 ILE 80 3HD1 ILE 80 15.053 -0.885 -7.770 650 HD12 ILE 80 1HD1 ILE 80 14.116 -2.366 -7.575 651 HD13 ILE 80 2HD1 ILE 80 14.347 -1.673 -9.181 652 H ILE 81 H ILE 81 11.579 -0.737 -4.097 653 HA ILE 81 HA ILE 81 9.431 -2.385 -3.429 654 HB ILE 81 HB ILE 81 11.183 -0.729 -1.611 655 HG12 ILE 81 2HG1 ILE 81 11.321 -3.673 -2.284 656 HG13 ILE 81 3HG1 ILE 81 12.302 -2.441 -3.070 657 HG21 ILE 81 1HG2 ILE 81 9.792 -1.294 0.028 658 HG22 ILE 81 2HG2 ILE 81 8.852 -2.332 -1.044 659 HG23 ILE 81 3HG2 ILE 81 10.281 -2.969 -0.229 660 HD11 ILE 81 3HD1 ILE 81 13.757 -2.411 -1.398 661 HD12 ILE 81 1HD1 ILE 81 12.482 -2.296 -0.186 662 HD13 ILE 81 2HD1 ILE 81 12.962 -3.873 -0.814 663 H ASP 82 H ASP 82 9.810 1.097 -3.179 664 HA ASP 82 HA ASP 82 7.481 1.546 -1.603 665 HB2 ASP 82 2HB ASP 82 9.324 3.177 -1.734 666 HB3 ASP 82 3HB ASP 82 8.959 3.447 -3.436 667 H GLU 83 H GLU 83 8.149 1.956 -5.079 668 HA GLU 83 HA GLU 83 5.551 2.715 -5.814 669 HB2 GLU 83 2HB GLU 83 7.875 1.539 -7.297 670 HB3 GLU 83 3HB GLU 83 6.323 1.719 -8.104 671 HG2 GLU 83 2HG GLU 83 6.650 4.181 -6.995 672 HG3 GLU 83 3HG GLU 83 8.312 3.732 -7.372 673 H PHE 84 H PHE 84 7.120 -0.476 -5.886 674 HA PHE 84 HA PHE 84 4.818 -1.858 -6.805 675 HB2 PHE 84 2HB PHE 84 7.408 -2.720 -5.546 676 HB3 PHE 84 3HB PHE 84 6.126 -3.886 -5.860 677 HD1 PHE 84 HD2 PHE 84 7.852 -1.111 -7.669 678 HD2 PHE 84 HD1 PHE 84 6.301 -5.072 -7.806 679 HE1 PHE 84 HE2 PHE 84 8.630 -1.331 -9.992 680 HE2 PHE 84 HE1 PHE 84 7.077 -5.299 -10.130 681 HZ PHE 84 HZ PHE 84 8.242 -3.427 -11.226 682 H LYS 85 H LYS 85 5.641 -0.551 -3.797 683 HA LYS 85 HA LYS 85 4.701 -0.639 -1.728 684 HB2 LYS 85 2HB LYS 85 2.474 -1.586 -3.493 685 HB3 LYS 85 3HB LYS 85 2.271 -1.625 -1.747 686 HG2 LYS 85 2HG LYS 85 1.494 0.453 -2.022 687 HG3 LYS 85 3HG LYS 85 3.201 0.895 -2.100 688 HD2 LYS 85 2HD LYS 85 3.063 1.448 -4.264 689 HD3 LYS 85 3HD LYS 85 2.142 -0.005 -4.661 690 HE2 LYS 85 2HE LYS 85 0.141 1.152 -3.621 691 HE3 LYS 85 3HE LYS 85 1.114 2.622 -3.610 692 HZ1 LYS 85 3HZ LYS 85 -0.422 2.189 -5.594 693 HZ2 LYS 85 1HZ LYS 85 0.749 1.075 -6.096 694 HZ3 LYS 85 2HZ LYS 85 1.157 2.706 -5.911 695 H ILE 86 H ILE 86 6.514 -2.509 -1.896 696 HA ILE 86 HA ILE 86 5.425 -5.139 -1.364 697 HB ILE 86 HB ILE 86 8.295 -4.243 -1.116 698 HG12 ILE 86 2HG1 ILE 86 6.914 -5.488 -3.503 699 HG13 ILE 86 3HG1 ILE 86 7.365 -3.791 -3.377 700 HG21 ILE 86 1HG2 ILE 86 7.449 -6.436 -0.073 701 HG22 ILE 86 2HG2 ILE 86 7.314 -7.005 -1.736 702 HG23 ILE 86 3HG2 ILE 86 8.880 -6.498 -1.102 703 HD11 ILE 86 3HD1 ILE 86 9.697 -4.374 -3.296 704 HD12 ILE 86 1HD1 ILE 86 9.300 -6.092 -3.278 705 HD13 ILE 86 2HD1 ILE 86 8.947 -5.121 -4.707 706 HA PRO 87 HA PRO 87 5.081 -4.512 3.004 707 HB2 PRO 87 2HB PRO 87 4.739 -7.115 3.694 708 HB3 PRO 87 3HB PRO 87 3.465 -6.145 2.945 709 HG2 PRO 87 2HG PRO 87 5.326 -8.124 1.688 710 HG3 PRO 87 3HG PRO 87 3.587 -7.899 1.423 711 HD2 PRO 87 2HD PRO 87 5.458 -6.934 -0.281 712 HD3 PRO 87 3HD PRO 87 3.908 -6.115 -0.001 713 H THR 88 H THR 88 6.303 -4.788 4.872 714 HA THR 88 HA THR 88 9.055 -5.581 4.425 715 HB THR 88 HB THR 88 8.313 -4.830 7.163 716 HG1 THR 88 HG1 THR 88 7.465 -2.906 6.734 717 HG21 THR 88 3HG2 THR 88 10.141 -3.093 6.594 718 HG22 THR 88 1HG2 THR 88 10.358 -4.033 5.118 719 HG23 THR 88 2HG2 THR 88 10.597 -4.794 6.691 720 H VAL 89 H VAL 89 10.174 -6.818 6.224 721 HA VAL 89 HA VAL 89 9.268 -9.420 6.347 722 HB VAL 89 HB VAL 89 11.057 -8.041 8.355 723 HG11 VAL 89 1HG1 VAL 89 10.482 -10.936 7.798 724 HG12 VAL 89 2HG1 VAL 89 11.970 -10.410 8.588 725 HG13 VAL 89 3HG1 VAL 89 10.407 -10.074 9.334 726 HG21 VAL 89 3HG2 VAL 89 12.277 -7.760 6.459 727 HG22 VAL 89 1HG2 VAL 89 12.742 -9.423 6.814 728 HG23 VAL 89 2HG2 VAL 89 11.487 -9.094 5.620 729 H GLU 90 H GLU 90 9.178 -7.062 9.028 730 HA GLU 90 HA GLU 90 7.765 -8.578 10.851 731 HB2 GLU 90 2HB GLU 90 7.908 -5.616 10.371 732 HB3 GLU 90 3HB GLU 90 6.884 -6.270 11.642 733 HG2 GLU 90 2HG GLU 90 8.739 -7.188 12.790 734 HG3 GLU 90 3HG GLU 90 9.816 -6.883 11.428 735 H GLN 91 H GLN 91 6.434 -6.294 8.464 736 HA GLN 91 HA GLN 91 3.739 -6.662 9.055 737 HB2 GLN 91 2HB GLN 91 4.838 -6.150 6.292 738 HB3 GLN 91 3HB GLN 91 3.264 -5.682 6.923 739 HG2 GLN 91 2HG GLN 91 5.952 -4.515 7.526 740 HG3 GLN 91 3HG GLN 91 4.500 -3.713 6.929 741 HE21 GLN 91 1HE2 GLN 91 6.277 -3.261 9.296 742 HE22 GLN 91 2HE2 GLN 91 5.200 -3.207 10.646 743 H TRP 92 H TRP 92 5.859 -8.465 6.878 744 HA TRP 92 HA TRP 92 3.842 -10.119 5.778 745 HB2 TRP 92 2HB TRP 92 5.978 -9.865 4.656 746 HB3 TRP 92 3HB TRP 92 6.824 -10.551 6.040 747 HD1 TRP 92 HD1 TRP 92 3.955 -11.771 3.705 748 HE1 TRP 92 HE1 TRP 92 4.422 -14.232 3.114 749 HE3 TRP 92 HE3 TRP 92 8.265 -12.442 6.371 750 HZ2 TRP 92 HZ2 TRP 92 6.360 -16.198 3.701 751 HZ3 TRP 92 HZ3 TRP 92 9.363 -14.643 6.304 752 HH2 TRP 92 HH2 TRP 92 8.428 -16.481 4.996 753 H LYS 93 H LYS 93 5.941 -10.421 8.592 754 HA LYS 93 HA LYS 93 5.274 -13.108 9.204 755 HB2 LYS 93 2HB LYS 93 6.244 -10.933 11.068 756 HB3 LYS 93 3HB LYS 93 6.288 -12.663 11.381 757 HG2 LYS 93 2HG LYS 93 7.633 -11.792 8.916 758 HG3 LYS 93 3HG LYS 93 8.366 -11.243 10.425 759 HD2 LYS 93 2HD LYS 93 9.403 -13.239 10.379 760 HD3 LYS 93 3HD LYS 93 7.868 -13.850 11.001 761 HE2 LYS 93 2HE LYS 93 7.394 -13.823 8.323 762 HE3 LYS 93 3HE LYS 93 9.117 -14.194 8.366 763 HZ1 LYS 93 3HZ LYS 93 6.867 -15.740 9.475 764 HZ2 LYS 93 1HZ LYS 93 8.424 -15.929 10.110 765 HZ3 LYS 93 2HZ LYS 93 8.130 -16.262 8.478 766 H ASP 94 H ASP 94 3.876 -10.003 10.067 767 HA ASP 94 HA ASP 94 2.101 -11.024 12.051 768 HB2 ASP 94 2HB ASP 94 2.867 -8.613 11.798 769 HB3 ASP 94 3HB ASP 94 1.727 -8.486 10.461 770 H GLN 95 H GLN 95 1.655 -10.047 8.658 771 HA GLN 95 HA GLN 95 -1.071 -10.677 8.486 772 HB2 GLN 95 2HB GLN 95 -0.751 -10.655 6.065 773 HB3 GLN 95 3HB GLN 95 0.093 -9.309 6.817 774 HG2 GLN 95 2HG GLN 95 2.194 -10.592 6.680 775 HG3 GLN 95 3HG GLN 95 1.324 -11.875 5.839 776 HE21 GLN 95 1HE2 GLN 95 0.718 -11.590 3.720 777 HE22 GLN 95 2HE2 GLN 95 1.291 -10.282 2.748 778 H THR 96 H THR 96 1.815 -12.634 7.937 779 HA THR 96 HA THR 96 0.423 -14.917 6.962 780 HB THR 96 HB THR 96 2.562 -16.134 7.452 781 HG1 THR 96 HG1 THR 96 3.896 -15.217 8.802 782 HG21 THR 96 3HG2 THR 96 2.604 -13.579 5.861 783 HG22 THR 96 1HG2 THR 96 2.356 -15.224 5.278 784 HG23 THR 96 2HG2 THR 96 3.947 -14.722 5.853 785 H ARG 97 H ARG 97 1.662 -13.970 10.143 786 HA ARG 97 HA ARG 97 1.078 -16.367 11.486 787 HB2 ARG 97 2HB ARG 97 1.484 -13.529 12.358 788 HB3 ARG 97 3HB ARG 97 0.944 -14.731 13.521 789 HG2 ARG 97 2HG ARG 97 3.211 -15.657 11.972 790 HG3 ARG 97 3HG ARG 97 3.554 -14.159 12.839 791 HD2 ARG 97 2HD ARG 97 2.155 -16.339 14.297 792 HD3 ARG 97 3HD ARG 97 3.875 -16.533 13.965 793 HE ARG 97 HE ARG 97 3.235 -13.990 15.119 794 HH11 ARG 97 1HH1 ARG 97 3.903 -17.336 15.812 795 HH12 ARG 97 2HH1 ARG 97 4.463 -17.026 17.421 796 HH21 ARG 97 1HH2 ARG 97 3.971 -13.570 17.237 797 HH22 ARG 97 2HH2 ARG 97 4.501 -14.884 18.232 798 H ARG 98 H ARG 98 -0.865 -13.493 10.855 799 HA ARG 98 HA ARG 98 -3.091 -14.439 12.422 800 HB2 ARG 98 2HB ARG 98 -2.792 -12.119 10.511 801 HB3 ARG 98 3HB ARG 98 -4.267 -12.464 11.403 802 HG2 ARG 98 2HG ARG 98 -2.872 -12.301 13.508 803 HG3 ARG 98 3HG ARG 98 -1.594 -11.636 12.488 804 HD2 ARG 98 2HD ARG 98 -2.732 -9.769 13.354 805 HD3 ARG 98 3HD ARG 98 -3.312 -9.942 11.698 806 HE ARG 98 HE ARG 98 -5.084 -11.349 13.272 807 HH11 ARG 98 1HH1 ARG 98 -3.961 -8.062 13.031 808 HH12 ARG 98 2HH1 ARG 98 -5.447 -7.375 13.598 809 HH21 ARG 98 1HH2 ARG 98 -7.045 -10.456 14.021 810 HH22 ARG 98 2HH2 ARG 98 -7.200 -8.738 14.162 811 H TYR 99 H TYR 99 -2.079 -14.532 9.087 812 HA TYR 99 HA TYR 99 -4.639 -15.345 8.065 813 HB2 TYR 99 2HB TYR 99 -3.224 -14.180 6.545 814 HB3 TYR 99 3HB TYR 99 -1.870 -15.257 6.869 815 HD1 TYR 99 HD1 TYR 99 -5.444 -15.852 5.938 816 HD2 TYR 99 HD2 TYR 99 -1.345 -16.463 4.977 817 HE1 TYR 99 HE1 TYR 99 -6.107 -17.250 4.026 818 HE2 TYR 99 HE2 TYR 99 -1.997 -17.863 3.062 819 HH TYR 99 HH TYR 99 -4.809 -19.259 2.679 820 H LYS 100 H LYS 100 -1.920 -16.903 9.484 821 HA LYS 100 HA LYS 100 -2.657 -19.527 8.451 822 HB2 LYS 100 2HB LYS 100 -0.367 -18.471 10.077 823 HB3 LYS 100 3HB LYS 100 -0.695 -20.198 10.032 824 HG2 LYS 100 2HG LYS 100 -0.502 -18.733 7.454 825 HG3 LYS 100 3HG LYS 100 0.981 -19.066 8.350 826 HD2 LYS 100 2HD LYS 100 -1.044 -21.202 7.727 827 HD3 LYS 100 3HD LYS 100 0.273 -20.795 6.625 828 HE2 LYS 100 2HE LYS 100 1.766 -21.119 8.736 829 HE3 LYS 100 3HE LYS 100 0.385 -22.029 9.346 830 HZ1 LYS 100 3HZ LYS 100 1.802 -23.570 8.295 831 HZ2 LYS 100 1HZ LYS 100 2.000 -22.594 6.927 832 HZ3 LYS 100 2HZ LYS 100 0.511 -23.339 7.227 833 H GLU 101 H GLU 101 -3.095 -17.565 11.255 834 HA GLU 101 HA GLU 101 -3.878 -19.809 12.931 835 HB2 GLU 101 2HB GLU 101 -3.987 -18.282 14.720 836 HB3 GLU 101 3HB GLU 101 -2.610 -17.757 13.762 837 HG2 GLU 101 2HG GLU 101 -4.155 -16.102 12.659 838 HG3 GLU 101 3HG GLU 101 -5.344 -16.523 13.890 839 H SER 102 H SER 102 -5.328 -18.499 10.446 840 HA SER 102 HA SER 102 -7.470 -18.129 9.757 841 HB2 SER 102 2HB SER 102 -8.395 -19.857 12.038 842 HB3 SER 102 3HB SER 102 -9.027 -19.762 10.394 843 HG SER 102 HG SER 102 -7.335 -20.937 9.663 844 H SER 103 H SER 103 -6.594 -16.056 11.255 845 HA SER 103 HA SER 103 -8.286 -15.426 13.457 846 HB2 SER 103 2HB SER 103 -7.290 -13.217 13.359 847 HB3 SER 103 3HB SER 103 -6.029 -14.422 13.098 848 HG SER 103 HG SER 103 -7.199 -12.637 11.276 849 H ILE 104 H ILE 104 -9.183 -12.886 13.043 850 HA ILE 104 HA ILE 104 -11.542 -13.368 11.462 851 HB ILE 104 HB ILE 104 -10.801 -10.771 12.794 852 HG12 ILE 104 2HG1 ILE 104 -12.435 -12.920 14.117 853 HG13 ILE 104 3HG1 ILE 104 -10.681 -12.901 14.274 854 HG21 ILE 104 1HG2 ILE 104 -12.687 -10.306 11.602 855 HG22 ILE 104 2HG2 ILE 104 -13.264 -11.971 11.654 856 HG23 ILE 104 3HG2 ILE 104 -13.430 -10.936 13.072 857 HD11 ILE 104 3HD1 ILE 104 -12.074 -10.370 14.857 858 HD12 ILE 104 1HD1 ILE 104 -12.326 -11.694 15.993 859 HD13 ILE 104 2HD1 ILE 104 -10.692 -11.121 15.654 860 H GLN 105 H GLN 105 -12.334 -11.858 9.841 861 HA GLN 105 HA GLN 105 -10.643 -11.492 7.706 862 HB2 GLN 105 2HB GLN 105 -12.362 -10.294 6.665 863 HB3 GLN 105 3HB GLN 105 -13.207 -11.321 7.816 864 HG2 GLN 105 2HG GLN 105 -13.037 -9.271 9.389 865 HG3 GLN 105 3HG GLN 105 -12.740 -8.374 7.900 866 HE21 GLN 105 1HE2 GLN 105 -15.063 -9.279 10.004 867 HE22 GLN 105 2HE2 GLN 105 -16.448 -9.203 8.974 868 H ILE 106 H ILE 106 -10.049 -9.373 6.659 869 HA ILE 106 HA ILE 106 -9.009 -7.507 8.691 870 HB ILE 106 HB ILE 106 -7.719 -8.125 6.033 871 HG12 ILE 106 2HG1 ILE 106 -6.107 -8.955 8.220 872 HG13 ILE 106 3HG1 ILE 106 -7.711 -9.639 8.462 873 HG21 ILE 106 1HG2 ILE 106 -5.780 -6.958 7.061 874 HG22 ILE 106 2HG2 ILE 106 -7.183 -5.920 6.811 875 HG23 ILE 106 3HG2 ILE 106 -6.814 -6.531 8.424 876 HD11 ILE 106 3HD1 ILE 106 -6.083 -11.066 7.195 877 HD12 ILE 106 1HD1 ILE 106 -7.630 -10.783 6.398 878 HD13 ILE 106 2HD1 ILE 106 -6.196 -9.894 5.883 879 H GLY 107 H GLY 107 -9.614 -7.638 5.169 880 HA2 GLY 107 2HA GLY 107 -11.296 -5.285 5.341 881 HA3 GLY 107 3HA GLY 107 -9.768 -5.034 4.510 882 H ASN 108 H ASN 108 -12.292 -7.558 4.535 883 HA ASN 108 HA ASN 108 -11.996 -7.867 1.660 884 HB2 ASN 108 2HB ASN 108 -13.562 -9.363 3.759 885 HB3 ASN 108 3HB ASN 108 -13.759 -9.684 2.039 886 HD21 ASN 108 1HD2 ASN 108 -11.419 -9.764 0.954 887 HD22 ASN 108 2HD2 ASN 108 -10.358 -10.894 1.717 888 H GLY 109 H GLY 109 -13.205 -6.811 0.236 889 HA2 GLY 109 2HA GLY 109 -15.922 -6.544 0.166 890 HA3 GLY 109 3HA GLY 109 -15.388 -5.152 1.096 891 H HIS 110 H HIS 110 -16.709 -5.210 -1.496 892 HA HIS 110 HA HIS 110 -15.156 -3.257 -2.818 893 HB2 HIS 110 2HB HIS 110 -13.916 -5.386 -3.435 894 HB3 HIS 110 3HB HIS 110 -15.350 -5.855 -4.344 895 HD1 HIS 110 HD1 HIS 110 -15.152 -5.322 -6.738 896 HD2 HIS 110 HD2 HIS 110 -13.061 -2.608 -4.388 897 HE1 HIS 110 HE1 HIS 110 -14.084 -3.717 -8.353 898 H GLY 111 H GLY 111 -16.233 -2.353 -4.665 899 HA2 GLY 111 2HA GLY 111 -19.109 -2.968 -4.644 900 HA3 GLY 111 3HA GLY 111 -18.394 -1.443 -5.145 901 H GLN 112 H GLN 112 -19.694 -1.599 -7.062 902 HA GLN 112 HA GLN 112 -18.288 -2.635 -9.273 903 HB2 GLN 112 2HB GLN 112 -19.509 -4.683 -8.133 904 HB3 GLN 112 3HB GLN 112 -20.902 -4.052 -9.000 905 HG2 GLN 112 2HG GLN 112 -19.230 -4.064 -11.027 906 HG3 GLN 112 3HG GLN 112 -18.410 -5.279 -10.048 907 HE21 GLN 112 1HE2 GLN 112 -19.346 -7.265 -9.749 908 HE22 GLN 112 2HE2 GLN 112 -20.740 -7.793 -10.622 909 H SER 113 H SER 113 -18.996 -1.746 -11.172 910 HA SER 113 HA SER 113 -20.920 0.380 -10.945 911 HB2 SER 113 2HB SER 113 -19.252 -0.619 -13.261 912 HB3 SER 113 3HB SER 113 -20.340 0.765 -13.369 913 HG SER 113 HG SER 113 -17.846 0.636 -12.357 914 H GLN 114 H GLN 114 -22.286 0.568 -13.194 915 HA GLN 114 HA GLN 114 -23.631 -1.964 -13.733 916 HB2 GLN 114 2HB GLN 114 -24.776 -0.815 -11.792 917 HB3 GLN 114 3HB GLN 114 -25.202 0.476 -12.908 918 HG2 GLN 114 2HG GLN 114 -26.658 -0.865 -14.109 919 HG3 GLN 114 3HG GLN 114 -25.923 -2.357 -13.523 920 HE21 GLN 114 1HE2 GLN 114 -27.806 0.445 -12.496 921 HE22 GLN 114 2HE2 GLN 114 -28.668 -0.369 -11.240 922 H GLY 115 H GLY 115 -24.618 -2.073 -15.732 923 HA2 GLY 115 2HA GLY 115 -24.470 0.359 -17.397 924 HA3 GLY 115 3HA GLY 115 -23.832 -1.172 -17.979 925 H LEU 116 H LEU 116 -26.443 0.849 -18.071 926 HA LEU 116 HA LEU 116 -28.073 -1.176 -19.343 927 HB2 LEU 116 2HB LEU 116 -30.072 -0.249 -17.930 928 HB3 LEU 116 3HB LEU 116 -29.070 -1.569 -17.329 929 HG LEU 116 HG LEU 116 -27.791 0.120 -15.996 930 HD11 LEU 116 1HD1 LEU 116 -29.734 1.904 -17.331 931 HD12 LEU 116 2HD1 LEU 116 -28.080 2.213 -16.806 932 HD13 LEU 116 3HD1 LEU 116 -29.394 2.222 -15.630 933 HD21 LEU 116 3HD2 LEU 116 -30.479 0.522 -14.969 934 HD22 LEU 116 1HD2 LEU 116 -29.125 -0.374 -14.280 935 HD23 LEU 116 2HD2 LEU 116 -30.184 -1.147 -15.460 936 H GLU 117 H GLU 117 -30.221 -0.087 -20.097 937 HA GLU 117 HA GLU 117 -29.458 2.475 -21.302 938 HB2 GLU 117 2HB GLU 117 -30.218 0.392 -22.652 939 HB3 GLU 117 3HB GLU 117 -31.836 0.837 -22.128 940 HG2 GLU 117 2HG GLU 117 -31.731 1.904 -24.141 941 HG3 GLU 117 3HG GLU 117 -31.171 3.184 -23.066 942 H1 GLY -9 H GLY -9 8.740 -8.989 16.343 943 HA2 GLY -9 2HA GLY -9 7.409 -9.991 14.487 944 HA3 GLY -9 3HA GLY -9 8.512 -9.160 13.401 945 H LYS -8 H LYS -8 9.543 -10.774 12.382 946 HA LYS -8 HA LYS -8 11.373 -12.395 13.916 947 HB2 LYS -8 2HB LYS -8 8.881 -13.486 13.358 948 HB3 LYS -8 3HB LYS -8 9.913 -14.135 12.091 949 HG2 LYS -8 2HG LYS -8 11.511 -14.820 13.928 950 HG3 LYS -8 3HG LYS -8 10.217 -14.430 15.064 951 HD2 LYS -8 2HD LYS -8 9.270 -16.406 14.694 952 HD3 LYS -8 3HD LYS -8 9.149 -16.047 12.969 953 HE2 LYS -8 2HE LYS -8 11.526 -17.251 14.384 954 HE3 LYS -8 3HE LYS -8 10.393 -18.106 13.339 955 HZ1 LYS -8 3HZ LYS -8 11.446 -15.857 11.992 956 HZ2 LYS -8 1HZ LYS -8 11.553 -17.493 11.573 957 HZ3 LYS -8 2HZ LYS -8 12.716 -16.802 12.589 958 H PHE -7 H PHE -7 12.552 -13.958 12.300 959 HA PHE -7 HA PHE -7 13.970 -14.133 10.531 960 HB2 PHE -7 2HB PHE -7 11.510 -12.966 9.305 961 HB3 PHE -7 3HB PHE -7 12.976 -13.040 8.333 962 HD1 PHE -7 HD1 PHE -7 10.477 -15.038 10.150 963 HD2 PHE -7 HD2 PHE -7 13.784 -15.100 7.471 964 HE1 PHE -7 HE1 PHE -7 9.998 -17.392 9.618 965 HE2 PHE -7 HE2 PHE -7 13.310 -17.454 6.934 966 HZ PHE -7 HZ PHE -7 11.414 -18.603 8.007 967 H ILE -6 H ILE -6 14.035 -11.757 12.308 968 HA ILE -6 HA ILE -6 14.851 -9.540 10.671 969 HB ILE -6 HB ILE -6 14.943 -10.056 13.632 970 HG12 ILE -6 2HG1 ILE -6 13.512 -7.870 13.447 971 HG13 ILE -6 3HG1 ILE -6 13.332 -8.350 11.764 972 HG21 ILE -6 1HG2 ILE -6 15.685 -7.629 13.782 973 HG22 ILE -6 2HG2 ILE -6 16.908 -8.807 13.307 974 HG23 ILE -6 3HG2 ILE -6 16.152 -7.781 12.088 975 HD11 ILE -6 3HD1 ILE -6 12.786 -10.640 13.270 976 HD12 ILE -6 1HD1 ILE -6 11.966 -9.311 14.089 977 HD13 ILE -6 2HD1 ILE -6 11.643 -9.631 12.384 978 HA PRO -5 HA PRO -5 18.965 -11.186 10.073 979 HB2 PRO -5 2HB PRO -5 19.829 -9.142 8.510 980 HB3 PRO -5 3HB PRO -5 18.790 -10.439 7.907 981 HG2 PRO -5 2HG PRO -5 18.052 -7.673 8.783 982 HG3 PRO -5 3HG PRO -5 17.481 -8.592 7.377 983 HD2 PRO -5 2HD PRO -5 16.030 -8.356 9.652 984 HD3 PRO -5 3HD PRO -5 15.970 -9.804 8.626 985 H SER -4 H SER -4 18.507 -7.693 10.652 986 HA SER -4 HA SER -4 19.724 -6.183 11.854 987 HB2 SER -4 2HB SER -4 18.706 -7.912 13.583 988 HB3 SER -4 3HB SER -4 20.404 -8.306 13.845 989 HG SER -4 HG SER -4 20.777 -6.286 14.569 990 H ARG -3 H ARG -3 21.178 -7.675 9.843 991 HA ARG -3 HA ARG -3 23.872 -7.656 11.037 992 HB2 ARG -3 2HB ARG -3 22.589 -9.438 9.042 993 HB3 ARG -3 3HB ARG -3 24.273 -9.020 8.758 994 HG2 ARG -3 2HG ARG -3 23.984 -9.734 11.492 995 HG3 ARG -3 3HG ARG -3 23.211 -10.973 10.502 996 HD2 ARG -3 2HD ARG -3 25.267 -11.818 10.260 997 HD3 ARG -3 3HD ARG -3 25.532 -10.488 9.133 998 HE ARG -3 HE ARG -3 26.081 -9.641 11.768 999 HH11 ARG -3 1HH1 ARG -3 27.369 -11.649 9.232 1000 HH12 ARG -3 2HH1 ARG -3 29.015 -11.457 9.737 1001 HH21 ARG -3 1HH2 ARG -3 28.245 -9.380 12.443 1002 HH22 ARG -3 2HH2 ARG -3 29.512 -10.167 11.564 1003 HA PRO -2 HA PRO -2 25.152 -4.453 8.327 1004 HB2 PRO -2 2HB PRO -2 27.635 -5.250 7.573 1005 HB3 PRO -2 3HB PRO -2 27.265 -4.671 9.201 1006 HG2 PRO -2 2HG PRO -2 27.530 -7.481 8.204 1007 HG3 PRO -2 3HG PRO -2 28.145 -6.764 9.705 1008 HD2 PRO -2 2HD PRO -2 25.896 -8.269 9.624 1009 HD3 PRO -2 3HD PRO -2 26.105 -6.926 10.766 1010 H ALA -1 H ALA -1 25.006 -7.689 7.125 1011 HA ALA -1 HA ALA -1 24.536 -8.543 5.067 1012 HB1 ALA -1 1HB ALA -1 24.113 -6.135 3.553 1013 HB2 ALA -1 2HB ALA -1 22.959 -7.387 4.013 1014 HB3 ALA -1 3HB ALA -1 23.284 -6.043 5.108 1015 HA PRO 0 HA PRO 0 28.383 -8.359 2.940 1016 HB2 PRO 0 2HB PRO 0 27.694 -9.644 0.651 1017 HB3 PRO 0 3HB PRO 0 27.906 -10.479 2.194 1018 HG2 PRO 0 2HG PRO 0 25.383 -9.582 0.857 1019 HG3 PRO 0 3HG PRO 0 25.726 -11.110 1.688 1020 HD2 PRO 0 2HD PRO 0 24.351 -9.092 2.858 1021 HD3 PRO 0 3HD PRO 0 25.398 -10.192 3.777 1022 H LYS 1 H LYS 1 29.455 -7.303 1.246 1023 HA LYS 1 HA LYS 1 27.869 -5.206 -0.051 1024 HB2 LYS 1 2HB LYS 1 30.688 -5.441 0.854 1025 HB3 LYS 1 3HB LYS 1 30.393 -4.468 -0.581 1026 HG2 LYS 1 2HG LYS 1 28.745 -3.146 0.710 1027 HG3 LYS 1 3HG LYS 1 29.184 -4.070 2.148 1028 HD2 LYS 1 2HD LYS 1 31.375 -2.787 0.606 1029 HD3 LYS 1 3HD LYS 1 30.321 -1.741 1.561 1030 HE2 LYS 1 2HE LYS 1 31.912 -2.237 3.126 1031 HE3 LYS 1 3HE LYS 1 30.777 -3.554 3.419 1032 HZ1 LYS 1 3HZ LYS 1 32.137 -5.069 2.322 1033 HZ2 LYS 1 1HZ LYS 1 33.235 -4.128 3.201 1034 HZ3 LYS 1 2HZ LYS 1 33.036 -3.867 1.542 1035 HA PRO 2 HA PRO 2 28.372 -6.788 -4.113 1036 HB2 PRO 2 2HB PRO 2 28.867 -4.549 -5.565 1037 HB3 PRO 2 3HB PRO 2 27.280 -4.918 -4.880 1038 HG2 PRO 2 2HG PRO 2 29.412 -3.088 -3.845 1039 HG3 PRO 2 3HG PRO 2 27.659 -2.831 -3.925 1040 HD2 PRO 2 2HD PRO 2 28.921 -3.563 -1.644 1041 HD3 PRO 2 3HD PRO 2 27.263 -4.072 -2.023 1042 HA PRO 3 HA PRO 3 32.581 -7.472 -5.185 1043 HB2 PRO 3 2HB PRO 3 32.461 -7.689 -7.888 1044 HB3 PRO 3 3HB PRO 3 31.833 -8.929 -6.796 1045 HG2 PRO 3 2HG PRO 3 30.361 -6.769 -8.254 1046 HG3 PRO 3 3HG PRO 3 29.918 -8.471 -8.032 1047 HD2 PRO 3 2HD PRO 3 28.844 -6.480 -6.544 1048 HD3 PRO 3 3HD PRO 3 29.111 -8.114 -5.902 1049 H SER 4 H SER 4 33.363 -5.380 -4.525 1050 HA SER 4 HA SER 4 33.830 -3.521 -6.762 1051 HB2 SER 4 2HB SER 4 34.138 -2.729 -3.883 1052 HB3 SER 4 3HB SER 4 33.779 -1.717 -5.282 1053 HG SER 4 HG SER 4 31.715 -2.212 -5.131 1054 H SER 5 H SER 5 35.610 -5.022 -7.320 1055 HA SER 5 HA SER 5 37.890 -5.099 -5.548 1056 HB2 SER 5 2HB SER 5 38.973 -6.357 -7.388 1057 HB3 SER 5 3HB SER 5 37.409 -7.041 -6.947 1058 HG SER 5 HG SER 5 37.442 -6.913 -9.150 1059 H ALA 6 H ALA 6 40.077 -4.760 -7.005 1060 HA ALA 6 HA ALA 6 39.886 -2.049 -8.141 1061 HB1 ALA 6 1HB ALA 6 42.284 -1.830 -7.114 1062 HB2 ALA 6 2HB ALA 6 40.854 -1.538 -6.123 1063 HB3 ALA 6 3HB ALA 6 41.702 -3.081 -6.014 Start of MODEL 10 1 H1 MET -2 H MET -2 0.778 0.913 -6.750 2 HA MET -2 HA MET -2 3.707 0.689 -6.583 3 HB2 MET -2 2HB MET -2 2.473 -0.380 -4.630 4 HB3 MET -2 3HB MET -2 1.830 -1.534 -5.791 5 HG2 MET -2 2HG MET -2 4.595 -1.478 -6.219 6 HG3 MET -2 3HG MET -2 4.371 -1.500 -4.472 7 HE1 MET -2 3HE MET -2 5.289 -4.459 -6.816 8 HE2 MET -2 1HE MET -2 5.940 -3.387 -5.576 9 HE3 MET -2 2HE MET -2 5.374 -4.999 -5.138 10 H ALA -1 H ALA -1 4.684 -0.709 -8.067 11 HA ALA -1 HA ALA -1 2.946 -1.898 -10.111 12 HB1 ALA -1 1HB ALA -1 4.871 -1.041 -11.727 13 HB2 ALA -1 2HB ALA -1 3.456 -0.057 -11.347 14 HB3 ALA -1 3HB ALA -1 4.979 0.226 -10.504 15 HA PRO 1 HA PRO 1 5.643 -5.356 -9.996 16 HB2 PRO 1 2HB PRO 1 5.707 -6.135 -12.597 17 HB3 PRO 1 3HB PRO 1 4.287 -6.346 -11.565 18 HG2 PRO 1 2HG PRO 1 4.857 -4.217 -13.591 19 HG3 PRO 1 3HG PRO 1 3.351 -5.105 -13.295 20 HD2 PRO 1 2HD PRO 1 3.767 -2.594 -12.372 21 HD3 PRO 1 3HD PRO 1 2.775 -3.780 -11.499 22 H LEU 2 H LEU 2 7.779 -5.433 -9.746 23 HA LEU 2 HA LEU 2 9.479 -4.023 -11.698 24 HB2 LEU 2 2HB LEU 2 10.871 -3.276 -10.036 25 HB3 LEU 2 3HB LEU 2 9.302 -3.202 -9.237 26 HG LEU 2 HG LEU 2 10.196 -5.713 -8.572 27 HD11 LEU 2 1HD1 LEU 2 12.528 -4.861 -7.581 28 HD12 LEU 2 2HD1 LEU 2 12.506 -3.945 -9.087 29 HD13 LEU 2 3HD1 LEU 2 12.388 -5.704 -9.124 30 HD21 LEU 2 3HD2 LEU 2 10.026 -3.069 -7.251 31 HD22 LEU 2 1HD2 LEU 2 10.943 -4.325 -6.419 32 HD23 LEU 2 2HD2 LEU 2 9.252 -4.600 -6.837 33 H PHE 3 H PHE 3 11.582 -4.945 -12.096 34 HA PHE 3 HA PHE 3 11.778 -7.810 -11.458 35 HB2 PHE 3 2HB PHE 3 12.206 -6.501 -14.148 36 HB3 PHE 3 3HB PHE 3 12.708 -8.146 -13.771 37 HD1 PHE 3 HD2 PHE 3 9.700 -5.953 -13.740 38 HD2 PHE 3 HD1 PHE 3 11.254 -9.893 -14.160 39 HE1 PHE 3 HE2 PHE 3 7.459 -6.769 -14.344 40 HE2 PHE 3 HE1 PHE 3 9.015 -10.716 -14.765 41 HZ PHE 3 HZ PHE 3 7.114 -9.153 -14.856 42 H ALA 4 H ALA 4 13.890 -8.662 -11.344 43 HA ALA 4 HA ALA 4 16.077 -6.701 -11.380 44 HB1 ALA 4 1HB ALA 4 15.187 -8.387 -9.090 45 HB2 ALA 4 2HB ALA 4 16.906 -8.040 -9.283 46 HB3 ALA 4 3HB ALA 4 15.754 -6.716 -9.109 47 H VAL 5 H VAL 5 18.090 -7.507 -11.930 48 HA VAL 5 HA VAL 5 18.111 -10.297 -12.882 49 HB VAL 5 HB VAL 5 18.267 -8.674 -14.711 50 HG11 VAL 5 1HG1 VAL 5 20.968 -7.764 -14.051 51 HG12 VAL 5 2HG1 VAL 5 19.597 -6.869 -14.710 52 HG13 VAL 5 3HG1 VAL 5 19.718 -7.148 -12.972 53 HG21 VAL 5 3HG2 VAL 5 20.904 -9.475 -15.145 54 HG22 VAL 5 1HG2 VAL 5 20.207 -10.720 -14.108 55 HG23 VAL 5 2HG2 VAL 5 19.439 -10.320 -15.644 56 H THR 6 H THR 6 19.576 -11.642 -12.052 57 HA THR 6 HA THR 6 21.248 -10.834 -9.904 58 HB THR 6 HB THR 6 22.231 -13.290 -10.604 59 HG1 THR 6 HG1 THR 6 20.916 -14.053 -12.080 60 HG21 THR 6 3HG2 THR 6 21.390 -13.799 -8.597 61 HG22 THR 6 1HG2 THR 6 19.734 -13.559 -9.154 62 HG23 THR 6 2HG2 THR 6 20.679 -12.185 -8.579 63 H LEU 7 H LEU 7 23.334 -10.246 -9.860 64 HA LEU 7 HA LEU 7 24.759 -10.112 -12.419 65 HB2 LEU 7 2HB LEU 7 25.440 -8.749 -9.821 66 HB3 LEU 7 3HB LEU 7 26.151 -8.435 -11.403 67 HG LEU 7 HG LEU 7 23.225 -8.026 -11.119 68 HD11 LEU 7 1HD1 LEU 7 25.037 -6.848 -9.292 69 HD12 LEU 7 2HD1 LEU 7 23.322 -6.504 -9.514 70 HD13 LEU 7 3HD1 LEU 7 24.528 -5.597 -10.427 71 HD21 LEU 7 3HD2 LEU 7 25.476 -7.074 -12.769 72 HD22 LEU 7 1HD2 LEU 7 24.224 -5.886 -12.405 73 HD23 LEU 7 2HD2 LEU 7 23.798 -7.397 -13.209 74 H TYR 8 H TYR 8 24.766 -11.707 -9.382 75 HA TYR 8 HA TYR 8 27.328 -12.980 -10.074 76 HB2 TYR 8 2HB TYR 8 26.390 -12.207 -7.304 77 HB3 TYR 8 3HB TYR 8 27.836 -13.146 -7.656 78 HD1 TYR 8 HD2 TYR 8 26.253 -9.839 -8.293 79 HD2 TYR 8 HD1 TYR 8 29.869 -12.068 -8.057 80 HE1 TYR 8 HE2 TYR 8 27.543 -7.757 -8.512 81 HE2 TYR 8 HE1 TYR 8 31.170 -9.992 -8.274 82 HH TYR 8 HH TYR 8 30.298 -7.203 -7.658 83 H GLU 9 H GLU 9 27.601 -15.104 -8.870 84 HA GLU 9 HA GLU 9 25.162 -16.643 -9.236 85 HB2 GLU 9 2HB GLU 9 27.097 -17.586 -10.261 86 HB3 GLU 9 3HB GLU 9 28.042 -17.418 -8.788 87 HG2 GLU 9 2HG GLU 9 27.300 -19.346 -7.945 88 HG3 GLU 9 3HG GLU 9 25.644 -19.055 -8.474 89 H PHE 10 H PHE 10 23.823 -16.585 -7.536 90 HA PHE 10 HA PHE 10 24.890 -16.647 -4.826 91 HB2 PHE 10 2HB PHE 10 23.011 -15.103 -5.516 92 HB3 PHE 10 3HB PHE 10 21.991 -16.530 -5.667 93 HD1 PHE 10 HD2 PHE 10 24.478 -15.393 -3.127 94 HD2 PHE 10 HD1 PHE 10 20.494 -16.650 -3.940 95 HE1 PHE 10 HE2 PHE 10 23.952 -15.264 -0.727 96 HE2 PHE 10 HE1 PHE 10 19.961 -16.522 -1.541 97 HZ PHE 10 HZ PHE 10 21.691 -15.830 0.069 98 H LYS 11 H LYS 11 25.499 -18.631 -4.204 99 HA LYS 11 HA LYS 11 24.006 -20.981 -5.005 100 HB2 LYS 11 2HB LYS 11 26.424 -20.679 -3.214 101 HB3 LYS 11 3HB LYS 11 25.739 -22.213 -3.732 102 HG2 LYS 11 2HG LYS 11 26.977 -20.113 -5.499 103 HG3 LYS 11 3HG LYS 11 27.670 -21.680 -5.070 104 HD2 LYS 11 2HD LYS 11 25.393 -22.562 -6.084 105 HD3 LYS 11 3HD LYS 11 25.455 -21.023 -6.948 106 HE2 LYS 11 2HE LYS 11 26.546 -22.485 -8.388 107 HE3 LYS 11 3HE LYS 11 27.872 -21.702 -7.530 108 HZ1 LYS 11 3HZ LYS 11 27.778 -24.290 -7.807 109 HZ2 LYS 11 1HZ LYS 11 26.793 -24.194 -6.434 110 HZ3 LYS 11 2HZ LYS 11 28.372 -23.590 -6.386 111 H ALA 12 H ALA 12 22.126 -21.300 -3.988 112 HA ALA 12 HA ALA 12 21.396 -20.372 -1.470 113 HB1 ALA 12 1HB ALA 12 19.815 -21.180 -3.183 114 HB2 ALA 12 2HB ALA 12 20.335 -22.833 -2.852 115 HB3 ALA 12 3HB ALA 12 19.525 -21.895 -1.597 116 H GLU 13 H GLU 13 20.974 -21.587 0.502 117 HA GLU 13 HA GLU 13 22.831 -23.835 0.904 118 HB2 GLU 13 2HB GLU 13 23.136 -22.883 3.261 119 HB3 GLU 13 3HB GLU 13 23.959 -22.058 1.944 120 HG2 GLU 13 2HG GLU 13 22.112 -20.412 1.881 121 HG3 GLU 13 3HG GLU 13 21.409 -21.203 3.291 122 H ARG 14 H ARG 14 19.911 -22.166 1.968 123 HA ARG 14 HA ARG 14 19.058 -24.617 3.354 124 HB2 ARG 14 2HB ARG 14 18.431 -21.717 3.749 125 HB3 ARG 14 3HB ARG 14 17.255 -22.926 4.248 126 HG2 ARG 14 2HG ARG 14 20.119 -22.954 5.156 127 HG3 ARG 14 3HG ARG 14 18.831 -22.124 6.031 128 HD2 ARG 14 2HD ARG 14 18.738 -25.046 5.309 129 HD3 ARG 14 3HD ARG 14 19.372 -24.445 6.840 130 HE ARG 14 HE ARG 14 16.829 -23.368 6.511 131 HH11 ARG 14 1HH1 ARG 14 18.305 -26.495 6.917 132 HH12 ARG 14 2HH1 ARG 14 16.927 -27.187 7.708 133 HH21 ARG 14 1HH2 ARG 14 15.010 -24.267 7.551 134 HH22 ARG 14 2HH2 ARG 14 15.053 -25.919 8.067 135 H ASP 15 H ASP 15 16.482 -24.649 3.384 136 HA ASP 15 HA ASP 15 15.699 -25.256 0.731 137 HB2 ASP 15 2HB ASP 15 14.834 -26.261 2.943 138 HB3 ASP 15 3HB ASP 15 13.770 -24.858 3.008 139 H ASP 16 H ASP 16 15.144 -22.503 2.846 140 HA ASP 16 HA ASP 16 13.189 -21.239 1.222 141 HB2 ASP 16 2HB ASP 16 15.051 -20.140 3.335 142 HB3 ASP 16 3HB ASP 16 13.775 -19.199 2.567 143 H GLU 17 H GLU 17 16.692 -20.737 1.591 144 HA GLU 17 HA GLU 17 16.979 -18.651 -0.231 145 HB2 GLU 17 2HB GLU 17 18.684 -19.808 1.411 146 HB3 GLU 17 3HB GLU 17 19.102 -20.746 -0.016 147 HG2 GLU 17 2HG GLU 17 20.609 -19.035 -0.156 148 HG3 GLU 17 3HG GLU 17 19.295 -18.407 -1.149 149 H LEU 18 H LEU 18 17.126 -18.511 -2.402 150 HA LEU 18 HA LEU 18 16.802 -21.010 -3.927 151 HB2 LEU 18 2HB LEU 18 15.024 -19.074 -3.885 152 HB3 LEU 18 3HB LEU 18 16.112 -18.342 -5.062 153 HG LEU 18 HG LEU 18 15.833 -20.293 -6.523 154 HD11 LEU 18 1HD1 LEU 18 13.505 -21.421 -5.283 155 HD12 LEU 18 2HD1 LEU 18 14.886 -21.522 -4.191 156 HD13 LEU 18 3HD1 LEU 18 14.990 -22.215 -5.809 157 HD21 LEU 18 3HD2 LEU 18 13.128 -19.927 -6.566 158 HD22 LEU 18 1HD2 LEU 18 14.310 -18.860 -7.325 159 HD23 LEU 18 2HD2 LEU 18 13.681 -18.480 -5.721 160 H ASP 19 H ASP 19 18.309 -21.549 -5.372 161 HA ASP 19 HA ASP 19 20.690 -19.984 -5.609 162 HB2 ASP 19 2HB ASP 19 19.992 -22.348 -7.340 163 HB3 ASP 19 3HB ASP 19 21.586 -21.794 -6.834 164 H VAL 20 H VAL 20 21.463 -18.834 -7.340 165 HA VAL 20 HA VAL 20 19.949 -18.703 -9.809 166 HB VAL 20 HB VAL 20 18.739 -17.072 -8.500 167 HG11 VAL 20 1HG1 VAL 20 20.328 -16.577 -6.775 168 HG12 VAL 20 2HG1 VAL 20 21.447 -15.871 -7.943 169 HG13 VAL 20 3HG1 VAL 20 19.914 -15.071 -7.594 170 HG21 VAL 20 3HG2 VAL 20 20.596 -15.531 -10.297 171 HG22 VAL 20 1HG2 VAL 20 19.350 -16.617 -10.911 172 HG23 VAL 20 2HG2 VAL 20 18.898 -15.209 -9.950 173 H SER 21 H SER 21 21.133 -17.928 -11.536 174 HA SER 21 HA SER 21 23.988 -17.499 -10.986 175 HB2 SER 21 2HB SER 21 22.486 -18.771 -13.225 176 HB3 SER 21 3HB SER 21 24.006 -17.966 -13.611 177 HG SER 21 HG SER 21 23.530 -20.254 -12.095 178 HA PRO 22 HA PRO 22 23.963 -13.387 -12.512 179 HB2 PRO 22 2HB PRO 22 26.280 -13.270 -13.922 180 HB3 PRO 22 3HB PRO 22 26.232 -13.342 -12.157 181 HG2 PRO 22 2HG PRO 22 26.717 -15.541 -14.130 182 HG3 PRO 22 3HG PRO 22 27.554 -15.203 -12.603 183 HD2 PRO 22 2HD PRO 22 25.646 -17.111 -12.827 184 HD3 PRO 22 3HD PRO 22 25.900 -16.186 -11.334 185 H GLY 23 H GLY 23 22.664 -12.598 -14.040 186 HA2 GLY 23 2HA GLY 23 22.445 -11.922 -16.360 187 HA3 GLY 23 3HA GLY 23 23.074 -13.496 -16.821 188 H GLU 24 H GLU 24 20.985 -13.889 -14.261 189 HA GLU 24 HA GLU 24 18.909 -14.884 -16.050 190 HB2 GLU 24 2HB GLU 24 19.582 -15.313 -13.161 191 HB3 GLU 24 3HB GLU 24 17.973 -15.703 -13.751 192 HG2 GLU 24 2HG GLU 24 19.281 -17.032 -15.577 193 HG3 GLU 24 3HG GLU 24 20.587 -16.974 -14.394 194 H ASN 25 H ASN 25 16.625 -14.503 -15.508 195 HA ASN 25 HA ASN 25 16.231 -11.735 -14.594 196 HB2 ASN 25 2HB ASN 25 14.505 -13.433 -16.411 197 HB3 ASN 25 3HB ASN 25 14.152 -11.776 -15.930 198 HD21 ASN 25 1HD2 ASN 25 14.835 -10.219 -17.213 199 HD22 ASN 25 2HD2 ASN 25 16.044 -10.373 -18.438 200 H LEU 26 H LEU 26 15.118 -11.373 -12.790 201 HA LEU 26 HA LEU 26 13.322 -13.477 -11.789 202 HB2 LEU 26 2HB LEU 26 15.205 -11.817 -10.120 203 HB3 LEU 26 3HB LEU 26 14.063 -13.015 -9.515 204 HG LEU 26 HG LEU 26 15.992 -14.045 -11.475 205 HD11 LEU 26 1HD1 LEU 26 16.913 -12.426 -9.272 206 HD12 LEU 26 2HD1 LEU 26 17.829 -13.179 -10.577 207 HD13 LEU 26 3HD1 LEU 26 17.462 -14.095 -9.115 208 HD21 LEU 26 3HD2 LEU 26 15.668 -15.967 -10.347 209 HD22 LEU 26 1HD2 LEU 26 14.251 -15.126 -9.718 210 HD23 LEU 26 2HD2 LEU 26 15.737 -15.178 -8.770 211 H SER 27 H SER 27 11.493 -12.785 -10.681 212 HA SER 27 HA SER 27 10.855 -9.941 -11.054 213 HB2 SER 27 2HB SER 27 9.445 -11.886 -12.076 214 HB3 SER 27 3HB SER 27 8.802 -12.046 -10.441 215 HG SER 27 HG SER 27 7.690 -10.571 -11.998 216 H ILE 28 H ILE 28 11.103 -8.753 -9.287 217 HA ILE 28 HA ILE 28 11.001 -9.924 -6.651 218 HB ILE 28 HB ILE 28 11.385 -7.052 -7.504 219 HG12 ILE 28 2HG1 ILE 28 13.355 -9.164 -6.601 220 HG13 ILE 28 3HG1 ILE 28 13.203 -8.514 -8.230 221 HG21 ILE 28 1HG2 ILE 28 11.728 -8.333 -4.796 222 HG22 ILE 28 2HG2 ILE 28 12.153 -6.673 -5.208 223 HG23 ILE 28 3HG2 ILE 28 10.467 -7.188 -5.254 224 HD11 ILE 28 3HD1 ILE 28 14.030 -6.969 -5.785 225 HD12 ILE 28 1HD1 ILE 28 15.099 -7.550 -7.061 226 HD13 ILE 28 2HD1 ILE 28 13.886 -6.320 -7.418 227 H CYS 29 H CYS 29 9.519 -9.476 -5.033 228 HA CYS 29 HA CYS 29 7.015 -8.210 -5.934 229 HB2 CYS 29 2HB CYS 29 7.375 -10.472 -3.957 230 HB3 CYS 29 3HB CYS 29 5.839 -9.717 -4.365 231 HG CYS 29 HG CYS 29 7.781 -11.706 -6.343 232 H ALA 30 H ALA 30 9.337 -8.571 -3.338 233 HA ALA 30 HA ALA 30 8.592 -6.024 -2.241 234 HB1 ALA 30 1HB ALA 30 7.611 -8.497 -1.016 235 HB2 ALA 30 2HB ALA 30 8.430 -7.403 0.100 236 HB3 ALA 30 3HB ALA 30 7.046 -6.836 -0.835 237 H HIS 31 H HIS 31 9.913 -5.640 -0.138 238 HA HIS 31 HA HIS 31 12.554 -6.911 -0.442 239 HB2 HIS 31 2HB HIS 31 13.647 -4.844 -0.125 240 HB3 HIS 31 3HB HIS 31 12.346 -4.496 -1.260 241 HD1 HIS 31 HD1 HIS 31 13.891 -2.925 1.399 242 HD2 HIS 31 HD2 HIS 31 9.901 -3.719 0.558 243 HE1 HIS 31 HE1 HIS 31 12.575 -1.272 2.762 244 H TYR 32 H TYR 32 13.943 -6.252 1.614 245 HA TYR 32 HA TYR 32 12.322 -6.421 4.042 246 HB2 TYR 32 2HB TYR 32 12.871 -8.749 3.320 247 HB3 TYR 32 3HB TYR 32 14.579 -8.349 3.464 248 HD1 TYR 32 HD2 TYR 32 15.593 -7.996 5.664 249 HD2 TYR 32 HD1 TYR 32 11.505 -9.109 5.277 250 HE1 TYR 32 HE2 TYR 32 15.540 -8.609 8.046 251 HE2 TYR 32 HE1 TYR 32 11.440 -9.725 7.658 252 HH TYR 32 HH TYR 32 12.843 -8.970 9.792 253 H ASP 33 H ASP 33 12.970 -4.501 4.864 254 HA ASP 33 HA ASP 33 14.302 -2.903 5.788 255 HB2 ASP 33 2HB ASP 33 14.798 -4.829 7.294 256 HB3 ASP 33 3HB ASP 33 16.189 -5.214 6.284 257 H TYR 34 H TYR 34 14.693 -3.714 2.915 258 HA TYR 34 HA TYR 34 15.974 -3.056 1.155 259 HB2 TYR 34 2HB TYR 34 17.504 -1.379 3.150 260 HB3 TYR 34 3HB TYR 34 17.415 -1.140 1.409 261 HD1 TYR 34 HD2 TYR 34 15.601 -0.811 4.586 262 HD2 TYR 34 HD1 TYR 34 15.498 -0.087 0.394 263 HE1 TYR 34 HE2 TYR 34 13.671 0.681 4.897 264 HE2 TYR 34 HE1 TYR 34 13.568 1.408 0.694 265 HH TYR 34 HH TYR 34 12.731 2.838 3.260 266 H GLU 35 H GLU 35 16.843 -5.176 3.238 267 HA GLU 35 HA GLU 35 19.682 -5.337 2.505 268 HB2 GLU 35 2HB GLU 35 18.309 -7.129 4.489 269 HB3 GLU 35 3HB GLU 35 20.018 -6.740 4.361 270 HG2 GLU 35 2HG GLU 35 17.822 -4.905 5.287 271 HG3 GLU 35 3HG GLU 35 19.069 -5.651 6.284 272 H TRP 36 H TRP 36 16.660 -7.167 2.462 273 HA TRP 36 HA TRP 36 17.886 -8.985 0.492 274 HB2 TRP 36 2HB TRP 36 15.793 -9.628 2.580 275 HB3 TRP 36 3HB TRP 36 16.311 -10.732 1.308 276 HD1 TRP 36 HD1 TRP 36 17.459 -9.230 4.622 277 HE1 TRP 36 HE1 TRP 36 19.514 -10.536 5.456 278 HE3 TRP 36 HE3 TRP 36 18.320 -12.113 0.489 279 HZ2 TRP 36 HZ2 TRP 36 21.269 -12.525 4.490 280 HZ3 TRP 36 HZ3 TRP 36 20.207 -13.692 0.525 281 HH2 TRP 36 HH2 TRP 36 21.650 -13.891 2.485 282 H PHE 37 H PHE 37 16.278 -9.998 -0.993 283 HA PHE 37 HA PHE 37 13.946 -8.282 -1.484 284 HB2 PHE 37 2HB PHE 37 16.286 -8.675 -3.218 285 HB3 PHE 37 3HB PHE 37 14.742 -8.920 -4.028 286 HD1 PHE 37 HD2 PHE 37 12.951 -6.998 -3.100 287 HD2 PHE 37 HD1 PHE 37 17.159 -6.600 -3.596 288 HE1 PHE 37 HE2 PHE 37 12.689 -4.564 -3.338 289 HE2 PHE 37 HE1 PHE 37 16.904 -4.164 -3.833 290 HZ PHE 37 HZ PHE 37 14.666 -3.143 -3.705 291 H ILE 38 H ILE 38 12.134 -9.376 -1.910 292 HA ILE 38 HA ILE 38 12.298 -12.280 -2.118 293 HB ILE 38 HB ILE 38 9.742 -10.712 -1.965 294 HG12 ILE 38 2HG1 ILE 38 11.111 -9.853 -0.157 295 HG13 ILE 38 3HG1 ILE 38 9.885 -10.926 0.508 296 HG21 ILE 38 1HG2 ILE 38 9.081 -12.858 -2.220 297 HG22 ILE 38 2HG2 ILE 38 10.597 -13.512 -1.601 298 HG23 ILE 38 3HG2 ILE 38 9.372 -12.916 -0.482 299 HD11 ILE 38 3HD1 ILE 38 12.697 -11.034 0.816 300 HD12 ILE 38 1HD1 ILE 38 11.467 -12.085 1.517 301 HD13 ILE 38 2HD1 ILE 38 12.179 -12.482 -0.047 302 H ALA 39 H ALA 39 12.869 -12.691 -4.228 303 HA ALA 39 HA ALA 39 10.884 -11.904 -6.259 304 HB1 ALA 39 1HB ALA 39 12.463 -11.020 -7.543 305 HB2 ALA 39 2HB ALA 39 13.606 -11.238 -6.217 306 HB3 ALA 39 3HB ALA 39 13.430 -12.492 -7.445 307 H LYS 40 H LYS 40 10.835 -13.399 -8.151 308 HA LYS 40 HA LYS 40 11.473 -16.166 -7.371 309 HB2 LYS 40 2HB LYS 40 9.332 -16.759 -8.673 310 HB3 LYS 40 3HB LYS 40 9.156 -16.096 -7.054 311 HG2 LYS 40 2HG LYS 40 8.338 -14.088 -7.815 312 HG3 LYS 40 3HG LYS 40 9.102 -14.254 -9.397 313 HD2 LYS 40 2HD LYS 40 7.490 -16.278 -9.667 314 HD3 LYS 40 3HD LYS 40 6.585 -15.502 -8.365 315 HE2 LYS 40 2HE LYS 40 7.392 -14.128 -10.924 316 HE3 LYS 40 3HE LYS 40 5.823 -14.888 -10.662 317 HZ1 LYS 40 3HZ LYS 40 5.123 -13.172 -9.444 318 HZ2 LYS 40 1HZ LYS 40 6.421 -12.313 -10.107 319 HZ3 LYS 40 2HZ LYS 40 6.576 -13.041 -8.588 320 HA PRO 41 HA PRO 41 13.319 -16.675 -11.320 321 HB2 PRO 41 2HB PRO 41 12.707 -19.257 -11.890 322 HB3 PRO 41 3HB PRO 41 13.891 -18.800 -10.660 323 HG2 PRO 41 2HG PRO 41 11.028 -19.607 -10.326 324 HG3 PRO 41 3HG PRO 41 12.443 -20.086 -9.372 325 HD2 PRO 41 2HD PRO 41 10.706 -18.181 -8.545 326 HD3 PRO 41 3HD PRO 41 12.435 -18.133 -8.148 327 H ILE 42 H ILE 42 12.825 -16.269 -13.401 328 HA ILE 42 HA ILE 42 10.003 -16.503 -14.195 329 HB ILE 42 HB ILE 42 12.169 -14.766 -15.384 330 HG12 ILE 42 2HG1 ILE 42 9.804 -14.054 -13.635 331 HG13 ILE 42 3HG1 ILE 42 11.493 -14.036 -13.139 332 HG21 ILE 42 1HG2 ILE 42 9.714 -15.651 -16.465 333 HG22 ILE 42 2HG2 ILE 42 9.525 -13.946 -16.057 334 HG23 ILE 42 3HG2 ILE 42 10.831 -14.457 -17.126 335 HD11 ILE 42 3HD1 ILE 42 10.743 -11.798 -13.596 336 HD12 ILE 42 1HD1 ILE 42 11.931 -12.282 -14.806 337 HD13 ILE 42 2HD1 ILE 42 10.214 -12.270 -15.211 338 H ASN 43 H ASN 43 13.311 -17.057 -15.339 339 HA ASN 43 HA ASN 43 12.633 -18.162 -17.836 340 HB2 ASN 43 2HB ASN 43 14.895 -17.408 -17.367 341 HB3 ASN 43 3HB ASN 43 15.068 -18.617 -16.099 342 HD21 ASN 43 1HD2 ASN 43 15.414 -17.931 -19.389 343 HD22 ASN 43 2HD2 ASN 43 15.842 -19.516 -19.926 344 H ARG 43 H ARG 43 13.417 -19.742 -14.743 345 HA ARG 43 HA ARG 43 12.315 -22.247 -15.813 346 HB2 ARG 43 2HB ARG 43 13.444 -23.262 -13.778 347 HB3 ARG 43 3HB ARG 43 14.512 -22.613 -15.016 348 HG2 ARG 43 2HG ARG 43 13.761 -20.754 -12.857 349 HG3 ARG 43 3HG ARG 43 14.789 -22.113 -12.397 350 HD2 ARG 43 2HD ARG 43 15.471 -20.523 -14.827 351 HD3 ARG 43 3HD ARG 43 15.836 -19.859 -13.235 352 HE ARG 43 HE ARG 43 17.200 -21.991 -14.566 353 HH11 ARG 43 1HH1 ARG 43 16.334 -20.704 -11.449 354 HH12 ARG 43 2HH1 ARG 43 17.669 -21.442 -10.628 355 HH21 ARG 43 1HH2 ARG 43 18.962 -22.968 -13.496 356 HH22 ARG 43 2HH2 ARG 43 19.164 -22.729 -11.793 357 H LEU 44 H LEU 44 11.502 -23.628 -13.737 358 HA LEU 44 HA LEU 44 9.524 -21.925 -12.370 359 HB2 LEU 44 2HB LEU 44 9.231 -24.445 -13.876 360 HB3 LEU 44 3HB LEU 44 8.320 -24.335 -12.372 361 HG LEU 44 HG LEU 44 8.117 -22.424 -14.699 362 HD11 LEU 44 1HD1 LEU 44 5.874 -23.394 -14.971 363 HD12 LEU 44 2HD1 LEU 44 6.250 -24.579 -13.721 364 HD13 LEU 44 3HD1 LEU 44 7.154 -24.578 -15.235 365 HD21 LEU 44 3HD2 LEU 44 7.058 -22.401 -11.934 366 HD22 LEU 44 1HD2 LEU 44 5.954 -21.921 -13.223 367 HD23 LEU 44 2HD2 LEU 44 7.478 -21.061 -13.002 368 H GLY 45 H GLY 45 9.791 -21.876 -10.244 369 HA2 GLY 45 2HA GLY 45 10.490 -24.332 -8.824 370 HA3 GLY 45 3HA GLY 45 11.589 -22.973 -8.647 371 H GLY 46 H GLY 46 10.015 -20.824 -8.374 372 HA2 GLY 46 2HA GLY 46 7.822 -20.397 -7.128 373 HA3 GLY 46 3HA GLY 46 8.523 -21.451 -5.909 374 HA PRO 47 HA PRO 47 9.720 -16.892 -5.314 375 HB2 PRO 47 2HB PRO 47 8.165 -16.375 -3.150 376 HB3 PRO 47 3HB PRO 47 7.622 -16.102 -4.810 377 HG2 PRO 47 2HG PRO 47 7.051 -18.405 -2.984 378 HG3 PRO 47 3HG PRO 47 5.948 -17.535 -4.066 379 HD2 PRO 47 2HD PRO 47 7.034 -19.929 -4.712 380 HD3 PRO 47 3HD PRO 47 6.661 -18.691 -5.928 381 H GLY 48 H GLY 48 11.677 -17.015 -4.400 382 HA2 GLY 48 2HA GLY 48 11.909 -18.401 -1.800 383 HA3 GLY 48 3HA GLY 48 13.200 -18.332 -2.991 384 H LEU 49 H LEU 49 14.792 -17.165 -2.136 385 HA LEU 49 HA LEU 49 14.199 -14.435 -1.287 386 HB2 LEU 49 2HB LEU 49 14.552 -16.394 0.590 387 HB3 LEU 49 3HB LEU 49 16.182 -15.748 0.417 388 HG LEU 49 HG LEU 49 15.296 -14.533 2.186 389 HD11 LEU 49 1HD1 LEU 49 14.633 -12.830 -0.209 390 HD12 LEU 49 2HD1 LEU 49 16.264 -13.109 0.398 391 HD13 LEU 49 3HD1 LEU 49 15.080 -12.276 1.405 392 HD21 LEU 49 3HD2 LEU 49 12.737 -14.345 0.604 393 HD22 LEU 49 1HD2 LEU 49 13.036 -13.504 2.126 394 HD23 LEU 49 2HD2 LEU 49 13.013 -15.268 2.082 395 H VAL 50 H VAL 50 15.591 -13.049 -2.160 396 HA VAL 50 HA VAL 50 18.297 -13.973 -2.833 397 HB VAL 50 HB VAL 50 17.067 -14.100 -4.908 398 HG11 VAL 50 1HG1 VAL 50 15.246 -12.556 -4.264 399 HG12 VAL 50 2HG1 VAL 50 16.348 -11.199 -4.505 400 HG13 VAL 50 3HG1 VAL 50 15.897 -12.223 -5.869 401 HG21 VAL 50 3HG2 VAL 50 18.816 -11.644 -4.808 402 HG22 VAL 50 1HG2 VAL 50 19.359 -13.306 -5.041 403 HG23 VAL 50 2HG2 VAL 50 18.368 -12.521 -6.271 404 HA PRO 51 HA PRO 51 19.343 -10.213 -0.733 405 HB2 PRO 51 2HB PRO 51 21.996 -10.248 -1.308 406 HB3 PRO 51 3HB PRO 51 21.263 -11.299 -0.090 407 HG2 PRO 51 2HG PRO 51 22.017 -11.918 -2.921 408 HG3 PRO 51 3HG PRO 51 22.255 -12.895 -1.460 409 HD2 PRO 51 2HD PRO 51 20.239 -13.354 -3.209 410 HD3 PRO 51 3HD PRO 51 20.081 -13.661 -1.468 411 H VAL 52 H VAL 52 20.224 -8.104 -1.215 412 HA VAL 52 HA VAL 52 19.637 -7.282 -3.923 413 HB VAL 52 HB VAL 52 20.688 -5.487 -1.750 414 HG11 VAL 52 1HG1 VAL 52 20.510 -4.078 -3.489 415 HG12 VAL 52 2HG1 VAL 52 19.445 -5.161 -4.387 416 HG13 VAL 52 3HG1 VAL 52 18.786 -4.119 -3.126 417 HG21 VAL 52 3HG2 VAL 52 17.988 -5.170 -1.624 418 HG22 VAL 52 1HG2 VAL 52 18.128 -6.911 -1.872 419 HG23 VAL 52 2HG2 VAL 52 18.938 -6.147 -0.504 420 H SER 53 H SER 53 22.422 -8.021 -2.046 421 HA SER 53 HA SER 53 24.289 -6.473 -3.574 422 HB2 SER 53 2HB SER 53 24.594 -8.692 -1.553 423 HB3 SER 53 3HB SER 53 25.979 -7.992 -2.391 424 HG SER 53 HG SER 53 24.100 -6.406 -0.993 425 H TYR 54 H TYR 54 22.510 -9.151 -4.320 426 HA TYR 54 HA TYR 54 24.495 -10.029 -6.311 427 HB2 TYR 54 2HB TYR 54 22.519 -11.755 -4.806 428 HB3 TYR 54 3HB TYR 54 23.528 -12.311 -6.137 429 HD1 TYR 54 HD1 TYR 54 23.730 -10.801 -2.738 430 HD2 TYR 54 HD2 TYR 54 25.661 -13.153 -5.711 431 HE1 TYR 54 HE1 TYR 54 25.528 -11.328 -1.145 432 HE2 TYR 54 HE2 TYR 54 27.464 -13.688 -4.126 433 HH TYR 54 HH TYR 54 27.233 -13.195 -0.845 434 H VAL 55 H VAL 55 21.651 -8.486 -5.872 435 HA VAL 55 HA VAL 55 20.640 -9.332 -8.508 436 HB VAL 55 HB VAL 55 19.273 -9.657 -6.141 437 HG11 VAL 55 1HG1 VAL 55 17.515 -8.045 -6.039 438 HG12 VAL 55 2HG1 VAL 55 19.045 -7.166 -6.029 439 HG13 VAL 55 3HG1 VAL 55 18.083 -7.249 -7.506 440 HG21 VAL 55 3HG2 VAL 55 18.333 -9.403 -8.987 441 HG22 VAL 55 1HG2 VAL 55 18.683 -10.871 -8.073 442 HG23 VAL 55 2HG2 VAL 55 17.263 -9.903 -7.677 443 H ARG 56 H ARG 56 19.808 -7.721 -9.852 444 HA ARG 56 HA ARG 56 20.344 -4.956 -8.987 445 HB2 ARG 56 2HB ARG 56 22.054 -5.313 -10.519 446 HB3 ARG 56 3HB ARG 56 21.069 -6.368 -11.524 447 HG2 ARG 56 2HG ARG 56 19.841 -4.501 -12.388 448 HG3 ARG 56 3HG ARG 56 20.643 -3.401 -11.265 449 HD2 ARG 56 2HD ARG 56 21.571 -3.297 -13.554 450 HD3 ARG 56 3HD ARG 56 22.764 -3.769 -12.345 451 HE ARG 56 HE ARG 56 21.890 -6.144 -13.247 452 HH11 ARG 56 1HH1 ARG 56 22.989 -3.276 -14.885 453 HH12 ARG 56 2HH1 ARG 56 23.622 -4.138 -16.248 454 HH21 ARG 56 1HH2 ARG 56 22.721 -7.292 -15.035 455 HH22 ARG 56 2HH2 ARG 56 23.469 -6.423 -16.332 456 H ILE 57 H ILE 57 18.448 -3.972 -8.754 457 HA ILE 57 HA ILE 57 16.048 -4.795 -9.997 458 HB ILE 57 HB ILE 57 16.855 -2.410 -8.390 459 HG12 ILE 57 2HG1 ILE 57 15.076 -3.221 -6.916 460 HG13 ILE 57 3HG1 ILE 57 14.632 -4.444 -8.101 461 HG21 ILE 57 1HG2 ILE 57 14.381 -2.643 -10.072 462 HG22 ILE 57 2HG2 ILE 57 14.424 -1.657 -8.611 463 HG23 ILE 57 3HG2 ILE 57 15.512 -1.295 -9.951 464 HD11 ILE 57 3HD1 ILE 57 16.772 -5.538 -7.806 465 HD12 ILE 57 1HD1 ILE 57 17.275 -4.286 -6.671 466 HD13 ILE 57 2HD1 ILE 57 15.943 -5.367 -6.259 467 H ILE 58 H ILE 58 15.665 -4.649 -12.104 468 HA ILE 58 HA ILE 58 16.353 -2.134 -13.474 469 HB ILE 58 HB ILE 58 16.583 -3.580 -15.571 470 HG12 ILE 58 2HG1 ILE 58 17.366 -5.789 -13.716 471 HG13 ILE 58 3HG1 ILE 58 15.666 -5.601 -14.133 472 HG21 ILE 58 1HG2 ILE 58 18.938 -4.423 -14.374 473 HG22 ILE 58 2HG2 ILE 58 18.662 -2.884 -15.188 474 HG23 ILE 58 3HG2 ILE 58 18.455 -3.006 -13.441 475 HD11 ILE 58 3HD1 ILE 58 17.134 -5.451 -16.535 476 HD12 ILE 58 1HD1 ILE 58 17.749 -6.830 -15.623 477 HD13 ILE 58 2HD1 ILE 58 16.029 -6.717 -16.001 478 H ASP 59 H ASP 59 14.848 -1.310 -14.871 479 HA ASP 59 HA ASP 59 12.147 -2.130 -14.509 480 HB2 ASP 59 2HB ASP 59 12.721 0.217 -14.868 481 HB3 ASP 59 3HB ASP 59 13.352 -0.163 -16.468 482 H LEU 60 H LEU 60 11.040 -3.626 -15.572 483 HA LEU 60 HA LEU 60 12.121 -5.286 -17.523 484 HB2 LEU 60 2HB LEU 60 10.295 -6.103 -16.298 485 HB3 LEU 60 3HB LEU 60 9.299 -4.703 -16.689 486 HG LEU 60 HG LEU 60 9.202 -5.513 -19.044 487 HD11 LEU 60 1HD1 LEU 60 11.298 -6.886 -18.855 488 HD12 LEU 60 2HD1 LEU 60 9.932 -7.692 -19.625 489 HD13 LEU 60 3HD1 LEU 60 10.351 -8.071 -17.955 490 HD21 LEU 60 3HD2 LEU 60 7.573 -6.082 -17.078 491 HD22 LEU 60 1HD2 LEU 60 8.206 -7.714 -17.294 492 HD23 LEU 60 2HD2 LEU 60 7.409 -6.892 -18.636 493 H MET 61 H MET 61 10.589 -2.201 -17.819 494 HA MET 61 HA MET 61 10.212 -2.494 -20.694 495 HB2 MET 61 2HB MET 61 9.639 -0.163 -18.856 496 HB3 MET 61 3HB MET 61 9.237 -0.227 -20.566 497 HG2 MET 61 2HG MET 61 7.242 -0.897 -19.798 498 HG3 MET 61 3HG MET 61 8.030 -2.472 -19.728 499 HE1 MET 61 3HE MET 61 7.812 -3.876 -18.001 500 HE2 MET 61 1HE MET 61 7.306 -3.543 -16.344 501 HE3 MET 61 2HE MET 61 6.166 -3.333 -17.673 502 H ASP 62 H ASP 62 12.369 -1.006 -18.402 503 HA ASP 62 HA ASP 62 14.141 -0.258 -20.602 504 HB2 ASP 62 2HB ASP 62 13.785 1.692 -18.353 505 HB3 ASP 62 3HB ASP 62 14.412 1.967 -19.976 506 HA PRO 63 HA PRO 63 16.322 -2.448 -17.166 507 HB2 PRO 63 2HB PRO 63 17.797 -4.024 -18.813 508 HB3 PRO 63 3HB PRO 63 16.163 -4.447 -18.289 509 HG2 PRO 63 2HG PRO 63 17.067 -3.221 -20.866 510 HG3 PRO 63 3HG PRO 63 15.876 -4.507 -20.595 511 HD2 PRO 63 2HD PRO 63 15.163 -1.938 -21.064 512 HD3 PRO 63 3HD PRO 63 14.211 -3.019 -20.028 513 H ALA 64 H ALA 64 17.134 -0.378 -19.710 514 HA ALA 64 HA ALA 64 19.981 -0.322 -19.054 515 HB1 ALA 64 1HB ALA 64 20.340 0.531 -21.101 516 HB2 ALA 64 2HB ALA 64 18.717 -0.075 -21.438 517 HB3 ALA 64 3HB ALA 64 18.954 1.618 -21.005 518 H LYS 65 H LYS 65 17.163 1.112 -18.007 519 HA LYS 65 HA LYS 65 18.252 3.745 -17.498 520 HB2 LYS 65 2HB LYS 65 15.630 2.393 -16.957 521 HB3 LYS 65 3HB LYS 65 16.033 3.891 -16.126 522 HG2 LYS 65 2HG LYS 65 16.605 4.546 -18.696 523 HG3 LYS 65 3HG LYS 65 15.259 3.425 -18.913 524 HD2 LYS 65 2HD LYS 65 14.287 5.568 -18.710 525 HD3 LYS 65 3HD LYS 65 14.033 4.777 -17.153 526 HE2 LYS 65 2HE LYS 65 15.465 6.165 -16.060 527 HE3 LYS 65 3HE LYS 65 16.506 6.376 -17.467 528 HZ1 LYS 65 3HZ LYS 65 15.264 8.090 -18.247 529 HZ2 LYS 65 1HZ LYS 65 14.943 8.289 -16.598 530 HZ3 LYS 65 2HZ LYS 65 13.816 7.511 -17.591 531 H TYR 66 H TYR 66 17.147 1.000 -15.512 532 HA TYR 66 HA TYR 66 18.542 2.142 -13.207 533 HB2 TYR 66 2HB TYR 66 16.548 -0.111 -13.462 534 HB3 TYR 66 3HB TYR 66 17.375 0.279 -11.958 535 HD1 TYR 66 HD1 TYR 66 15.397 2.017 -14.616 536 HD2 TYR 66 HD2 TYR 66 16.262 1.638 -10.468 537 HE1 TYR 66 HE1 TYR 66 13.669 3.693 -14.109 538 HE2 TYR 66 HE2 TYR 66 14.536 3.312 -9.949 539 HH TYR 66 HH TYR 66 13.159 5.311 -12.269 540 H ALA 67 H ALA 67 19.849 0.812 -15.554 541 HA ALA 67 HA ALA 67 20.936 -1.639 -14.455 542 HB1 ALA 67 1HB ALA 67 20.662 -0.536 -17.041 543 HB2 ALA 67 2HB ALA 67 22.387 -0.754 -16.743 544 HB3 ALA 67 3HB ALA 67 21.287 -2.123 -16.590 545 H SER 68 H SER 68 21.689 1.699 -14.442 546 HA SER 68 HA SER 68 24.510 1.255 -13.851 547 HB2 SER 68 2HB SER 68 24.691 3.703 -13.866 548 HB3 SER 68 3HB SER 68 23.893 3.129 -15.330 549 HG SER 68 HG SER 68 22.678 4.806 -14.579 550 H VAL 69 H VAL 69 21.516 1.859 -12.244 551 HA VAL 69 HA VAL 69 22.284 3.072 -9.886 552 HB VAL 69 HB VAL 69 19.936 2.466 -10.565 553 HG11 VAL 69 1HG1 VAL 69 19.127 0.355 -10.486 554 HG12 VAL 69 2HG1 VAL 69 20.820 -0.060 -10.765 555 HG13 VAL 69 3HG1 VAL 69 20.157 -0.106 -9.131 556 HG21 VAL 69 3HG2 VAL 69 19.249 2.825 -8.449 557 HG22 VAL 69 1HG2 VAL 69 20.164 1.459 -7.811 558 HG23 VAL 69 2HG2 VAL 69 20.974 2.994 -8.122 559 H ASP 70 H ASP 70 22.729 2.218 -7.774 560 HA ASP 70 HA ASP 70 24.264 -0.293 -7.879 561 HB2 ASP 70 2HB ASP 70 24.588 2.096 -6.051 562 HB3 ASP 70 3HB ASP 70 25.527 0.610 -5.940 563 H THR 71 H THR 71 22.698 -1.759 -7.323 564 HA THR 71 HA THR 71 20.724 -1.439 -5.376 565 HB THR 71 HB THR 71 21.322 -4.154 -5.316 566 HG1 THR 71 HG1 THR 71 22.615 -4.420 -6.976 567 HG21 THR 71 3HG2 THR 71 19.351 -4.408 -6.580 568 HG22 THR 71 1HG2 THR 71 19.586 -2.872 -7.412 569 HG23 THR 71 2HG2 THR 71 19.135 -2.892 -5.707 570 H TYR 72 H TYR 72 24.040 -2.614 -5.112 571 HA TYR 72 HA TYR 72 23.985 -3.637 -2.534 572 HB2 TYR 72 2HB TYR 72 25.933 -3.966 -3.882 573 HB3 TYR 72 3HB TYR 72 26.190 -2.232 -4.045 574 HD1 TYR 72 HD1 TYR 72 25.441 -4.200 -0.975 575 HD2 TYR 72 HD2 TYR 72 28.298 -1.879 -3.107 576 HE1 TYR 72 HE1 TYR 72 26.927 -4.242 0.984 577 HE2 TYR 72 HE2 TYR 72 29.794 -1.915 -1.155 578 HH TYR 72 HH TYR 72 29.792 -2.287 1.158 579 H ASP 73 H ASP 73 24.520 -0.303 -3.609 580 HA ASP 73 HA ASP 73 25.027 0.793 -1.065 581 HB2 ASP 73 2HB ASP 73 25.553 1.945 -3.191 582 HB3 ASP 73 3HB ASP 73 23.829 2.156 -3.486 583 H ARG 74 H ARG 74 23.672 0.646 0.598 584 HA ARG 74 HA ARG 74 20.963 0.114 0.527 585 HB2 ARG 74 2HB ARG 74 20.897 0.656 2.831 586 HB3 ARG 74 3HB ARG 74 22.517 0.040 2.530 587 HG2 ARG 74 2HG ARG 74 21.859 2.972 2.580 588 HG3 ARG 74 3HG ARG 74 22.371 2.066 4.005 589 HD2 ARG 74 2HD ARG 74 23.919 2.527 1.463 590 HD3 ARG 74 3HD ARG 74 24.298 3.129 3.077 591 HE ARG 74 HE ARG 74 24.305 0.439 3.392 592 HH11 ARG 74 1HH1 ARG 74 25.894 2.603 1.175 593 HH12 ARG 74 2HH1 ARG 74 27.285 1.589 0.978 594 HH21 ARG 74 1HH2 ARG 74 26.132 -0.904 3.141 595 HH22 ARG 74 2HH2 ARG 74 27.419 -0.406 2.096 596 H GLU 75 H GLU 75 22.624 3.145 0.127 597 HA GLU 75 HA GLU 75 20.431 4.868 0.606 598 HB2 GLU 75 2HB GLU 75 23.068 5.143 -0.783 599 HB3 GLU 75 3HB GLU 75 21.864 6.411 -0.963 600 HG2 GLU 75 2HG GLU 75 21.766 6.562 1.527 601 HG3 GLU 75 3HG GLU 75 23.129 5.446 1.587 602 H GLN 76 H GLN 76 21.892 3.790 -2.466 603 HA GLN 76 HA GLN 76 19.973 4.913 -4.154 604 HB2 GLN 76 2HB GLN 76 21.608 2.412 -4.610 605 HB3 GLN 76 3HB GLN 76 20.799 3.352 -5.856 606 HG2 GLN 76 2HG GLN 76 22.370 5.205 -4.534 607 HG3 GLN 76 3HG GLN 76 23.373 3.758 -4.604 608 HE21 GLN 76 1HE2 GLN 76 24.759 4.050 -6.202 609 HE22 GLN 76 2HE2 GLN 76 24.362 4.558 -7.804 610 H VAL 77 H VAL 77 20.220 1.538 -3.025 611 HA VAL 77 HA VAL 77 17.896 0.559 -4.169 612 HB VAL 77 HB VAL 77 19.697 -0.738 -2.910 613 HG11 VAL 77 1HG1 VAL 77 19.577 0.554 -0.827 614 HG12 VAL 77 2HG1 VAL 77 17.939 -0.045 -0.559 615 HG13 VAL 77 3HG1 VAL 77 19.301 -1.165 -0.550 616 HG21 VAL 77 3HG2 VAL 77 16.791 -1.238 -2.983 617 HG22 VAL 77 1HG2 VAL 77 18.126 -2.192 -3.629 618 HG23 VAL 77 2HG2 VAL 77 17.728 -2.280 -1.913 619 H MET 78 H MET 78 18.323 2.452 -1.250 620 HA MET 78 HA MET 78 15.734 2.054 -0.179 621 HB2 MET 78 2HB MET 78 18.010 3.865 0.318 622 HB3 MET 78 3HB MET 78 16.436 4.494 0.784 623 HG2 MET 78 2HG MET 78 16.071 2.409 2.097 624 HG3 MET 78 3HG MET 78 17.736 1.958 1.738 625 HE1 MET 78 3HE MET 78 19.833 3.670 4.173 626 HE2 MET 78 1HE MET 78 19.582 2.457 2.917 627 HE3 MET 78 2HE MET 78 19.829 4.145 2.474 628 H LYS 79 H LYS 79 17.112 4.768 -2.036 629 HA LYS 79 HA LYS 79 14.797 6.294 -2.248 630 HB2 LYS 79 2HB LYS 79 17.139 6.017 -4.133 631 HB3 LYS 79 3HB LYS 79 15.875 7.224 -4.332 632 HG2 LYS 79 2HG LYS 79 16.582 8.464 -2.552 633 HG3 LYS 79 3HG LYS 79 17.274 7.072 -1.716 634 HD2 LYS 79 2HD LYS 79 19.018 7.017 -3.561 635 HD3 LYS 79 3HD LYS 79 18.412 8.603 -4.043 636 HE2 LYS 79 2HE LYS 79 19.188 8.104 -1.201 637 HE3 LYS 79 3HE LYS 79 20.436 8.415 -2.407 638 HZ1 LYS 79 3HZ LYS 79 19.763 10.454 -1.328 639 HZ2 LYS 79 1HZ LYS 79 18.149 10.199 -1.766 640 HZ3 LYS 79 2HZ LYS 79 19.311 10.494 -2.958 641 H ILE 80 H ILE 80 15.914 3.580 -4.193 642 HA ILE 80 HA ILE 80 13.977 3.808 -6.243 643 HB ILE 80 HB ILE 80 15.464 1.357 -5.292 644 HG12 ILE 80 2HG1 ILE 80 16.132 2.840 -7.794 645 HG13 ILE 80 3HG1 ILE 80 16.642 3.535 -6.259 646 HG21 ILE 80 1HG2 ILE 80 13.612 1.851 -7.568 647 HG22 ILE 80 2HG2 ILE 80 14.980 0.766 -7.808 648 HG23 ILE 80 3HG2 ILE 80 13.793 0.423 -6.549 649 HD11 ILE 80 3HD1 ILE 80 18.409 2.215 -6.290 650 HD12 ILE 80 1HD1 ILE 80 17.346 0.812 -6.193 651 HD13 ILE 80 2HD1 ILE 80 17.837 1.440 -7.766 652 H ILE 81 H ILE 81 14.126 1.680 -3.388 653 HA ILE 81 HA ILE 81 11.602 0.496 -3.770 654 HB ILE 81 HB ILE 81 13.167 0.878 -1.215 655 HG12 ILE 81 2HG1 ILE 81 12.908 -1.590 -2.938 656 HG13 ILE 81 3HG1 ILE 81 14.232 -0.440 -3.097 657 HG21 ILE 81 1HG2 ILE 81 11.346 0.153 -0.164 658 HG22 ILE 81 2HG2 ILE 81 10.515 -0.157 -1.687 659 HG23 ILE 81 3HG2 ILE 81 11.569 -1.388 -0.992 660 HD11 ILE 81 3HD1 ILE 81 14.222 -2.652 -1.499 661 HD12 ILE 81 1HD1 ILE 81 15.298 -1.266 -1.327 662 HD13 ILE 81 2HD1 ILE 81 13.822 -1.361 -0.365 663 H ASP 82 H ASP 82 12.605 3.448 -2.164 664 HA ASP 82 HA ASP 82 10.128 3.944 -0.850 665 HB2 ASP 82 2HB ASP 82 12.164 4.989 -0.045 666 HB3 ASP 82 3HB ASP 82 12.393 5.807 -1.588 667 H GLU 83 H GLU 83 11.575 5.124 -3.870 668 HA GLU 83 HA GLU 83 9.395 6.798 -4.569 669 HB2 GLU 83 2HB GLU 83 11.720 5.653 -6.087 670 HB3 GLU 83 3HB GLU 83 10.458 6.549 -6.921 671 HG2 GLU 83 2HG GLU 83 12.037 7.638 -4.605 672 HG3 GLU 83 3HG GLU 83 12.457 7.894 -6.298 673 H PHE 84 H PHE 84 10.350 3.537 -5.614 674 HA PHE 84 HA PHE 84 8.123 3.162 -7.331 675 HB2 PHE 84 2HB PHE 84 10.199 1.361 -6.138 676 HB3 PHE 84 3HB PHE 84 8.802 0.658 -6.947 677 HD1 PHE 84 HD1 PHE 84 11.404 3.269 -7.517 678 HD2 PHE 84 HD2 PHE 84 8.968 0.206 -9.190 679 HE1 PHE 84 HE1 PHE 84 12.516 3.576 -9.690 680 HE2 PHE 84 HE2 PHE 84 10.077 0.508 -11.366 681 HZ PHE 84 HZ PHE 84 11.854 2.194 -11.618 682 H LYS 85 H LYS 85 8.445 3.120 -3.958 683 HA LYS 85 HA LYS 85 7.033 2.603 -2.251 684 HB2 LYS 85 2HB LYS 85 4.954 2.500 -4.445 685 HB3 LYS 85 3HB LYS 85 4.624 2.614 -2.722 686 HG2 LYS 85 2HG LYS 85 6.365 4.697 -3.898 687 HG3 LYS 85 3HG LYS 85 4.653 4.732 -4.327 688 HD2 LYS 85 2HD LYS 85 4.041 4.794 -1.976 689 HD3 LYS 85 3HD LYS 85 5.740 4.673 -1.511 690 HE2 LYS 85 2HE LYS 85 6.206 6.815 -2.535 691 HE3 LYS 85 3HE LYS 85 4.550 6.924 -3.129 692 HZ1 LYS 85 3HZ LYS 85 5.546 7.784 -0.675 693 HZ2 LYS 85 1HZ LYS 85 4.504 6.491 -0.353 694 HZ3 LYS 85 2HZ LYS 85 3.945 7.832 -1.220 695 H ILE 86 H ILE 86 8.505 0.497 -3.023 696 HA ILE 86 HA ILE 86 6.890 -1.800 -3.633 697 HB ILE 86 HB ILE 86 9.708 -1.811 -2.562 698 HG12 ILE 86 2HG1 ILE 86 8.812 -1.660 -5.448 699 HG13 ILE 86 3HG1 ILE 86 9.516 -0.326 -4.540 700 HG21 ILE 86 1HG2 ILE 86 8.234 -3.926 -2.725 701 HG22 ILE 86 2HG2 ILE 86 8.504 -3.785 -4.461 702 HG23 ILE 86 3HG2 ILE 86 9.874 -3.981 -3.369 703 HD11 ILE 86 3HD1 ILE 86 11.055 -1.590 -6.090 704 HD12 ILE 86 1HD1 ILE 86 11.613 -1.377 -4.430 705 HD13 ILE 86 2HD1 ILE 86 10.950 -2.928 -4.946 706 HA PRO 87 HA PRO 87 5.590 -2.617 0.519 707 HB2 PRO 87 2HB PRO 87 4.640 -5.123 0.087 708 HB3 PRO 87 3HB PRO 87 3.779 -3.668 -0.429 709 HG2 PRO 87 2HG PRO 87 5.518 -5.507 -2.028 710 HG3 PRO 87 3HG PRO 87 3.965 -4.772 -2.467 711 HD2 PRO 87 2HD PRO 87 6.336 -3.794 -3.335 712 HD3 PRO 87 3HD PRO 87 4.933 -2.754 -3.019 713 H THR 88 H THR 88 5.992 -4.177 2.244 714 HA THR 88 HA THR 88 8.689 -5.285 2.041 715 HB THR 88 HB THR 88 7.483 -5.558 4.658 716 HG1 THR 88 HG1 THR 88 7.213 -3.331 5.063 717 HG21 THR 88 3HG2 THR 88 9.462 -3.960 5.153 718 HG22 THR 88 1HG2 THR 88 9.884 -4.220 3.461 719 HG23 THR 88 2HG2 THR 88 9.809 -5.588 4.571 720 H VAL 89 H VAL 89 9.051 -7.346 3.359 721 HA VAL 89 HA VAL 89 7.728 -9.475 2.160 722 HB VAL 89 HB VAL 89 9.192 -9.488 4.803 723 HG11 VAL 89 1HG1 VAL 89 9.617 -11.923 3.982 724 HG12 VAL 89 2HG1 VAL 89 8.099 -11.522 4.786 725 HG13 VAL 89 3HG1 VAL 89 8.158 -11.658 3.028 726 HG21 VAL 89 3HG2 VAL 89 10.940 -10.543 3.087 727 HG22 VAL 89 1HG2 VAL 89 10.079 -9.478 1.977 728 HG23 VAL 89 2HG2 VAL 89 10.858 -8.812 3.412 729 H GLU 90 H GLU 90 7.359 -8.296 5.507 730 HA GLU 90 HA GLU 90 5.359 -10.006 6.340 731 HB2 GLU 90 2HB GLU 90 6.079 -7.193 7.079 732 HB3 GLU 90 3HB GLU 90 4.638 -7.931 7.766 733 HG2 GLU 90 2HG GLU 90 5.933 -9.678 8.766 734 HG3 GLU 90 3HG GLU 90 7.392 -9.126 7.945 735 H GLN 91 H GLN 91 4.972 -6.818 4.802 736 HA GLN 91 HA GLN 91 2.185 -6.764 4.756 737 HB2 GLN 91 2HB GLN 91 3.969 -5.590 2.625 738 HB3 GLN 91 3HB GLN 91 2.372 -5.036 3.109 739 HG2 GLN 91 2HG GLN 91 4.945 -4.827 4.640 740 HG3 GLN 91 3HG GLN 91 3.932 -3.522 4.025 741 HE21 GLN 91 1HE2 GLN 91 4.909 -4.443 6.769 742 HE22 GLN 91 2HE2 GLN 91 3.481 -4.406 7.740 743 H TRP 92 H TRP 92 4.476 -8.041 2.373 744 HA TRP 92 HA TRP 92 2.594 -8.747 0.413 745 HB2 TRP 92 2HB TRP 92 5.043 -8.643 0.030 746 HB3 TRP 92 3HB TRP 92 5.238 -10.092 1.011 747 HD1 TRP 92 HD1 TRP 92 2.850 -9.300 -1.960 748 HE1 TRP 92 HE1 TRP 92 3.054 -11.221 -3.661 749 HE3 TRP 92 HE3 TRP 92 6.398 -12.114 0.414 750 HZ2 TRP 92 HZ2 TRP 92 4.524 -13.613 -3.957 751 HZ3 TRP 92 HZ3 TRP 92 7.148 -14.205 -0.645 752 HH2 TRP 92 HH2 TRP 92 6.228 -14.937 -2.785 753 H LYS 93 H LYS 93 3.911 -10.568 3.149 754 HA LYS 93 HA LYS 93 2.701 -13.032 2.586 755 HB2 LYS 93 2HB LYS 93 3.358 -11.859 5.295 756 HB3 LYS 93 3HB LYS 93 3.076 -13.560 4.948 757 HG2 LYS 93 2HG LYS 93 5.197 -12.228 3.383 758 HG3 LYS 93 3HG LYS 93 5.512 -12.479 5.101 759 HD2 LYS 93 2HD LYS 93 6.281 -14.470 4.309 760 HD3 LYS 93 3HD LYS 93 4.581 -14.901 4.516 761 HE2 LYS 93 2HE LYS 93 4.482 -13.909 2.031 762 HE3 LYS 93 3HE LYS 93 6.153 -14.470 2.045 763 HZ1 LYS 93 3HZ LYS 93 5.449 -16.665 2.539 764 HZ2 LYS 93 1HZ LYS 93 4.497 -16.129 1.246 765 HZ3 LYS 93 2HZ LYS 93 3.852 -16.177 2.809 766 H ASP 94 H ASP 94 1.615 -10.428 4.765 767 HA ASP 94 HA ASP 94 -0.820 -11.604 5.492 768 HB2 ASP 94 2HB ASP 94 0.041 -9.751 6.761 769 HB3 ASP 94 3HB ASP 94 0.003 -8.700 5.348 770 H GLN 95 H GLN 95 0.048 -9.557 2.760 771 HA GLN 95 HA GLN 95 -2.536 -9.021 1.814 772 HB2 GLN 95 2HB GLN 95 0.186 -9.064 0.579 773 HB3 GLN 95 3HB GLN 95 -1.220 -8.925 -0.469 774 HG2 GLN 95 2HG GLN 95 -1.717 -7.058 1.485 775 HG3 GLN 95 3HG GLN 95 0.028 -6.950 1.258 776 HE21 GLN 95 1HE2 GLN 95 0.621 -5.515 -0.183 777 HE22 GLN 95 2HE2 GLN 95 -0.273 -5.035 -1.581 778 H THR 96 H THR 96 -0.241 -11.558 0.815 779 HA THR 96 HA THR 96 -1.958 -12.836 -1.000 780 HB THR 96 HB THR 96 -0.405 -14.898 -0.193 781 HG1 THR 96 HG1 THR 96 0.561 -13.615 1.470 782 HG21 THR 96 3HG2 THR 96 -0.584 -13.568 -2.422 783 HG22 THR 96 1HG2 THR 96 0.886 -14.478 -2.077 784 HG23 THR 96 2HG2 THR 96 0.853 -12.731 -1.835 785 H ARG 97 H ARG 97 -1.363 -13.407 2.447 786 HA ARG 97 HA ARG 97 -2.926 -15.710 2.735 787 HB2 ARG 97 2HB ARG 97 -2.177 -13.525 4.672 788 HB3 ARG 97 3HB ARG 97 -3.118 -14.928 5.159 789 HG2 ARG 97 2HG ARG 97 -0.998 -16.073 3.865 790 HG3 ARG 97 3HG ARG 97 -0.261 -14.672 4.646 791 HD2 ARG 97 2HD ARG 97 -1.211 -15.373 6.790 792 HD3 ARG 97 3HD ARG 97 -1.947 -16.771 6.007 793 HE ARG 97 HE ARG 97 0.717 -16.977 5.433 794 HH11 ARG 97 1HH1 ARG 97 -1.175 -16.732 8.345 795 HH12 ARG 97 2HH1 ARG 97 -0.059 -17.647 9.303 796 HH21 ARG 97 1HH2 ARG 97 2.195 -18.183 6.683 797 HH22 ARG 97 2HH2 ARG 97 1.858 -18.471 8.357 798 H ARG 98 H ARG 98 -3.824 -12.368 3.618 799 HA ARG 98 HA ARG 98 -6.509 -12.863 4.140 800 HB2 ARG 98 2HB ARG 98 -5.168 -10.359 3.110 801 HB3 ARG 98 3HB ARG 98 -6.834 -10.420 3.671 802 HG2 ARG 98 2HG ARG 98 -5.804 -11.383 5.845 803 HG3 ARG 98 3HG ARG 98 -4.304 -10.683 5.233 804 HD2 ARG 98 2HD ARG 98 -5.466 -9.140 6.732 805 HD3 ARG 98 3HD ARG 98 -5.365 -8.496 5.093 806 HE ARG 98 HE ARG 98 -7.800 -9.858 5.388 807 HH11 ARG 98 1HH1 ARG 98 -6.191 -6.981 6.507 808 HH12 ARG 98 2HH1 ARG 98 -7.660 -6.093 6.741 809 HH21 ARG 98 1HH2 ARG 98 -9.741 -8.699 5.692 810 HH22 ARG 98 2HH2 ARG 98 -9.679 -7.071 6.278 811 H TYR 99 H TYR 99 -4.879 -12.185 1.097 812 HA TYR 99 HA TYR 99 -7.145 -11.743 -0.496 813 HB2 TYR 99 2HB TYR 99 -4.926 -11.194 -1.300 814 HB3 TYR 99 3HB TYR 99 -4.442 -12.884 -1.228 815 HD1 TYR 99 HD1 TYR 99 -7.386 -11.080 -2.672 816 HD2 TYR 99 HD2 TYR 99 -4.153 -13.765 -3.334 817 HE1 TYR 99 HE1 TYR 99 -8.123 -11.383 -4.998 818 HE2 TYR 99 HE2 TYR 99 -4.881 -14.075 -5.663 819 HH TYR 99 HH TYR 99 -6.436 -13.616 -7.183 820 H LYS 100 H LYS 100 -5.342 -14.728 0.180 821 HA LYS 100 HA LYS 100 -7.101 -16.368 -1.371 822 HB2 LYS 100 2HB LYS 100 -4.761 -16.810 0.409 823 HB3 LYS 100 3HB LYS 100 -5.848 -18.170 0.160 824 HG2 LYS 100 2HG LYS 100 -4.595 -16.613 -2.087 825 HG3 LYS 100 3HG LYS 100 -3.889 -18.073 -1.389 826 HD2 LYS 100 2HD LYS 100 -6.722 -18.104 -2.342 827 HD3 LYS 100 3HD LYS 100 -5.405 -18.233 -3.510 828 HE2 LYS 100 2HE LYS 100 -4.704 -20.270 -2.695 829 HE3 LYS 100 3HE LYS 100 -5.385 -19.982 -1.094 830 HZ1 LYS 100 3HZ LYS 100 -7.611 -20.036 -2.467 831 HZ2 LYS 100 1HZ LYS 100 -6.890 -21.458 -1.901 832 HZ3 LYS 100 2HZ LYS 100 -6.683 -20.990 -3.513 833 H GLU 101 H GLU 101 -7.037 -15.215 1.889 834 HA GLU 101 HA GLU 101 -8.595 -17.174 3.150 835 HB2 GLU 101 2HB GLU 101 -7.509 -14.645 3.815 836 HB3 GLU 101 3HB GLU 101 -9.225 -14.577 4.192 837 HG2 GLU 101 2HG GLU 101 -7.840 -17.009 5.085 838 HG3 GLU 101 3HG GLU 101 -7.331 -15.513 5.866 839 H SER 102 H SER 102 -10.854 -16.752 3.997 840 HA SER 102 HA SER 102 -12.557 -16.130 1.716 841 HB2 SER 102 2HB SER 102 -14.352 -17.032 3.384 842 HB3 SER 102 3HB SER 102 -13.216 -18.163 2.649 843 HG SER 102 HG SER 102 -13.502 -18.337 4.989 844 H SER 103 H SER 103 -14.698 -15.038 2.254 845 HA SER 103 HA SER 103 -14.088 -12.502 3.511 846 HB2 SER 103 2HB SER 103 -16.668 -13.376 2.195 847 HB3 SER 103 3HB SER 103 -16.166 -11.724 2.553 848 HG SER 103 HG SER 103 -15.618 -11.967 0.473 849 H ILE 104 H ILE 104 -16.519 -11.676 4.466 850 HA ILE 104 HA ILE 104 -16.619 -13.075 6.997 851 HB ILE 104 HB ILE 104 -18.361 -10.752 6.209 852 HG12 ILE 104 2HG1 ILE 104 -15.668 -10.454 7.520 853 HG13 ILE 104 3HG1 ILE 104 -15.840 -10.417 5.769 854 HG21 ILE 104 1HG2 ILE 104 -17.697 -10.398 8.800 855 HG22 ILE 104 2HG2 ILE 104 -19.121 -11.286 8.261 856 HG23 ILE 104 3HG2 ILE 104 -17.652 -12.158 8.696 857 HD11 ILE 104 3HD1 ILE 104 -15.925 -8.239 7.320 858 HD12 ILE 104 1HD1 ILE 104 -16.762 -8.367 5.773 859 HD13 ILE 104 2HD1 ILE 104 -17.640 -8.644 7.278 860 H GLN 105 H GLN 105 -18.676 -13.674 8.001 861 HA GLN 105 HA GLN 105 -20.110 -15.538 6.586 862 HB2 GLN 105 2HB GLN 105 -21.727 -15.516 8.381 863 HB3 GLN 105 3HB GLN 105 -20.116 -15.308 9.054 864 HG2 GLN 105 2HG GLN 105 -21.772 -12.908 8.436 865 HG3 GLN 105 3HG GLN 105 -22.096 -13.846 9.893 866 HE21 GLN 105 1HE2 GLN 105 -21.388 -11.302 10.230 867 HE22 GLN 105 2HE2 GLN 105 -19.770 -11.174 10.821 868 H ILE 106 H ILE 106 -22.478 -15.517 6.078 869 HA ILE 106 HA ILE 106 -23.200 -12.977 4.769 870 HB ILE 106 HB ILE 106 -24.138 -15.708 3.908 871 HG12 ILE 106 2HG1 ILE 106 -21.725 -15.669 3.663 872 HG13 ILE 106 3HG1 ILE 106 -22.469 -15.515 2.075 873 HG21 ILE 106 1HG2 ILE 106 -24.184 -12.995 2.598 874 HG22 ILE 106 2HG2 ILE 106 -24.628 -14.498 1.792 875 HG23 ILE 106 3HG2 ILE 106 -25.567 -13.927 3.171 876 HD11 ILE 106 3HD1 ILE 106 -22.175 -12.969 2.480 877 HD12 ILE 106 1HD1 ILE 106 -20.986 -13.487 3.675 878 HD13 ILE 106 2HD1 ILE 106 -20.794 -13.948 1.983 879 H GLY 107 H GLY 107 -24.203 -15.505 6.908 880 HA2 GLY 107 2HA GLY 107 -26.949 -14.456 6.973 881 HA3 GLY 107 3HA GLY 107 -26.423 -15.992 7.648 882 H ASN 108 H ASN 108 -27.079 -15.763 9.725 883 HA ASN 108 HA ASN 108 -26.043 -13.440 11.210 884 HB2 ASN 108 2HB ASN 108 -27.874 -14.257 12.907 885 HB3 ASN 108 3HB ASN 108 -28.334 -13.293 11.507 886 HD21 ASN 108 1HD2 ASN 108 -28.613 -16.296 13.107 887 HD22 ASN 108 2HD2 ASN 108 -29.678 -17.057 11.979 888 H GLY 109 H GLY 109 -24.356 -13.873 12.459 889 HA2 GLY 109 2HA GLY 109 -23.685 -16.598 13.155 890 HA3 GLY 109 3HA GLY 109 -22.742 -15.162 13.523 891 H HIS 110 H HIS 110 -23.636 -17.522 15.163 892 HA HIS 110 HA HIS 110 -25.459 -16.438 17.106 893 HB2 HIS 110 2HB HIS 110 -23.849 -18.968 16.906 894 HB3 HIS 110 3HB HIS 110 -24.663 -18.539 18.408 895 HD1 HIS 110 HD1 HIS 110 -26.708 -19.912 18.554 896 HD2 HIS 110 HD2 HIS 110 -26.069 -18.508 14.696 897 HE1 HIS 110 HE1 HIS 110 -28.691 -20.691 17.218 898 H GLY 111 H GLY 111 -24.669 -16.767 19.528 899 HA2 GLY 111 2HA GLY 111 -22.563 -14.824 19.879 900 HA3 GLY 111 3HA GLY 111 -23.536 -15.552 21.148 901 H GLN 112 H GLN 112 -20.536 -15.124 20.627 902 HA GLN 112 HA GLN 112 -19.750 -17.844 21.419 903 HB2 GLN 112 2HB GLN 112 -17.646 -17.581 20.168 904 HB3 GLN 112 3HB GLN 112 -19.051 -17.533 19.111 905 HG2 GLN 112 2HG GLN 112 -17.795 -15.018 20.139 906 HG3 GLN 112 3HG GLN 112 -17.165 -15.848 18.717 907 HE21 GLN 112 1HE2 GLN 112 -19.299 -13.551 19.805 908 HE22 GLN 112 2HE2 GLN 112 -20.300 -13.421 18.404 909 H SER 113 H SER 113 -17.308 -17.673 22.229 910 HA SER 113 HA SER 113 -16.827 -15.237 23.738 911 HB2 SER 113 2HB SER 113 -16.480 -16.805 25.826 912 HB3 SER 113 3HB SER 113 -18.085 -16.186 25.436 913 HG SER 113 HG SER 113 -17.463 -18.666 25.743 914 H GLN 114 H GLN 114 -14.702 -15.121 24.633 915 HA GLN 114 HA GLN 114 -12.844 -17.198 23.705 916 HB2 GLN 114 2HB GLN 114 -12.814 -14.278 23.091 917 HB3 GLN 114 3HB GLN 114 -11.275 -15.100 23.318 918 HG2 GLN 114 2HG GLN 114 -12.051 -16.766 21.591 919 HG3 GLN 114 3HG GLN 114 -13.384 -15.662 21.257 920 HE21 GLN 114 1HE2 GLN 114 -11.364 -16.476 19.427 921 HE22 GLN 114 2HE2 GLN 114 -10.489 -15.062 18.959 922 H GLY 115 H GLY 115 -10.568 -16.731 24.669 923 HA2 GLY 115 2HA GLY 115 -10.948 -16.545 27.540 924 HA3 GLY 115 3HA GLY 115 -9.477 -17.029 26.709 925 H LEU 116 H LEU 116 -11.346 -14.351 27.924 926 HA LEU 116 HA LEU 116 -8.989 -12.621 27.567 927 HB2 LEU 116 2HB LEU 116 -11.901 -11.864 27.407 928 HB3 LEU 116 3HB LEU 116 -10.572 -10.708 27.444 929 HG LEU 116 HG LEU 116 -10.718 -12.793 25.297 930 HD11 LEU 116 1HD1 LEU 116 -11.915 -10.077 24.935 931 HD12 LEU 116 2HD1 LEU 116 -12.887 -11.408 25.561 932 HD13 LEU 116 3HD1 LEU 116 -12.137 -11.537 23.971 933 HD21 LEU 116 3HD2 LEU 116 -9.697 -10.648 24.132 934 HD22 LEU 116 1HD2 LEU 116 -8.702 -11.745 25.089 935 HD23 LEU 116 2HD2 LEU 116 -9.284 -10.238 25.797 936 H GLU 117 H GLU 117 -12.068 -12.283 29.318 937 HA GLU 117 HA GLU 117 -10.552 -12.149 31.833 938 HB2 GLU 117 2HB GLU 117 -11.048 -9.857 31.101 939 HB3 GLU 117 3HB GLU 117 -12.757 -10.255 31.000 940 HG2 GLU 117 2HG GLU 117 -12.987 -10.402 33.311 941 HG3 GLU 117 3HG GLU 117 -11.251 -10.565 33.567 942 H1 GLY -9 H GLY -9 4.927 -14.878 9.885 943 HA2 GLY -9 2HA GLY -9 4.574 -14.586 7.399 944 HA3 GLY -9 3HA GLY -9 6.223 -13.979 7.388 945 H LYS -8 H LYS -8 6.625 -15.668 5.815 946 HA LYS -8 HA LYS -8 7.031 -18.292 7.094 947 HB2 LYS -8 2HB LYS -8 5.294 -18.043 5.161 948 HB3 LYS -8 3HB LYS -8 6.715 -17.982 4.127 949 HG2 LYS -8 2HG LYS -8 6.507 -20.200 6.092 950 HG3 LYS -8 3HG LYS -8 5.479 -20.247 4.657 951 HD2 LYS -8 2HD LYS -8 8.395 -19.674 4.357 952 HD3 LYS -8 3HD LYS -8 7.860 -21.336 4.621 953 HE2 LYS -8 2HE LYS -8 7.802 -21.264 2.338 954 HE3 LYS -8 3HE LYS -8 6.161 -20.727 2.697 955 HZ1 LYS -8 3HZ LYS -8 7.620 -19.403 1.036 956 HZ2 LYS -8 1HZ LYS -8 8.307 -18.735 2.430 957 HZ3 LYS -8 2HZ LYS -8 6.649 -18.569 2.141 958 H PHE -7 H PHE -7 8.272 -15.915 4.804 959 HA PHE -7 HA PHE -7 10.709 -17.322 4.295 960 HB2 PHE -7 2HB PHE -7 9.869 -14.466 3.776 961 HB3 PHE -7 3HB PHE -7 11.422 -15.128 3.277 962 HD1 PHE -7 HD1 PHE -7 7.775 -15.360 2.800 963 HD2 PHE -7 HD2 PHE -7 11.615 -16.496 1.357 964 HE1 PHE -7 HE1 PHE -7 6.746 -16.189 0.724 965 HE2 PHE -7 HE2 PHE -7 10.592 -17.326 -0.722 966 HZ PHE -7 HZ PHE -7 8.155 -17.172 -1.041 967 H ILE -6 H ILE -6 10.400 -14.060 5.672 968 HA ILE -6 HA ILE -6 11.621 -12.968 7.256 969 HB ILE -6 HB ILE -6 11.764 -15.636 8.653 970 HG12 ILE -6 2HG1 ILE -6 9.457 -15.263 7.994 971 HG13 ILE -6 3HG1 ILE -6 9.620 -14.986 9.725 972 HG21 ILE -6 1HG2 ILE -6 13.042 -14.221 9.924 973 HG22 ILE -6 2HG2 ILE -6 12.118 -12.793 9.460 974 HG23 ILE -6 3HG2 ILE -6 11.452 -13.933 10.629 975 HD11 ILE -6 3HD1 ILE -6 8.661 -13.018 9.449 976 HD12 ILE -6 1HD1 ILE -6 10.046 -12.506 8.484 977 HD13 ILE -6 2HD1 ILE -6 8.643 -13.233 7.699 978 HA PRO -5 HA PRO -5 15.629 -14.561 5.562 979 HB2 PRO -5 2HB PRO -5 16.451 -12.148 4.628 980 HB3 PRO -5 3HB PRO -5 15.426 -13.243 3.691 981 HG2 PRO -5 2HG PRO -5 14.655 -10.843 5.306 982 HG3 PRO -5 3HG PRO -5 14.085 -11.343 3.703 983 HD2 PRO -5 2HD PRO -5 12.650 -11.774 5.958 984 HD3 PRO -5 3HD PRO -5 12.602 -12.879 4.570 985 H SER -4 H SER -4 15.952 -14.766 7.954 986 HA SER -4 HA SER -4 17.017 -12.478 9.352 987 HB2 SER -4 2HB SER -4 15.813 -14.018 10.707 988 HB3 SER -4 3HB SER -4 16.715 -15.394 10.074 989 HG SER -4 HG SER -4 17.259 -14.229 12.251 990 H ARG -3 H ARG -3 18.256 -14.378 7.008 991 HA ARG -3 HA ARG -3 20.723 -15.282 7.798 992 HB2 ARG -3 2HB ARG -3 19.704 -14.136 5.228 993 HB3 ARG -3 3HB ARG -3 21.418 -14.499 5.387 994 HG2 ARG -3 2HG ARG -3 19.215 -16.491 5.868 995 HG3 ARG -3 3HG ARG -3 20.086 -16.312 4.344 996 HD2 ARG -3 2HD ARG -3 22.190 -16.812 5.499 997 HD3 ARG -3 3HD ARG -3 21.308 -17.004 7.013 998 HE ARG -3 HE ARG -3 20.386 -18.708 4.881 999 HH11 ARG -3 1HH1 ARG -3 22.611 -18.358 7.535 1000 HH12 ARG -3 2HH1 ARG -3 22.822 -20.064 7.753 1001 HH21 ARG -3 1HH2 ARG -3 20.656 -20.956 5.158 1002 HH22 ARG -3 2HH2 ARG -3 21.710 -21.541 6.400 1003 HA PRO -2 HA PRO -2 23.290 -11.877 8.824 1004 HB2 PRO -2 2HB PRO -2 25.662 -12.558 7.691 1005 HB3 PRO -2 3HB PRO -2 25.008 -13.376 9.114 1006 HG2 PRO -2 2HG PRO -2 24.932 -14.220 6.243 1007 HG3 PRO -2 3HG PRO -2 25.269 -15.193 7.687 1008 HD2 PRO -2 2HD PRO -2 22.856 -15.196 6.458 1009 HD3 PRO -2 3HD PRO -2 23.035 -15.417 8.210 1010 H ALA -1 H ALA -1 23.054 -12.747 5.441 1011 HA ALA -1 HA ALA -1 23.043 -11.502 3.535 1012 HB1 ALA -1 1HB ALA -1 22.159 -9.382 3.614 1013 HB2 ALA -1 2HB ALA -1 21.631 -10.025 5.169 1014 HB3 ALA -1 3HB ALA -1 23.030 -8.955 5.087 1015 HA PRO 0 HA PRO 0 27.566 -10.804 3.919 1016 HB2 PRO 0 2HB PRO 0 28.170 -12.098 1.610 1017 HB3 PRO 0 3HB PRO 0 27.951 -12.935 3.151 1018 HG2 PRO 0 2HG PRO 0 26.025 -12.608 0.883 1019 HG3 PRO 0 3HG PRO 0 26.371 -14.048 1.858 1020 HD2 PRO 0 2HD PRO 0 24.202 -12.485 2.288 1021 HD3 PRO 0 3HD PRO 0 25.035 -13.346 3.599 1022 H LYS 1 H LYS 1 28.990 -9.542 2.617 1023 HA LYS 1 HA LYS 1 27.572 -7.654 0.903 1024 HB2 LYS 1 2HB LYS 1 30.127 -7.621 2.437 1025 HB3 LYS 1 3HB LYS 1 30.010 -6.591 1.016 1026 HG2 LYS 1 2HG LYS 1 29.333 -5.185 2.710 1027 HG3 LYS 1 3HG LYS 1 27.795 -5.783 2.084 1028 HD2 LYS 1 2HD LYS 1 27.473 -6.056 4.342 1029 HD3 LYS 1 3HD LYS 1 28.133 -7.636 3.913 1030 HE2 LYS 1 2HE LYS 1 29.998 -5.454 4.718 1031 HE3 LYS 1 3HE LYS 1 29.071 -6.287 5.964 1032 HZ1 LYS 1 3HZ LYS 1 29.991 -8.365 4.617 1033 HZ2 LYS 1 1HZ LYS 1 30.847 -7.656 5.893 1034 HZ3 LYS 1 2HZ LYS 1 31.243 -7.273 4.294 1035 HA PRO 2 HA PRO 2 29.226 -9.041 -2.917 1036 HB2 PRO 2 2HB PRO 2 29.775 -6.712 -4.199 1037 HB3 PRO 2 3HB PRO 2 28.128 -7.291 -3.921 1038 HG2 PRO 2 2HG PRO 2 29.703 -5.254 -2.393 1039 HG3 PRO 2 3HG PRO 2 28.003 -5.207 -2.897 1040 HD2 PRO 2 2HD PRO 2 28.759 -5.856 -0.379 1041 HD3 PRO 2 3HD PRO 2 27.318 -6.548 -1.152 1042 HA PRO 3 HA PRO 3 33.621 -9.166 -2.976 1043 HB2 PRO 3 2HB PRO 3 34.184 -9.207 -5.631 1044 HB3 PRO 3 3HB PRO 3 33.470 -10.582 -4.779 1045 HG2 PRO 3 2HG PRO 3 32.136 -8.501 -6.468 1046 HG3 PRO 3 3HG PRO 3 31.867 -10.253 -6.431 1047 HD2 PRO 3 2HD PRO 3 30.228 -8.501 -5.176 1048 HD3 PRO 3 3HD PRO 3 30.533 -10.136 -4.555 1049 H SER 4 H SER 4 34.888 -7.527 -2.386 1050 HA SER 4 HA SER 4 34.580 -4.868 -3.246 1051 HB2 SER 4 2HB SER 4 36.774 -6.315 -1.774 1052 HB3 SER 4 3HB SER 4 36.924 -4.609 -2.195 1053 HG SER 4 HG SER 4 35.827 -5.470 -0.074 1054 H SER 5 H SER 5 36.261 -3.550 -4.323 1055 HA SER 5 HA SER 5 37.668 -5.053 -6.429 1056 HB2 SER 5 2HB SER 5 35.531 -3.881 -7.193 1057 HB3 SER 5 3HB SER 5 36.376 -2.363 -6.889 1058 HG SER 5 HG SER 5 37.844 -2.870 -8.460 1059 H ALA 6 H ALA 6 37.450 -1.978 -4.673 1060 HA ALA 6 HA ALA 6 40.373 -1.719 -4.945 1061 HB1 ALA 6 1HB ALA 6 38.891 -0.080 -6.290 1062 HB2 ALA 6 2HB ALA 6 38.606 0.686 -4.727 1063 HB3 ALA 6 3HB ALA 6 40.247 0.558 -5.359 Start of MODEL 11 1 H1 MET -2 H MET -2 1.459 0.224 -4.788 2 HA MET -2 HA MET -2 4.320 0.717 -4.995 3 HB2 MET -2 2HB MET -2 4.942 -1.607 -4.923 4 HB3 MET -2 3HB MET -2 4.068 -1.219 -3.448 5 HG2 MET -2 2HG MET -2 2.125 -2.337 -4.194 6 HG3 MET -2 3HG MET -2 2.753 -2.477 -5.834 7 HE1 MET -2 3HE MET -2 5.433 -5.160 -5.638 8 HE2 MET -2 1HE MET -2 4.871 -3.681 -6.419 9 HE3 MET -2 2HE MET -2 5.950 -3.587 -5.027 10 H ALA -1 H ALA -1 5.011 -1.160 -6.839 11 HA ALA -1 HA ALA -1 3.038 -1.144 -8.976 12 HB1 ALA -1 1HB ALA -1 5.390 0.623 -8.910 13 HB2 ALA -1 2HB ALA -1 5.141 -0.257 -10.419 14 HB3 ALA -1 3HB ALA -1 3.867 0.786 -9.786 15 HA PRO 1 HA PRO 1 4.906 -4.946 -10.121 16 HB2 PRO 1 2HB PRO 1 4.666 -4.918 -12.825 17 HB3 PRO 1 3HB PRO 1 3.288 -5.141 -11.740 18 HG2 PRO 1 2HG PRO 1 4.211 -2.664 -13.146 19 HG3 PRO 1 3HG PRO 1 2.563 -3.286 -12.941 20 HD2 PRO 1 2HD PRO 1 3.568 -1.292 -11.409 21 HD3 PRO 1 3HD PRO 1 2.385 -2.464 -10.795 22 H LEU 2 H LEU 2 7.043 -4.064 -9.392 23 HA LEU 2 HA LEU 2 8.840 -3.241 -11.530 24 HB2 LEU 2 2HB LEU 2 10.233 -2.453 -9.923 25 HB3 LEU 2 3HB LEU 2 8.713 -2.391 -9.033 26 HG LEU 2 HG LEU 2 9.545 -4.852 -8.338 27 HD11 LEU 2 1HD1 LEU 2 11.616 -5.073 -9.258 28 HD12 LEU 2 2HD1 LEU 2 12.059 -4.301 -7.736 29 HD13 LEU 2 3HD1 LEU 2 11.947 -3.341 -9.211 30 HD21 LEU 2 3HD2 LEU 2 8.851 -3.189 -6.762 31 HD22 LEU 2 1HD2 LEU 2 10.285 -2.214 -7.083 32 HD23 LEU 2 2HD2 LEU 2 10.443 -3.775 -6.277 33 H PHE 3 H PHE 3 10.637 -4.399 -12.200 34 HA PHE 3 HA PHE 3 10.753 -7.206 -11.312 35 HB2 PHE 3 2HB PHE 3 10.934 -6.061 -14.093 36 HB3 PHE 3 3HB PHE 3 11.571 -7.655 -13.705 37 HD1 PHE 3 HD2 PHE 3 8.443 -5.701 -13.117 38 HD2 PHE 3 HD1 PHE 3 10.206 -9.428 -14.173 39 HE1 PHE 3 HE2 PHE 3 6.203 -6.667 -13.432 40 HE2 PHE 3 HE1 PHE 3 7.968 -10.400 -14.491 41 HZ PHE 3 HZ PHE 3 5.963 -9.020 -14.120 42 H ALA 4 H ALA 4 12.761 -8.119 -11.039 43 HA ALA 4 HA ALA 4 15.069 -6.314 -11.367 44 HB1 ALA 4 1HB ALA 4 14.338 -8.094 -9.068 45 HB2 ALA 4 2HB ALA 4 16.006 -7.594 -9.348 46 HB3 ALA 4 3HB ALA 4 14.759 -6.381 -9.057 47 H VAL 5 H VAL 5 17.069 -7.274 -11.888 48 HA VAL 5 HA VAL 5 16.843 -9.998 -12.995 49 HB VAL 5 HB VAL 5 17.115 -8.344 -14.761 50 HG11 VAL 5 1HG1 VAL 5 18.249 -6.637 -13.353 51 HG12 VAL 5 2HG1 VAL 5 19.727 -7.596 -13.455 52 HG13 VAL 5 3HG1 VAL 5 19.025 -6.898 -14.915 53 HG21 VAL 5 3HG2 VAL 5 18.829 -10.556 -14.284 54 HG22 VAL 5 1HG2 VAL 5 18.290 -9.896 -15.828 55 HG23 VAL 5 2HG2 VAL 5 19.772 -9.298 -15.082 56 H THR 6 H THR 6 18.194 -11.499 -12.242 57 HA THR 6 HA THR 6 19.943 -10.945 -10.080 58 HB THR 6 HB THR 6 20.709 -13.437 -11.010 59 HG1 THR 6 HG1 THR 6 19.040 -13.297 -12.614 60 HG21 THR 6 3HG2 THR 6 20.155 -13.767 -8.877 61 HG22 THR 6 1HG2 THR 6 18.464 -13.840 -9.368 62 HG23 THR 6 2HG2 THR 6 19.170 -12.305 -8.862 63 H LEU 7 H LEU 7 22.070 -10.528 -10.022 64 HA LEU 7 HA LEU 7 23.492 -10.390 -12.586 65 HB2 LEU 7 2HB LEU 7 24.315 -9.163 -9.965 66 HB3 LEU 7 3HB LEU 7 24.961 -8.812 -11.566 67 HG LEU 7 HG LEU 7 22.084 -8.255 -10.973 68 HD11 LEU 7 1HD1 LEU 7 23.667 -5.907 -10.616 69 HD12 LEU 7 2HD1 LEU 7 24.200 -7.147 -9.482 70 HD13 LEU 7 3HD1 LEU 7 22.509 -6.647 -9.511 71 HD21 LEU 7 3HD2 LEU 7 23.080 -6.239 -12.502 72 HD22 LEU 7 1HD2 LEU 7 22.316 -7.699 -13.133 73 HD23 LEU 7 2HD2 LEU 7 24.074 -7.600 -13.024 74 H TYR 8 H TYR 8 23.329 -12.158 -9.685 75 HA TYR 8 HA TYR 8 25.786 -13.585 -10.414 76 HB2 TYR 8 2HB TYR 8 25.054 -12.898 -7.563 77 HB3 TYR 8 3HB TYR 8 26.506 -13.725 -8.113 78 HD1 TYR 8 HD1 TYR 8 24.749 -10.478 -8.055 79 HD2 TYR 8 HD2 TYR 8 28.389 -12.505 -8.916 80 HE1 TYR 8 HE1 TYR 8 25.905 -8.315 -8.229 81 HE2 TYR 8 HE2 TYR 8 29.556 -10.347 -9.091 82 HH TYR 8 HH TYR 8 28.511 -7.736 -9.693 83 H GLU 9 H GLU 9 25.906 -15.762 -9.444 84 HA GLU 9 HA GLU 9 23.299 -17.030 -9.561 85 HB2 GLU 9 2HB GLU 9 25.081 -18.059 -10.823 86 HB3 GLU 9 3HB GLU 9 26.096 -18.158 -9.391 87 HG2 GLU 9 2HG GLU 9 25.288 -20.162 -8.950 88 HG3 GLU 9 3HG GLU 9 23.666 -19.486 -8.812 89 H PHE 10 H PHE 10 22.124 -17.236 -7.783 90 HA PHE 10 HA PHE 10 23.468 -17.418 -5.185 91 HB2 PHE 10 2HB PHE 10 21.651 -15.691 -5.634 92 HB3 PHE 10 3HB PHE 10 20.514 -17.035 -5.663 93 HD1 PHE 10 HD1 PHE 10 23.325 -15.889 -3.485 94 HD2 PHE 10 HD2 PHE 10 19.328 -17.331 -3.733 95 HE1 PHE 10 HE1 PHE 10 23.134 -15.773 -1.034 96 HE2 PHE 10 HE2 PHE 10 19.130 -17.216 -1.284 97 HZ PHE 10 HZ PHE 10 21.034 -16.435 0.069 98 H LYS 11 H LYS 11 23.477 -19.236 -4.023 99 HA LYS 11 HA LYS 11 21.945 -21.524 -5.047 100 HB2 LYS 11 2HB LYS 11 24.417 -21.396 -3.314 101 HB3 LYS 11 3HB LYS 11 23.562 -22.886 -3.693 102 HG2 LYS 11 2HG LYS 11 24.374 -22.979 -5.793 103 HG3 LYS 11 3HG LYS 11 24.342 -21.226 -5.999 104 HD2 LYS 11 2HD LYS 11 26.432 -20.948 -5.121 105 HD3 LYS 11 3HD LYS 11 26.293 -22.355 -4.064 106 HE2 LYS 11 2HE LYS 11 26.889 -23.832 -5.737 107 HE3 LYS 11 3HE LYS 11 26.396 -22.734 -7.025 108 HZ1 LYS 11 3HZ LYS 11 28.939 -23.006 -5.747 109 HZ2 LYS 11 1HZ LYS 11 28.399 -21.402 -5.745 110 HZ3 LYS 11 2HZ LYS 11 28.542 -22.244 -7.205 111 H ALA 12 H ALA 12 20.069 -21.775 -4.023 112 HA ALA 12 HA ALA 12 19.463 -20.777 -1.464 113 HB1 ALA 12 1HB ALA 12 17.564 -21.104 -2.687 114 HB2 ALA 12 2HB ALA 12 18.134 -22.624 -3.376 115 HB3 ALA 12 3HB ALA 12 17.547 -22.574 -1.713 116 H GLU 13 H GLU 13 18.866 -22.030 0.448 117 HA GLU 13 HA GLU 13 20.588 -24.398 0.779 118 HB2 GLU 13 2HB GLU 13 20.752 -23.767 3.170 119 HB3 GLU 13 3HB GLU 13 21.431 -22.554 2.094 120 HG2 GLU 13 2HG GLU 13 19.675 -21.072 2.453 121 HG3 GLU 13 3HG GLU 13 18.617 -22.333 3.084 122 H ARG 14 H ARG 14 17.444 -22.999 1.269 123 HA ARG 14 HA ARG 14 16.413 -25.643 1.975 124 HB2 ARG 14 2HB ARG 14 15.617 -23.140 3.470 125 HB3 ARG 14 3HB ARG 14 15.043 -24.775 3.771 126 HG2 ARG 14 2HG ARG 14 17.934 -24.002 4.026 127 HG3 ARG 14 3HG ARG 14 16.786 -23.880 5.361 128 HD2 ARG 14 2HD ARG 14 17.195 -26.428 3.822 129 HD3 ARG 14 3HD ARG 14 18.188 -26.004 5.216 130 HE ARG 14 HE ARG 14 15.546 -25.757 6.012 131 HH11 ARG 14 1HH1 ARG 14 17.669 -28.269 4.870 132 HH12 ARG 14 2HH1 ARG 14 16.857 -29.530 5.736 133 HH21 ARG 14 1HH2 ARG 14 14.468 -27.409 7.157 134 HH22 ARG 14 2HH2 ARG 14 15.035 -29.040 7.037 135 H ASP 15 H ASP 15 13.805 -25.200 2.238 136 HA ASP 15 HA ASP 15 12.930 -24.721 -0.401 137 HB2 ASP 15 2HB ASP 15 11.256 -24.793 2.117 138 HB3 ASP 15 3HB ASP 15 10.681 -25.033 0.470 139 H ASP 16 H ASP 16 12.893 -22.745 2.519 140 HA ASP 16 HA ASP 16 11.302 -20.645 1.533 141 HB2 ASP 16 2HB ASP 16 12.535 -19.287 3.324 142 HB3 ASP 16 3HB ASP 16 11.627 -20.696 3.867 143 H GLU 17 H GLU 17 14.502 -21.583 0.804 144 HA GLU 17 HA GLU 17 15.060 -18.959 -0.410 145 HB2 GLU 17 2HB GLU 17 16.647 -20.216 1.321 146 HB3 GLU 17 3HB GLU 17 17.192 -21.021 -0.143 147 HG2 GLU 17 2HG GLU 17 18.605 -19.315 -0.339 148 HG3 GLU 17 3HG GLU 17 17.206 -18.402 -0.901 149 H LEU 18 H LEU 18 15.516 -18.797 -2.562 150 HA LEU 18 HA LEU 18 15.205 -21.261 -4.147 151 HB2 LEU 18 2HB LEU 18 13.420 -19.452 -4.294 152 HB3 LEU 18 3HB LEU 18 14.634 -18.475 -5.117 153 HG LEU 18 HG LEU 18 14.752 -20.636 -6.668 154 HD11 LEU 18 1HD1 LEU 18 12.565 -21.613 -6.993 155 HD12 LEU 18 2HD1 LEU 18 11.899 -20.621 -5.696 156 HD13 LEU 18 3HD1 LEU 18 13.093 -21.866 -5.330 157 HD21 LEU 18 3HD2 LEU 18 13.381 -19.477 -8.230 158 HD22 LEU 18 1HD2 LEU 18 14.222 -18.259 -7.271 159 HD23 LEU 18 2HD2 LEU 18 12.528 -18.624 -6.943 160 H ASP 19 H ASP 19 16.432 -21.446 -6.093 161 HA ASP 19 HA ASP 19 19.017 -20.085 -5.906 162 HB2 ASP 19 2HB ASP 19 19.344 -22.409 -5.984 163 HB3 ASP 19 3HB ASP 19 18.102 -22.633 -7.213 164 H VAL 20 H VAL 20 19.603 -18.560 -7.302 165 HA VAL 20 HA VAL 20 18.144 -18.356 -9.855 166 HB VAL 20 HB VAL 20 18.740 -15.807 -9.552 167 HG11 VAL 20 1HG1 VAL 20 16.455 -17.334 -9.314 168 HG12 VAL 20 2HG1 VAL 20 16.460 -16.367 -7.838 169 HG13 VAL 20 3HG1 VAL 20 16.526 -15.575 -9.413 170 HG21 VAL 20 3HG2 VAL 20 18.598 -15.060 -7.248 171 HG22 VAL 20 1HG2 VAL 20 18.477 -16.729 -6.691 172 HG23 VAL 20 2HG2 VAL 20 19.966 -16.155 -7.443 173 H SER 21 H SER 21 19.319 -17.249 -11.572 174 HA SER 21 HA SER 21 22.243 -17.451 -11.258 175 HB2 SER 21 2HB SER 21 20.451 -18.519 -13.403 176 HB3 SER 21 3HB SER 21 22.076 -17.989 -13.839 177 HG SER 21 HG SER 21 21.263 -20.200 -12.428 178 HA PRO 22 HA PRO 22 22.614 -13.388 -12.870 179 HB2 PRO 22 2HB PRO 22 24.860 -13.574 -14.384 180 HB3 PRO 22 3HB PRO 22 24.888 -13.604 -12.617 181 HG2 PRO 22 2HG PRO 22 25.019 -15.884 -14.552 182 HG3 PRO 22 3HG PRO 22 25.960 -15.616 -13.073 183 HD2 PRO 22 2HD PRO 22 23.834 -17.290 -13.163 184 HD3 PRO 22 3HD PRO 22 24.264 -16.371 -11.706 185 H GLY 23 H GLY 23 21.249 -12.567 -14.328 186 HA2 GLY 23 2HA GLY 23 20.971 -11.877 -16.636 187 HA3 GLY 23 3HA GLY 23 21.494 -13.483 -17.121 188 H GLU 24 H GLU 24 19.555 -13.954 -14.526 189 HA GLU 24 HA GLU 24 17.323 -14.721 -16.225 190 HB2 GLU 24 2HB GLU 24 18.146 -15.329 -13.410 191 HB3 GLU 24 3HB GLU 24 16.479 -15.594 -13.902 192 HG2 GLU 24 2HG GLU 24 17.963 -17.596 -14.043 193 HG3 GLU 24 3HG GLU 24 17.116 -17.186 -15.533 194 H ASN 25 H ASN 25 15.158 -14.101 -15.831 195 HA ASN 25 HA ASN 25 14.933 -11.411 -14.705 196 HB2 ASN 25 2HB ASN 25 13.021 -12.991 -16.439 197 HB3 ASN 25 3HB ASN 25 12.764 -11.334 -15.898 198 HD21 ASN 25 1HD2 ASN 25 13.641 -9.707 -17.020 199 HD22 ASN 25 2HD2 ASN 25 14.682 -9.900 -18.386 200 H LEU 26 H LEU 26 14.349 -11.286 -12.645 201 HA LEU 26 HA LEU 26 12.435 -13.265 -11.598 202 HB2 LEU 26 2HB LEU 26 14.576 -11.666 -10.213 203 HB3 LEU 26 3HB LEU 26 13.338 -12.578 -9.352 204 HG LEU 26 HG LEU 26 15.287 -13.911 -9.336 205 HD11 LEU 26 1HD1 LEU 26 14.523 -15.893 -10.278 206 HD12 LEU 26 2HD1 LEU 26 13.791 -15.072 -11.656 207 HD13 LEU 26 3HD1 LEU 26 13.047 -14.951 -10.062 208 HD21 LEU 26 3HD2 LEU 26 16.369 -12.635 -11.234 209 HD22 LEU 26 1HD2 LEU 26 15.492 -13.703 -12.330 210 HD23 LEU 26 2HD2 LEU 26 16.666 -14.373 -11.197 211 H SER 27 H SER 27 10.630 -12.589 -10.503 212 HA SER 27 HA SER 27 9.927 -9.774 -10.863 213 HB2 SER 27 2HB SER 27 8.490 -11.977 -11.438 214 HB3 SER 27 3HB SER 27 7.933 -11.694 -9.789 215 HG SER 27 HG SER 27 7.485 -9.501 -10.484 216 H ILE 28 H ILE 28 10.357 -8.460 -9.226 217 HA ILE 28 HA ILE 28 10.843 -9.324 -6.575 218 HB ILE 28 HB ILE 28 10.276 -6.554 -7.633 219 HG12 ILE 28 2HG1 ILE 28 12.308 -7.713 -8.523 220 HG13 ILE 28 3HG1 ILE 28 12.667 -6.251 -7.611 221 HG21 ILE 28 1HG2 ILE 28 11.340 -5.787 -5.522 222 HG22 ILE 28 2HG2 ILE 28 9.789 -6.590 -5.285 223 HG23 ILE 28 3HG2 ILE 28 11.289 -7.451 -4.941 224 HD11 ILE 28 3HD1 ILE 28 12.903 -9.073 -6.596 225 HD12 ILE 28 1HD1 ILE 28 14.233 -8.020 -7.079 226 HD13 ILE 28 2HD1 ILE 28 13.252 -7.613 -5.671 227 H CYS 29 H CYS 29 9.613 -9.148 -4.718 228 HA CYS 29 HA CYS 29 6.752 -8.571 -5.122 229 HB2 CYS 29 2HB CYS 29 7.910 -10.639 -3.243 230 HB3 CYS 29 3HB CYS 29 6.203 -10.330 -3.541 231 HG CYS 29 HG CYS 29 8.000 -11.131 -6.266 232 H ALA 30 H ALA 30 9.438 -8.606 -2.821 233 HA ALA 30 HA ALA 30 8.691 -6.131 -1.671 234 HB1 ALA 30 1HB ALA 30 6.996 -7.036 -0.429 235 HB2 ALA 30 2HB ALA 30 7.781 -8.611 -0.300 236 HB3 ALA 30 3HB ALA 30 8.349 -7.260 0.680 237 H HIS 31 H HIS 31 10.030 -5.668 0.341 238 HA HIS 31 HA HIS 31 12.609 -7.083 0.149 239 HB2 HIS 31 2HB HIS 31 13.778 -5.050 0.422 240 HB3 HIS 31 3HB HIS 31 12.510 -4.689 -0.746 241 HD1 HIS 31 HD1 HIS 31 14.055 -3.193 2.010 242 HD2 HIS 31 HD2 HIS 31 10.084 -3.661 0.879 243 HE1 HIS 31 HE1 HIS 31 12.785 -1.422 3.265 244 H TYR 32 H TYR 32 13.995 -6.404 2.205 245 HA TYR 32 HA TYR 32 12.382 -6.333 4.625 246 HB2 TYR 32 2HB TYR 32 12.635 -8.755 3.920 247 HB3 TYR 32 3HB TYR 32 14.362 -8.575 4.212 248 HD1 TYR 32 HD1 TYR 32 11.089 -8.049 5.935 249 HD2 TYR 32 HD2 TYR 32 15.193 -9.108 6.304 250 HE1 TYR 32 HE1 TYR 32 10.734 -8.571 8.312 251 HE2 TYR 32 HE2 TYR 32 14.850 -9.634 8.682 252 HH TYR 32 HH TYR 32 12.472 -8.610 10.466 253 H ASP 33 H ASP 33 13.294 -4.600 5.539 254 HA ASP 33 HA ASP 33 14.841 -3.209 6.463 255 HB2 ASP 33 2HB ASP 33 15.983 -5.933 6.869 256 HB3 ASP 33 3HB ASP 33 17.017 -4.547 7.210 257 H TYR 34 H TYR 34 14.941 -3.887 3.528 258 HA TYR 34 HA TYR 34 16.178 -3.348 1.697 259 HB2 TYR 34 2HB TYR 34 17.877 -1.691 3.562 260 HB3 TYR 34 3HB TYR 34 17.601 -1.435 1.842 261 HD1 TYR 34 HD2 TYR 34 16.091 -1.187 5.194 262 HD2 TYR 34 HD1 TYR 34 15.652 -0.288 1.059 263 HE1 TYR 34 HE2 TYR 34 14.221 0.319 5.726 264 HE2 TYR 34 HE1 TYR 34 13.781 1.222 1.579 265 HH TYR 34 HH TYR 34 12.011 1.250 3.828 266 H GLU 35 H GLU 35 17.019 -5.574 3.546 267 HA GLU 35 HA GLU 35 19.796 -5.819 2.588 268 HB2 GLU 35 2HB GLU 35 19.909 -7.513 4.595 269 HB3 GLU 35 3HB GLU 35 20.130 -5.790 4.865 270 HG2 GLU 35 2HG GLU 35 17.774 -5.606 5.526 271 HG3 GLU 35 3HG GLU 35 17.590 -7.344 5.300 272 H TRP 36 H TRP 36 16.700 -6.934 2.241 273 HA TRP 36 HA TRP 36 17.611 -9.270 0.787 274 HB2 TRP 36 2HB TRP 36 15.690 -9.495 3.112 275 HB3 TRP 36 3HB TRP 36 15.955 -10.764 1.919 276 HD1 TRP 36 HD1 TRP 36 17.337 -9.381 5.110 277 HE1 TRP 36 HE1 TRP 36 19.441 -10.697 5.794 278 HE3 TRP 36 HE3 TRP 36 18.088 -12.010 0.791 279 HZ2 TRP 36 HZ2 TRP 36 21.188 -12.598 4.652 280 HZ3 TRP 36 HZ3 TRP 36 19.998 -13.556 0.668 281 HH2 TRP 36 HH2 TRP 36 21.516 -13.842 2.560 282 H PHE 37 H PHE 37 15.923 -10.204 -0.565 283 HA PHE 37 HA PHE 37 13.543 -8.542 -0.922 284 HB2 PHE 37 2HB PHE 37 15.833 -8.583 -2.703 285 HB3 PHE 37 3HB PHE 37 14.368 -9.100 -3.532 286 HD1 PHE 37 HD1 PHE 37 12.283 -7.581 -3.202 287 HD2 PHE 37 HD2 PHE 37 16.292 -6.334 -2.502 288 HE1 PHE 37 HE1 PHE 37 11.591 -5.233 -3.448 289 HE2 PHE 37 HE2 PHE 37 15.606 -3.983 -2.746 290 HZ PHE 37 HZ PHE 37 13.253 -3.430 -3.218 291 H ILE 38 H ILE 38 11.834 -9.571 -2.045 292 HA ILE 38 HA ILE 38 12.096 -12.503 -2.121 293 HB ILE 38 HB ILE 38 9.462 -11.072 -2.003 294 HG12 ILE 38 2HG1 ILE 38 10.728 -10.167 -0.140 295 HG13 ILE 38 3HG1 ILE 38 9.538 -11.313 0.468 296 HG21 ILE 38 1HG2 ILE 38 10.316 -13.771 -2.076 297 HG22 ILE 38 2HG2 ILE 38 9.597 -13.477 -0.494 298 HG23 ILE 38 3HG2 ILE 38 8.672 -13.144 -1.958 299 HD11 ILE 38 3HD1 ILE 38 11.945 -12.723 -0.039 300 HD12 ILE 38 1HD1 ILE 38 12.330 -11.276 0.891 301 HD13 ILE 38 2HD1 ILE 38 11.139 -12.426 1.500 302 H ALA 39 H ALA 39 12.753 -12.791 -4.228 303 HA ALA 39 HA ALA 39 10.977 -11.759 -6.335 304 HB1 ALA 39 1HB ALA 39 13.704 -11.614 -6.160 305 HB2 ALA 39 2HB ALA 39 13.465 -13.012 -7.209 306 HB3 ALA 39 3HB ALA 39 12.764 -11.454 -7.644 307 H LYS 40 H LYS 40 10.129 -13.133 -7.893 308 HA LYS 40 HA LYS 40 10.315 -16.008 -7.270 309 HB2 LYS 40 2HB LYS 40 7.960 -14.425 -8.310 310 HB3 LYS 40 3HB LYS 40 8.000 -16.180 -8.206 311 HG2 LYS 40 2HG LYS 40 8.498 -15.828 -5.717 312 HG3 LYS 40 3HG LYS 40 7.958 -14.169 -5.987 313 HD2 LYS 40 2HD LYS 40 6.350 -16.652 -6.589 314 HD3 LYS 40 3HD LYS 40 6.145 -15.622 -5.171 315 HE2 LYS 40 2HE LYS 40 4.536 -14.733 -6.522 316 HE3 LYS 40 3HE LYS 40 5.908 -13.743 -7.014 317 HZ1 LYS 40 3HZ LYS 40 5.821 -14.564 -9.061 318 HZ2 LYS 40 1HZ LYS 40 4.327 -15.247 -8.657 319 HZ3 LYS 40 2HZ LYS 40 5.741 -16.164 -8.517 320 HA PRO 41 HA PRO 41 11.653 -16.795 -11.376 321 HB2 PRO 41 2HB PRO 41 10.492 -19.199 -11.870 322 HB3 PRO 41 3HB PRO 41 11.857 -19.001 -10.765 323 HG2 PRO 41 2HG PRO 41 8.938 -19.235 -10.146 324 HG3 PRO 41 3HG PRO 41 10.318 -19.996 -9.334 325 HD2 PRO 41 2HD PRO 41 9.079 -17.800 -8.349 326 HD3 PRO 41 3HD PRO 41 10.814 -18.098 -8.124 327 H ILE 42 H ILE 42 10.983 -15.826 -13.175 328 HA ILE 42 HA ILE 42 8.192 -15.399 -13.710 329 HB ILE 42 HB ILE 42 10.600 -14.755 -15.416 330 HG12 ILE 42 2HG1 ILE 42 8.988 -12.992 -13.557 331 HG13 ILE 42 3HG1 ILE 42 10.596 -13.623 -13.216 332 HG21 ILE 42 1HG2 ILE 42 9.108 -13.231 -16.604 333 HG22 ILE 42 2HG2 ILE 42 8.538 -14.896 -16.716 334 HG23 ILE 42 3HG2 ILE 42 7.756 -13.769 -15.607 335 HD11 ILE 42 3HD1 ILE 42 10.967 -12.389 -15.618 336 HD12 ILE 42 1HD1 ILE 42 9.776 -11.347 -14.841 337 HD13 ILE 42 2HD1 ILE 42 11.311 -11.683 -14.040 338 H ASN 43 H ASN 43 10.812 -17.232 -15.257 339 HA ASN 43 HA ASN 43 9.326 -18.229 -17.414 340 HB2 ASN 43 2HB ASN 43 11.792 -19.201 -15.989 341 HB3 ASN 43 3HB ASN 43 11.087 -20.122 -17.315 342 HD21 ASN 43 1HD2 ASN 43 10.954 -19.128 -19.389 343 HD22 ASN 43 2HD2 ASN 43 12.064 -17.879 -19.829 344 H ARG 43 H ARG 43 10.394 -20.175 -14.625 345 HA ARG 43 HA ARG 43 8.116 -21.943 -15.013 346 HB2 ARG 43 2HB ARG 43 9.232 -23.316 -13.243 347 HB3 ARG 43 3HB ARG 43 10.219 -23.039 -14.671 348 HG2 ARG 43 2HG ARG 43 10.562 -21.083 -12.503 349 HG3 ARG 43 3HG ARG 43 11.090 -22.728 -12.143 350 HD2 ARG 43 2HD ARG 43 12.711 -22.709 -13.779 351 HD3 ARG 43 3HD ARG 43 11.886 -21.473 -14.728 352 HE ARG 43 HE ARG 43 13.034 -19.881 -13.562 353 HH11 ARG 43 1HH1 ARG 43 13.128 -22.867 -11.774 354 HH12 ARG 43 2HH1 ARG 43 14.226 -22.266 -10.576 355 HH21 ARG 43 1HH2 ARG 43 14.480 -19.079 -11.991 356 HH22 ARG 43 2HH2 ARG 43 14.994 -20.111 -10.700 357 H LEU 44 H LEU 44 7.489 -22.867 -12.587 358 HA LEU 44 HA LEU 44 6.362 -20.506 -11.246 359 HB2 LEU 44 2HB LEU 44 4.945 -22.555 -10.228 360 HB3 LEU 44 3HB LEU 44 4.485 -21.657 -11.673 361 HG LEU 44 HG LEU 44 6.167 -24.115 -11.933 362 HD11 LEU 44 1HD1 LEU 44 3.425 -24.764 -12.314 363 HD12 LEU 44 2HD1 LEU 44 3.625 -24.096 -10.694 364 HD13 LEU 44 3HD1 LEU 44 4.589 -25.483 -11.201 365 HD21 LEU 44 3HD2 LEU 44 3.963 -23.481 -13.778 366 HD22 LEU 44 1HD2 LEU 44 5.614 -24.002 -14.113 367 HD23 LEU 44 2HD2 LEU 44 5.283 -22.310 -13.737 368 H GLY 45 H GLY 45 6.950 -23.839 -10.144 369 HA2 GLY 45 2HA GLY 45 7.960 -24.647 -8.248 370 HA3 GLY 45 3HA GLY 45 9.080 -23.304 -8.419 371 H GLY 46 H GLY 46 8.881 -21.525 -7.116 372 HA2 GLY 46 2HA GLY 46 6.609 -20.778 -5.666 373 HA3 GLY 46 3HA GLY 46 7.557 -21.852 -4.648 374 HA PRO 47 HA PRO 47 9.102 -17.346 -4.575 375 HB2 PRO 47 2HB PRO 47 8.111 -16.625 -2.152 376 HB3 PRO 47 3HB PRO 47 7.227 -16.381 -3.663 377 HG2 PRO 47 2HG PRO 47 6.936 -18.557 -1.628 378 HG3 PRO 47 3HG PRO 47 5.675 -17.652 -2.486 379 HD2 PRO 47 2HD PRO 47 6.433 -20.146 -3.220 380 HD3 PRO 47 3HD PRO 47 5.874 -18.934 -4.391 381 H GLY 48 H GLY 48 11.034 -16.903 -3.636 382 HA2 GLY 48 2HA GLY 48 11.846 -18.570 -1.338 383 HA3 GLY 48 3HA GLY 48 12.906 -18.344 -2.721 384 H LEU 49 H LEU 49 14.557 -17.368 -1.583 385 HA LEU 49 HA LEU 49 14.007 -14.610 -0.752 386 HB2 LEU 49 2HB LEU 49 14.274 -16.439 1.139 387 HB3 LEU 49 3HB LEU 49 15.988 -16.187 0.810 388 HG LEU 49 HG LEU 49 15.474 -14.803 2.641 389 HD11 LEU 49 1HD1 LEU 49 16.168 -12.741 1.888 390 HD12 LEU 49 2HD1 LEU 49 15.176 -12.816 0.433 391 HD13 LEU 49 3HD1 LEU 49 16.645 -13.785 0.549 392 HD21 LEU 49 3HD2 LEU 49 13.517 -13.007 1.930 393 HD22 LEU 49 1HD2 LEU 49 13.310 -14.393 3.002 394 HD23 LEU 49 2HD2 LEU 49 12.907 -14.535 1.291 395 H VAL 50 H VAL 50 15.325 -13.226 -1.726 396 HA VAL 50 HA VAL 50 18.020 -14.115 -2.489 397 HB VAL 50 HB VAL 50 16.558 -14.227 -4.482 398 HG11 VAL 50 1HG1 VAL 50 15.026 -12.400 -3.776 399 HG12 VAL 50 2HG1 VAL 50 16.294 -11.239 -4.176 400 HG13 VAL 50 3HG1 VAL 50 15.592 -12.250 -5.440 401 HG21 VAL 50 3HG2 VAL 50 18.939 -13.762 -4.734 402 HG22 VAL 50 1HG2 VAL 50 18.000 -12.909 -5.960 403 HG23 VAL 50 2HG2 VAL 50 18.630 -12.034 -4.564 404 HA PRO 51 HA PRO 51 19.136 -10.338 -0.471 405 HB2 PRO 51 2HB PRO 51 21.739 -10.295 -1.244 406 HB3 PRO 51 3HB PRO 51 21.128 -11.377 0.013 407 HG2 PRO 51 2HG PRO 51 21.682 -11.948 -2.872 408 HG3 PRO 51 3HG PRO 51 22.055 -12.932 -1.445 409 HD2 PRO 51 2HD PRO 51 19.926 -13.430 -3.042 410 HD3 PRO 51 3HD PRO 51 19.908 -13.757 -1.297 411 H VAL 52 H VAL 52 19.805 -8.191 -0.984 412 HA VAL 52 HA VAL 52 18.990 -7.340 -3.598 413 HB VAL 52 HB VAL 52 20.331 -5.544 -1.602 414 HG11 VAL 52 1HG1 VAL 52 19.664 -3.969 -3.015 415 HG12 VAL 52 2HG1 VAL 52 18.963 -5.202 -4.065 416 HG13 VAL 52 3HG1 VAL 52 17.988 -4.468 -2.791 417 HG21 VAL 52 3HG2 VAL 52 17.730 -5.267 -0.949 418 HG22 VAL 52 1HG2 VAL 52 17.784 -6.995 -1.298 419 HG23 VAL 52 2HG2 VAL 52 18.854 -6.308 -0.075 420 H SER 53 H SER 53 21.977 -8.141 -2.108 421 HA SER 53 HA SER 53 23.632 -6.585 -3.877 422 HB2 SER 53 2HB SER 53 24.329 -8.835 -1.975 423 HB3 SER 53 3HB SER 53 25.503 -7.840 -2.835 424 HG SER 53 HG SER 53 24.647 -7.302 -0.529 425 H TYR 54 H TYR 54 21.742 -9.165 -4.437 426 HA TYR 54 HA TYR 54 23.590 -10.297 -6.435 427 HB2 TYR 54 2HB TYR 54 21.477 -11.608 -4.746 428 HB3 TYR 54 3HB TYR 54 21.993 -12.332 -6.266 429 HD1 TYR 54 HD2 TYR 54 23.706 -10.742 -3.339 430 HD2 TYR 54 HD1 TYR 54 23.485 -14.059 -5.995 431 HE1 TYR 54 HE2 TYR 54 25.615 -11.783 -2.189 432 HE2 TYR 54 HE1 TYR 54 25.392 -15.110 -4.852 433 HH TYR 54 HH TYR 54 27.454 -13.523 -2.880 434 H VAL 55 H VAL 55 20.455 -8.960 -5.787 435 HA VAL 55 HA VAL 55 19.653 -9.381 -8.585 436 HB VAL 55 HB VAL 55 17.379 -8.644 -7.786 437 HG11 VAL 55 1HG1 VAL 55 17.451 -10.910 -8.101 438 HG12 VAL 55 2HG1 VAL 55 18.755 -11.143 -6.935 439 HG13 VAL 55 3HG1 VAL 55 17.109 -10.851 -6.372 440 HG21 VAL 55 3HG2 VAL 55 17.063 -7.897 -5.716 441 HG22 VAL 55 1HG2 VAL 55 17.805 -9.342 -5.029 442 HG23 VAL 55 2HG2 VAL 55 18.809 -7.963 -5.477 443 H ARG 56 H ARG 56 18.945 -7.652 -9.852 444 HA ARG 56 HA ARG 56 19.694 -4.988 -8.837 445 HB2 ARG 56 2HB ARG 56 21.261 -5.385 -10.504 446 HB3 ARG 56 3HB ARG 56 20.127 -6.293 -11.495 447 HG2 ARG 56 2HG ARG 56 19.011 -4.285 -12.169 448 HG3 ARG 56 3HG ARG 56 19.967 -3.324 -11.039 449 HD2 ARG 56 2HD ARG 56 20.761 -3.145 -13.372 450 HD3 ARG 56 3HD ARG 56 21.982 -3.792 -12.276 451 HE ARG 56 HE ARG 56 20.859 -6.024 -13.260 452 HH11 ARG 56 1HH1 ARG 56 22.081 -3.149 -14.795 453 HH12 ARG 56 2HH1 ARG 56 22.551 -3.967 -16.248 454 HH21 ARG 56 1HH2 ARG 56 21.473 -7.113 -15.167 455 HH22 ARG 56 2HH2 ARG 56 22.204 -6.222 -16.459 456 H ILE 57 H ILE 57 17.914 -3.858 -8.421 457 HA ILE 57 HA ILE 57 15.382 -4.402 -9.582 458 HB ILE 57 HB ILE 57 16.452 -2.277 -7.780 459 HG12 ILE 57 2HG1 ILE 57 14.685 -3.096 -6.308 460 HG13 ILE 57 3HG1 ILE 57 14.058 -4.119 -7.596 461 HG21 ILE 57 1HG2 ILE 57 15.155 -0.887 -9.145 462 HG22 ILE 57 2HG2 ILE 57 13.906 -2.112 -9.358 463 HG23 ILE 57 3HG2 ILE 57 14.089 -1.301 -7.803 464 HD11 ILE 57 3HD1 ILE 57 16.100 -5.432 -7.564 465 HD12 ILE 57 1HD1 ILE 57 16.760 -4.393 -6.302 466 HD13 ILE 57 2HD1 ILE 57 15.346 -5.393 -5.971 467 H ILE 58 H ILE 58 14.886 -3.992 -11.628 468 HA ILE 58 HA ILE 58 15.765 -1.431 -12.793 469 HB ILE 58 HB ILE 58 15.717 -2.611 -15.024 470 HG12 ILE 58 2HG1 ILE 58 16.078 -5.164 -13.495 471 HG13 ILE 58 3HG1 ILE 58 14.455 -4.611 -13.893 472 HG21 ILE 58 1HG2 ILE 58 17.904 -2.403 -14.685 473 HG22 ILE 58 2HG2 ILE 58 17.717 -2.665 -12.952 474 HG23 ILE 58 3HG2 ILE 58 17.897 -4.043 -14.037 475 HD11 ILE 58 3HD1 ILE 58 14.916 -5.979 -15.664 476 HD12 ILE 58 1HD1 ILE 58 15.433 -4.420 -16.304 477 HD13 ILE 58 2HD1 ILE 58 16.628 -5.560 -15.686 478 H ASP 59 H ASP 59 14.385 -0.778 -14.694 479 HA ASP 59 HA ASP 59 11.569 -1.239 -14.006 480 HB2 ASP 59 2HB ASP 59 12.979 1.017 -15.425 481 HB3 ASP 59 3HB ASP 59 11.226 0.844 -15.451 482 H LEU 60 H LEU 60 10.310 -2.388 -15.310 483 HA LEU 60 HA LEU 60 11.229 -3.741 -17.559 484 HB2 LEU 60 2HB LEU 60 8.605 -3.236 -16.311 485 HB3 LEU 60 3HB LEU 60 8.570 -3.708 -18.009 486 HG LEU 60 HG LEU 60 9.811 -5.294 -15.761 487 HD11 LEU 60 1HD1 LEU 60 7.313 -5.811 -17.368 488 HD12 LEU 60 2HD1 LEU 60 7.354 -5.236 -15.701 489 HD13 LEU 60 3HD1 LEU 60 7.977 -6.837 -16.096 490 HD21 LEU 60 3HD2 LEU 60 9.640 -5.736 -18.726 491 HD22 LEU 60 1HD2 LEU 60 9.836 -7.072 -17.591 492 HD23 LEU 60 2HD2 LEU 60 11.058 -5.804 -17.677 493 H MET 61 H MET 61 9.986 -0.532 -17.242 494 HA MET 61 HA MET 61 9.524 -0.241 -20.100 495 HB2 MET 61 2HB MET 61 9.154 1.578 -17.731 496 HB3 MET 61 3HB MET 61 9.037 2.181 -19.379 497 HG2 MET 61 2HG MET 61 6.846 1.736 -18.923 498 HG3 MET 61 3HG MET 61 7.344 0.219 -19.669 499 HE1 MET 61 3HE MET 61 5.301 -1.162 -18.612 500 HE2 MET 61 1HE MET 61 6.872 -1.955 -18.731 501 HE3 MET 61 2HE MET 61 5.890 -2.156 -17.280 502 H ASP 62 H ASP 62 11.911 0.552 -17.689 503 HA ASP 62 HA ASP 62 13.724 1.416 -19.802 504 HB2 ASP 62 2HB ASP 62 14.467 3.363 -18.369 505 HB3 ASP 62 3HB ASP 62 12.880 3.536 -19.114 506 HA PRO 63 HA PRO 63 15.629 -1.416 -16.661 507 HB2 PRO 63 2HB PRO 63 16.788 -3.046 -18.496 508 HB3 PRO 63 3HB PRO 63 15.128 -3.265 -17.929 509 HG2 PRO 63 2HG PRO 63 16.117 -1.972 -20.442 510 HG3 PRO 63 3HG PRO 63 14.755 -3.085 -20.218 511 HD2 PRO 63 2HD PRO 63 14.425 -0.407 -20.447 512 HD3 PRO 63 3HD PRO 63 13.356 -1.419 -19.455 513 H ALA 64 H ALA 64 16.666 0.690 -19.106 514 HA ALA 64 HA ALA 64 19.505 0.294 -18.515 515 HB1 ALA 64 1HB ALA 64 18.259 2.166 -20.521 516 HB2 ALA 64 2HB ALA 64 19.958 1.706 -20.400 517 HB3 ALA 64 3HB ALA 64 18.752 0.510 -20.875 518 H LYS 65 H LYS 65 16.953 2.050 -17.333 519 HA LYS 65 HA LYS 65 18.385 4.505 -16.790 520 HB2 LYS 65 2HB LYS 65 15.835 4.206 -17.184 521 HB3 LYS 65 3HB LYS 65 15.793 3.715 -15.496 522 HG2 LYS 65 2HG LYS 65 16.974 5.912 -14.993 523 HG3 LYS 65 3HG LYS 65 16.559 6.377 -16.645 524 HD2 LYS 65 2HD LYS 65 14.513 5.401 -14.664 525 HD3 LYS 65 3HD LYS 65 14.945 7.105 -14.830 526 HE2 LYS 65 2HE LYS 65 14.332 5.746 -17.356 527 HE3 LYS 65 3HE LYS 65 12.977 5.845 -16.232 528 HZ1 LYS 65 3HZ LYS 65 12.705 7.862 -17.127 529 HZ2 LYS 65 1HZ LYS 65 14.282 7.938 -17.734 530 HZ3 LYS 65 2HZ LYS 65 13.978 8.332 -16.118 531 H TYR 66 H TYR 66 17.031 1.845 -14.844 532 HA TYR 66 HA TYR 66 18.534 2.753 -12.522 533 HB2 TYR 66 2HB TYR 66 16.493 0.565 -12.922 534 HB3 TYR 66 3HB TYR 66 17.357 0.799 -11.406 535 HD1 TYR 66 HD1 TYR 66 14.998 2.397 -13.772 536 HD2 TYR 66 HD2 TYR 66 16.687 2.468 -9.868 537 HE1 TYR 66 HE1 TYR 66 13.323 4.061 -13.085 538 HE2 TYR 66 HE2 TYR 66 15.016 4.131 -9.169 539 HH TYR 66 HH TYR 66 12.449 5.193 -11.367 540 H ALA 67 H ALA 67 19.249 0.984 -15.163 541 HA ALA 67 HA ALA 67 20.467 -1.346 -14.184 542 HB1 ALA 67 1HB ALA 67 20.797 -1.695 -16.349 543 HB2 ALA 67 2HB ALA 67 20.185 -0.073 -16.675 544 HB3 ALA 67 3HB ALA 67 21.913 -0.332 -16.436 545 H SER 68 H SER 68 21.375 1.932 -13.898 546 HA SER 68 HA SER 68 24.200 1.511 -13.641 547 HB2 SER 68 2HB SER 68 24.305 3.840 -12.989 548 HB3 SER 68 3HB SER 68 23.188 3.685 -14.345 549 HG SER 68 HG SER 68 21.635 4.373 -13.112 550 H VAL 69 H VAL 69 21.464 1.315 -11.547 551 HA VAL 69 HA VAL 69 22.929 1.593 -9.091 552 HB VAL 69 HB VAL 69 20.207 0.338 -9.426 553 HG11 VAL 69 1HG1 VAL 69 21.855 1.256 -7.161 554 HG12 VAL 69 2HG1 VAL 69 20.147 1.696 -7.098 555 HG13 VAL 69 3HG1 VAL 69 20.618 0.001 -7.233 556 HG21 VAL 69 3HG2 VAL 69 19.843 2.968 -8.616 557 HG22 VAL 69 1HG2 VAL 69 21.041 3.068 -9.907 558 HG23 VAL 69 2HG2 VAL 69 19.483 2.296 -10.206 559 H ASP 70 H ASP 70 24.160 0.097 -8.180 560 HA ASP 70 HA ASP 70 24.049 -2.647 -9.146 561 HB2 ASP 70 2HB ASP 70 26.014 -1.022 -7.589 562 HB3 ASP 70 3HB ASP 70 26.058 -2.775 -7.428 563 H THR 71 H THR 71 22.186 -1.161 -7.107 564 HA THR 71 HA THR 71 21.082 -1.626 -5.157 565 HB THR 71 HB THR 71 20.670 -4.194 -4.894 566 HG1 THR 71 HG1 THR 71 21.832 -5.322 -6.251 567 HG21 THR 71 3HG2 THR 71 19.256 -2.276 -6.032 568 HG22 THR 71 1HG2 THR 71 18.796 -3.970 -6.203 569 HG23 THR 71 2HG2 THR 71 19.669 -3.157 -7.503 570 H TYR 72 H TYR 72 23.936 -1.324 -4.862 571 HA TYR 72 HA TYR 72 24.547 -3.244 -2.724 572 HB2 TYR 72 2HB TYR 72 26.296 -3.163 -4.349 573 HB3 TYR 72 3HB TYR 72 26.305 -1.403 -4.347 574 HD1 TYR 72 HD2 TYR 72 26.405 -3.903 -1.571 575 HD2 TYR 72 HD1 TYR 72 28.353 -0.682 -3.555 576 HE1 TYR 72 HE2 TYR 72 28.167 -3.919 0.145 577 HE2 TYR 72 HE1 TYR 72 30.121 -0.689 -1.845 578 HH TYR 72 HH TYR 72 29.838 -2.269 1.084 579 H ASP 73 H ASP 73 24.867 0.238 -3.421 580 HA ASP 73 HA ASP 73 25.389 1.005 -0.761 581 HB2 ASP 73 2HB ASP 73 25.382 2.278 -3.198 582 HB3 ASP 73 3HB ASP 73 23.998 3.009 -2.389 583 H ARG 74 H ARG 74 24.073 0.820 0.918 584 HA ARG 74 HA ARG 74 21.395 0.159 0.863 585 HB2 ARG 74 2HB ARG 74 21.334 0.619 3.186 586 HB3 ARG 74 3HB ARG 74 22.977 0.094 2.843 587 HG2 ARG 74 2HG ARG 74 22.177 2.987 3.005 588 HG3 ARG 74 3HG ARG 74 22.757 2.058 4.389 589 HD2 ARG 74 2HD ARG 74 24.235 2.698 1.845 590 HD3 ARG 74 3HD ARG 74 24.617 3.240 3.479 591 HE ARG 74 HE ARG 74 24.766 0.554 3.685 592 HH11 ARG 74 1HH1 ARG 74 26.169 2.849 1.476 593 HH12 ARG 74 2HH1 ARG 74 27.591 1.903 1.191 594 HH21 ARG 74 1HH2 ARG 74 26.634 -0.702 3.318 595 HH22 ARG 74 2HH2 ARG 74 27.855 -0.117 2.239 596 H GLU 75 H GLU 75 22.893 3.286 0.559 597 HA GLU 75 HA GLU 75 20.623 4.876 1.123 598 HB2 GLU 75 2HB GLU 75 23.259 5.306 -0.187 599 HB3 GLU 75 3HB GLU 75 21.997 6.488 -0.503 600 HG2 GLU 75 2HG GLU 75 21.750 6.878 1.890 601 HG3 GLU 75 3HG GLU 75 23.003 5.682 2.217 602 H GLN 76 H GLN 76 22.012 3.729 -1.943 603 HA GLN 76 HA GLN 76 20.081 4.899 -3.620 604 HB2 GLN 76 2HB GLN 76 21.785 2.441 -4.057 605 HB3 GLN 76 3HB GLN 76 20.868 3.262 -5.313 606 HG2 GLN 76 2HG GLN 76 22.224 5.345 -4.607 607 HG3 GLN 76 3HG GLN 76 23.308 4.177 -3.854 608 HE21 GLN 76 1HE2 GLN 76 24.312 2.594 -5.198 609 HE22 GLN 76 2HE2 GLN 76 24.576 2.914 -6.875 610 H VAL 77 H VAL 77 20.374 1.508 -2.549 611 HA VAL 77 HA VAL 77 18.009 0.552 -3.634 612 HB VAL 77 HB VAL 77 19.923 -0.698 -2.377 613 HG11 VAL 77 1HG1 VAL 77 17.937 -0.400 -0.129 614 HG12 VAL 77 2HG1 VAL 77 19.462 -1.288 -0.101 615 HG13 VAL 77 3HG1 VAL 77 19.467 0.472 -0.223 616 HG21 VAL 77 3HG2 VAL 77 18.007 -2.440 -1.673 617 HG22 VAL 77 1HG2 VAL 77 17.065 -1.366 -2.707 618 HG23 VAL 77 2HG2 VAL 77 18.499 -2.169 -3.344 619 H MET 78 H MET 78 18.544 2.402 -0.713 620 HA MET 78 HA MET 78 16.009 1.951 0.472 621 HB2 MET 78 2HB MET 78 18.283 3.790 0.895 622 HB3 MET 78 3HB MET 78 16.722 4.371 1.459 623 HG2 MET 78 2HG MET 78 16.481 2.215 2.712 624 HG3 MET 78 3HG MET 78 18.156 1.865 2.288 625 HE1 MET 78 3HE MET 78 20.206 3.677 3.006 626 HE2 MET 78 1HE MET 78 20.210 3.663 4.769 627 HE3 MET 78 2HE MET 78 19.891 2.176 3.877 628 H LYS 79 H LYS 79 17.278 4.725 -1.376 629 HA LYS 79 HA LYS 79 14.916 6.203 -1.467 630 HB2 LYS 79 2HB LYS 79 17.140 6.069 -3.511 631 HB3 LYS 79 3HB LYS 79 15.908 7.322 -3.440 632 HG2 LYS 79 2HG LYS 79 16.842 8.336 -1.628 633 HG3 LYS 79 3HG LYS 79 17.532 6.836 -1.004 634 HD2 LYS 79 2HD LYS 79 19.293 6.887 -2.609 635 HD3 LYS 79 3HD LYS 79 18.526 8.206 -3.497 636 HE2 LYS 79 2HE LYS 79 18.752 9.506 -1.268 637 HE3 LYS 79 3HE LYS 79 19.940 8.269 -0.858 638 HZ1 LYS 79 3HZ LYS 79 20.048 9.970 -3.290 639 HZ2 LYS 79 1HZ LYS 79 21.219 8.857 -2.786 640 HZ3 LYS 79 2HZ LYS 79 20.933 10.254 -1.876 641 H ILE 80 H ILE 80 16.042 3.563 -3.494 642 HA ILE 80 HA ILE 80 14.069 3.817 -5.512 643 HB ILE 80 HB ILE 80 15.612 1.363 -4.661 644 HG12 ILE 80 2HG1 ILE 80 16.194 3.083 -7.056 645 HG13 ILE 80 3HG1 ILE 80 16.843 3.502 -5.474 646 HG21 ILE 80 1HG2 ILE 80 14.267 0.267 -6.054 647 HG22 ILE 80 2HG2 ILE 80 13.518 1.762 -6.613 648 HG23 ILE 80 3HG2 ILE 80 15.007 1.187 -7.364 649 HD11 ILE 80 3HD1 ILE 80 17.252 0.729 -6.416 650 HD12 ILE 80 1HD1 ILE 80 18.169 2.008 -7.212 651 HD13 ILE 80 2HD1 ILE 80 18.308 1.776 -5.469 652 H ILE 81 H ILE 81 14.303 1.673 -2.678 653 HA ILE 81 HA ILE 81 11.795 0.430 -3.063 654 HB ILE 81 HB ILE 81 13.433 0.757 -0.548 655 HG12 ILE 81 2HG1 ILE 81 13.097 -1.660 -2.332 656 HG13 ILE 81 3HG1 ILE 81 14.436 -0.526 -2.474 657 HG21 ILE 81 1HG2 ILE 81 10.758 -0.256 -0.940 658 HG22 ILE 81 2HG2 ILE 81 11.831 -1.504 -0.310 659 HG23 ILE 81 3HG2 ILE 81 11.649 0.021 0.557 660 HD11 ILE 81 3HD1 ILE 81 14.097 -1.493 0.236 661 HD12 ILE 81 1HD1 ILE 81 14.369 -2.795 -0.921 662 HD13 ILE 81 2HD1 ILE 81 15.529 -1.473 -0.792 663 H ASP 82 H ASP 82 12.793 3.324 -1.336 664 HA ASP 82 HA ASP 82 10.312 3.742 0.000 665 HB2 ASP 82 2HB ASP 82 12.329 4.756 0.873 666 HB3 ASP 82 3HB ASP 82 12.584 5.634 -0.632 667 H GLU 83 H GLU 83 11.793 5.260 -2.863 668 HA GLU 83 HA GLU 83 9.660 6.941 -3.512 669 HB2 GLU 83 2HB GLU 83 11.858 5.703 -5.147 670 HB3 GLU 83 3HB GLU 83 10.632 6.714 -5.898 671 HG2 GLU 83 2HG GLU 83 12.468 7.553 -3.666 672 HG3 GLU 83 3HG GLU 83 12.657 7.967 -5.369 673 H PHE 84 H PHE 84 10.435 3.712 -4.806 674 HA PHE 84 HA PHE 84 8.084 3.515 -6.374 675 HB2 PHE 84 2HB PHE 84 10.160 1.563 -5.439 676 HB3 PHE 84 3HB PHE 84 8.700 0.978 -6.230 677 HD1 PHE 84 HD1 PHE 84 11.475 3.414 -6.699 678 HD2 PHE 84 HD2 PHE 84 8.638 0.823 -8.531 679 HE1 PHE 84 HE1 PHE 84 12.493 3.857 -8.894 680 HE2 PHE 84 HE2 PHE 84 9.652 1.262 -10.729 681 HZ PHE 84 HZ PHE 84 11.583 2.780 -10.913 682 H LYS 85 H LYS 85 8.633 3.226 -3.042 683 HA LYS 85 HA LYS 85 7.315 2.647 -1.281 684 HB2 LYS 85 2HB LYS 85 5.079 2.679 -3.316 685 HB3 LYS 85 3HB LYS 85 4.896 2.763 -1.569 686 HG2 LYS 85 2HG LYS 85 6.497 4.824 -3.029 687 HG3 LYS 85 3HG LYS 85 4.736 4.928 -2.958 688 HD2 LYS 85 2HD LYS 85 4.868 4.829 -0.490 689 HD3 LYS 85 3HD LYS 85 6.630 4.829 -0.609 690 HE2 LYS 85 2HE LYS 85 4.997 6.993 -1.887 691 HE3 LYS 85 3HE LYS 85 5.404 7.061 -0.173 692 HZ1 LYS 85 3HZ LYS 85 7.006 7.739 -2.380 693 HZ2 LYS 85 1HZ LYS 85 7.738 6.452 -1.562 694 HZ3 LYS 85 2HZ LYS 85 7.367 7.879 -0.733 695 H ILE 86 H ILE 86 8.685 0.566 -2.079 696 HA ILE 86 HA ILE 86 7.001 -1.669 -2.794 697 HB ILE 86 HB ILE 86 9.856 -1.798 -1.835 698 HG12 ILE 86 2HG1 ILE 86 8.845 -1.416 -4.662 699 HG13 ILE 86 3HG1 ILE 86 9.669 -0.194 -3.700 700 HG21 ILE 86 1HG2 ILE 86 9.943 -3.915 -2.786 701 HG22 ILE 86 2HG2 ILE 86 8.333 -3.866 -2.069 702 HG23 ILE 86 3HG2 ILE 86 8.532 -3.624 -3.804 703 HD11 ILE 86 3HD1 ILE 86 11.695 -1.445 -3.721 704 HD12 ILE 86 1HD1 ILE 86 10.894 -2.831 -4.461 705 HD13 ILE 86 2HD1 ILE 86 11.100 -1.338 -5.378 706 HA PRO 87 HA PRO 87 5.853 -2.663 1.365 707 HB2 PRO 87 2HB PRO 87 4.826 -5.123 0.850 708 HB3 PRO 87 3HB PRO 87 3.980 -3.624 0.444 709 HG2 PRO 87 2HG PRO 87 5.606 -5.417 -1.317 710 HG3 PRO 87 3HG PRO 87 4.055 -4.628 -1.652 711 HD2 PRO 87 2HD PRO 87 6.411 -3.660 -2.571 712 HD3 PRO 87 3HD PRO 87 5.047 -2.606 -2.144 713 H THR 88 H THR 88 6.318 -4.274 3.005 714 HA THR 88 HA THR 88 8.938 -5.515 2.576 715 HB THR 88 HB THR 88 7.949 -5.674 5.299 716 HG1 THR 88 HG1 THR 88 8.207 -3.275 5.529 717 HG21 THR 88 3HG2 THR 88 10.347 -4.598 3.866 718 HG22 THR 88 1HG2 THR 88 10.244 -5.906 5.044 719 HG23 THR 88 2HG2 THR 88 10.098 -4.230 5.572 720 H VAL 89 H VAL 89 9.277 -7.577 3.927 721 HA VAL 89 HA VAL 89 7.803 -9.653 2.863 722 HB VAL 89 HB VAL 89 9.315 -9.640 5.479 723 HG11 VAL 89 1HG1 VAL 89 8.233 -11.888 3.798 724 HG12 VAL 89 2HG1 VAL 89 9.519 -12.114 4.986 725 HG13 VAL 89 3HG1 VAL 89 7.928 -11.554 5.503 726 HG21 VAL 89 3HG2 VAL 89 10.223 -10.535 2.746 727 HG22 VAL 89 1HG2 VAL 89 10.615 -8.973 3.465 728 HG23 VAL 89 2HG2 VAL 89 11.189 -10.460 4.219 729 H GLU 90 H GLU 90 7.527 -8.322 6.161 730 HA GLU 90 HA GLU 90 5.451 -9.886 7.084 731 HB2 GLU 90 2HB GLU 90 6.246 -7.049 7.673 732 HB3 GLU 90 3HB GLU 90 4.848 -7.773 8.455 733 HG2 GLU 90 2HG GLU 90 6.277 -9.551 9.348 734 HG3 GLU 90 3HG GLU 90 7.676 -8.795 8.587 735 H GLN 91 H GLN 91 5.191 -6.738 5.439 736 HA GLN 91 HA GLN 91 2.400 -6.606 5.384 737 HB2 GLN 91 2HB GLN 91 4.239 -5.490 3.267 738 HB3 GLN 91 3HB GLN 91 2.646 -4.898 3.719 739 HG2 GLN 91 2HG GLN 91 5.222 -4.680 5.229 740 HG3 GLN 91 3HG GLN 91 4.145 -3.395 4.684 741 HE21 GLN 91 1HE2 GLN 91 5.198 -4.899 7.335 742 HE22 GLN 91 2HE2 GLN 91 3.826 -4.724 8.368 743 H TRP 92 H TRP 92 4.682 -7.967 3.041 744 HA TRP 92 HA TRP 92 2.796 -8.640 1.068 745 HB2 TRP 92 2HB TRP 92 5.240 -8.585 0.683 746 HB3 TRP 92 3HB TRP 92 5.417 -10.018 1.692 747 HD1 TRP 92 HD1 TRP 92 3.410 -9.065 -1.503 748 HE1 TRP 92 HE1 TRP 92 3.451 -11.094 -3.087 749 HE3 TRP 92 HE3 TRP 92 6.045 -12.326 1.422 750 HZ2 TRP 92 HZ2 TRP 92 4.466 -13.728 -3.095 751 HZ3 TRP 92 HZ3 TRP 92 6.508 -14.581 0.553 752 HH2 TRP 92 HH2 TRP 92 5.734 -15.266 -1.659 753 H LYS 93 H LYS 93 3.969 -10.386 3.898 754 HA LYS 93 HA LYS 93 2.742 -12.861 3.322 755 HB2 LYS 93 2HB LYS 93 3.506 -11.632 5.977 756 HB3 LYS 93 3HB LYS 93 3.030 -13.310 5.753 757 HG2 LYS 93 2HG LYS 93 5.275 -12.249 4.121 758 HG3 LYS 93 3HG LYS 93 5.557 -12.599 5.828 759 HD2 LYS 93 2HD LYS 93 5.891 -14.719 5.225 760 HD3 LYS 93 3HD LYS 93 4.159 -14.809 4.894 761 HE2 LYS 93 2HE LYS 93 4.789 -13.827 2.588 762 HE3 LYS 93 3HE LYS 93 6.427 -14.338 2.992 763 HZ1 LYS 93 3HZ LYS 93 4.153 -16.216 3.161 764 HZ2 LYS 93 1HZ LYS 93 5.804 -16.563 3.032 765 HZ3 LYS 93 2HZ LYS 93 4.962 -15.951 1.699 766 H ASP 94 H ASP 94 1.710 -10.199 5.456 767 HA ASP 94 HA ASP 94 -0.742 -11.292 6.222 768 HB2 ASP 94 2HB ASP 94 0.410 -8.546 6.143 769 HB3 ASP 94 3HB ASP 94 -1.331 -8.695 6.367 770 H GLN 95 H GLN 95 0.098 -9.263 3.449 771 HA GLN 95 HA GLN 95 -2.516 -8.873 2.489 772 HB2 GLN 95 2HB GLN 95 0.173 -8.830 1.132 773 HB3 GLN 95 3HB GLN 95 -1.319 -8.486 0.267 774 HG2 GLN 95 2HG GLN 95 -0.698 -6.987 2.766 775 HG3 GLN 95 3HG GLN 95 0.116 -6.554 1.263 776 HE21 GLN 95 1HE2 GLN 95 -2.804 -6.461 3.056 777 HE22 GLN 95 2HE2 GLN 95 -3.730 -5.537 1.927 778 H THR 96 H THR 96 -0.071 -11.318 1.687 779 HA THR 96 HA THR 96 -1.594 -12.659 -0.270 780 HB THR 96 HB THR 96 -0.048 -14.648 0.424 781 HG1 THR 96 HG1 THR 96 1.540 -14.170 1.808 782 HG21 THR 96 3HG2 THR 96 0.191 -13.140 -1.570 783 HG22 THR 96 1HG2 THR 96 1.710 -13.781 -0.946 784 HG23 THR 96 2HG2 THR 96 1.243 -12.118 -0.591 785 H ARG 97 H ARG 97 -1.445 -12.933 3.222 786 HA ARG 97 HA ARG 97 -2.869 -15.386 3.417 787 HB2 ARG 97 2HB ARG 97 -2.293 -13.171 5.376 788 HB3 ARG 97 3HB ARG 97 -3.258 -14.574 5.814 789 HG2 ARG 97 2HG ARG 97 -0.546 -14.937 4.620 790 HG3 ARG 97 3HG ARG 97 -0.724 -14.547 6.332 791 HD2 ARG 97 2HD ARG 97 -0.719 -16.845 6.399 792 HD3 ARG 97 3HD ARG 97 -2.447 -16.512 6.296 793 HE ARG 97 HE ARG 97 -1.232 -16.863 3.729 794 HH11 ARG 97 1HH1 ARG 97 -2.571 -18.527 6.478 795 HH12 ARG 97 2HH1 ARG 97 -2.993 -19.946 5.578 796 HH21 ARG 97 1HH2 ARG 97 -1.782 -18.726 2.533 797 HH22 ARG 97 2HH2 ARG 97 -2.543 -20.059 3.335 798 H ARG 98 H ARG 98 -3.924 -12.090 4.298 799 HA ARG 98 HA ARG 98 -6.619 -12.647 4.593 800 HB2 ARG 98 2HB ARG 98 -6.981 -10.216 4.146 801 HB3 ARG 98 3HB ARG 98 -5.729 -10.544 5.336 802 HG2 ARG 98 2HG ARG 98 -4.469 -9.137 4.163 803 HG3 ARG 98 3HG ARG 98 -4.318 -10.442 2.984 804 HD2 ARG 98 2HD ARG 98 -6.585 -9.471 2.091 805 HD3 ARG 98 3HD ARG 98 -6.048 -8.014 2.925 806 HE ARG 98 HE ARG 98 -4.029 -9.111 1.225 807 HH11 ARG 98 1HH1 ARG 98 -6.890 -7.129 1.294 808 HH12 ARG 98 2HH1 ARG 98 -6.468 -6.240 -0.131 809 HH21 ARG 98 1HH2 ARG 98 -3.461 -7.948 -0.653 810 HH22 ARG 98 2HH2 ARG 98 -4.517 -6.708 -1.239 811 H TYR 99 H TYR 99 -4.809 -11.834 1.677 812 HA TYR 99 HA TYR 99 -7.032 -11.543 -0.039 813 HB2 TYR 99 2HB TYR 99 -4.917 -10.661 -0.734 814 HB3 TYR 99 3HB TYR 99 -4.144 -12.235 -0.585 815 HD1 TYR 99 HD2 TYR 99 -7.065 -10.740 -2.387 816 HD2 TYR 99 HD1 TYR 99 -3.694 -13.331 -2.556 817 HE1 TYR 99 HE2 TYR 99 -7.538 -11.191 -4.758 818 HE2 TYR 99 HE1 TYR 99 -4.157 -13.788 -4.928 819 HH TYR 99 HH TYR 99 -5.592 -13.501 -6.613 820 H LYS 100 H LYS 100 -4.819 -14.290 0.457 821 HA LYS 100 HA LYS 100 -6.126 -16.081 -1.255 822 HB2 LYS 100 2HB LYS 100 -4.229 -16.361 1.034 823 HB3 LYS 100 3HB LYS 100 -5.033 -17.804 0.429 824 HG2 LYS 100 2HG LYS 100 -3.789 -16.065 -1.601 825 HG3 LYS 100 3HG LYS 100 -2.689 -16.907 -0.507 826 HD2 LYS 100 2HD LYS 100 -3.007 -18.318 -2.395 827 HD3 LYS 100 3HD LYS 100 -3.927 -19.026 -1.066 828 HE2 LYS 100 2HE LYS 100 -5.246 -19.091 -3.086 829 HE3 LYS 100 3HE LYS 100 -5.966 -17.952 -1.949 830 HZ1 LYS 100 3HZ LYS 100 -5.622 -16.248 -3.330 831 HZ2 LYS 100 1HZ LYS 100 -5.419 -17.420 -4.533 832 HZ3 LYS 100 2HZ LYS 100 -4.068 -16.761 -3.759 833 H GLU 101 H GLU 101 -6.880 -15.019 1.950 834 HA GLU 101 HA GLU 101 -8.708 -17.211 2.464 835 HB2 GLU 101 2HB GLU 101 -7.688 -14.874 3.995 836 HB3 GLU 101 3HB GLU 101 -9.265 -15.506 4.446 837 HG2 GLU 101 2HG GLU 101 -6.920 -17.338 4.172 838 HG3 GLU 101 3HG GLU 101 -7.158 -16.391 5.640 839 H SER 102 H SER 102 -10.920 -16.341 3.474 840 HA SER 102 HA SER 102 -12.202 -14.888 1.284 841 HB2 SER 102 2HB SER 102 -13.232 -16.703 3.454 842 HB3 SER 102 3HB SER 102 -14.326 -15.686 2.516 843 HG SER 102 HG SER 102 -13.325 -18.032 1.843 844 H SER 103 H SER 103 -14.282 -13.655 2.181 845 HA SER 103 HA SER 103 -13.299 -11.817 4.264 846 HB2 SER 103 2HB SER 103 -15.240 -11.128 2.051 847 HB3 SER 103 3HB SER 103 -14.431 -10.015 3.155 848 HG SER 103 HG SER 103 -13.590 -10.852 0.798 849 H ILE 104 H ILE 104 -15.531 -10.383 4.799 850 HA ILE 104 HA ILE 104 -16.996 -12.142 6.485 851 HB ILE 104 HB ILE 104 -17.760 -9.315 5.763 852 HG12 ILE 104 2HG1 ILE 104 -15.435 -9.305 6.457 853 HG13 ILE 104 3HG1 ILE 104 -16.429 -8.645 7.752 854 HG21 ILE 104 1HG2 ILE 104 -18.599 -9.409 8.174 855 HG22 ILE 104 2HG2 ILE 104 -19.514 -10.302 6.960 856 HG23 ILE 104 3HG2 ILE 104 -18.414 -11.158 8.040 857 HD11 ILE 104 3HD1 ILE 104 -15.406 -10.057 9.112 858 HD12 ILE 104 1HD1 ILE 104 -16.277 -11.360 8.302 859 HD13 ILE 104 2HD1 ILE 104 -14.657 -10.913 7.764 860 H GLN 105 H GLN 105 -19.214 -12.660 6.431 861 HA GLN 105 HA GLN 105 -20.961 -11.950 4.337 862 HB2 GLN 105 2HB GLN 105 -21.065 -14.287 3.304 863 HB3 GLN 105 3HB GLN 105 -19.716 -13.261 2.836 864 HG2 GLN 105 2HG GLN 105 -18.255 -14.433 4.371 865 HG3 GLN 105 3HG GLN 105 -19.604 -15.424 4.925 866 HE21 GLN 105 1HE2 GLN 105 -18.633 -17.339 4.318 867 HE22 GLN 105 2HE2 GLN 105 -18.447 -17.806 2.665 868 H ILE 106 H ILE 106 -22.750 -13.880 4.197 869 HA ILE 106 HA ILE 106 -23.571 -14.238 6.982 870 HB ILE 106 HB ILE 106 -25.235 -14.713 4.513 871 HG12 ILE 106 2HG1 ILE 106 -24.487 -12.399 4.495 872 HG13 ILE 106 3HG1 ILE 106 -26.189 -12.465 4.936 873 HG21 ILE 106 1HG2 ILE 106 -25.839 -14.461 7.442 874 HG22 ILE 106 2HG2 ILE 106 -27.078 -14.228 6.210 875 HG23 ILE 106 3HG2 ILE 106 -26.246 -15.777 6.341 876 HD11 ILE 106 3HD1 ILE 106 -23.831 -11.708 6.565 877 HD12 ILE 106 1HD1 ILE 106 -25.431 -10.971 6.471 878 HD13 ILE 106 2HD1 ILE 106 -25.201 -12.468 7.375 879 H GLY 107 H GLY 107 -22.580 -16.063 7.719 880 HA2 GLY 107 2HA GLY 107 -23.675 -18.556 7.213 881 HA3 GLY 107 3HA GLY 107 -22.262 -18.430 6.175 882 H ASN 108 H ASN 108 -23.271 -19.614 9.027 883 HA ASN 108 HA ASN 108 -21.431 -18.894 10.953 884 HB2 ASN 108 2HB ASN 108 -22.538 -21.668 10.463 885 HB3 ASN 108 3HB ASN 108 -21.840 -21.086 11.972 886 HD21 ASN 108 1HD2 ASN 108 -22.935 -18.623 12.228 887 HD22 ASN 108 2HD2 ASN 108 -24.650 -18.747 12.398 888 H GLY 109 H GLY 109 -19.328 -19.308 11.360 889 HA2 GLY 109 2HA GLY 109 -17.810 -21.467 10.553 890 HA3 GLY 109 3HA GLY 109 -17.687 -20.297 9.248 891 H HIS 110 H HIS 110 -17.860 -19.774 12.754 892 HA HIS 110 HA HIS 110 -15.080 -18.888 12.773 893 HB2 HIS 110 2HB HIS 110 -16.619 -16.921 12.245 894 HB3 HIS 110 3HB HIS 110 -17.240 -17.099 13.883 895 HD1 HIS 110 HD1 HIS 110 -15.868 -16.120 15.757 896 HD2 HIS 110 HD2 HIS 110 -13.860 -16.125 12.119 897 HE1 HIS 110 HE1 HIS 110 -13.789 -14.756 16.134 898 H GLY 111 H GLY 111 -14.308 -18.437 15.011 899 HA2 GLY 111 2HA GLY 111 -15.905 -19.706 17.112 900 HA3 GLY 111 3HA GLY 111 -14.341 -20.415 16.738 901 H GLN 112 H GLN 112 -13.817 -19.954 18.975 902 HA GLN 112 HA GLN 112 -12.485 -17.411 19.222 903 HB2 GLN 112 2HB GLN 112 -13.578 -16.838 21.384 904 HB3 GLN 112 3HB GLN 112 -14.660 -16.733 20.001 905 HG2 GLN 112 2HG GLN 112 -15.321 -19.152 20.656 906 HG3 GLN 112 3HG GLN 112 -14.610 -18.734 22.214 907 HE21 GLN 112 1HE2 GLN 112 -17.013 -19.293 22.618 908 HE22 GLN 112 2HE2 GLN 112 -18.081 -17.936 22.679 909 H SER 113 H SER 113 -10.836 -17.431 20.734 910 HA SER 113 HA SER 113 -9.863 -20.008 21.474 911 HB2 SER 113 2HB SER 113 -8.102 -18.563 22.705 912 HB3 SER 113 3HB SER 113 -8.176 -18.462 20.946 913 HG SER 113 HG SER 113 -9.129 -16.506 21.084 914 H GLN 114 H GLN 114 -8.855 -20.073 23.858 915 HA GLN 114 HA GLN 114 -11.118 -20.287 25.594 916 HB2 GLN 114 2HB GLN 114 -8.935 -21.730 25.480 917 HB3 GLN 114 3HB GLN 114 -8.294 -20.504 26.566 918 HG2 GLN 114 2HG GLN 114 -9.063 -22.095 28.033 919 HG3 GLN 114 3HG GLN 114 -10.425 -20.977 27.957 920 HE21 GLN 114 1HE2 GLN 114 -9.176 -23.906 26.402 921 HE22 GLN 114 2HE2 GLN 114 -10.717 -24.657 26.185 922 H GLY 115 H GLY 115 -8.082 -18.417 25.823 923 HA2 GLY 115 2HA GLY 115 -8.140 -16.059 26.352 924 HA3 GLY 115 3HA GLY 115 -9.595 -16.357 27.292 925 H LEU 116 H LEU 116 -6.122 -16.507 27.244 926 HA LEU 116 HA LEU 116 -6.124 -17.247 30.093 927 HB2 LEU 116 2HB LEU 116 -3.702 -17.295 28.332 928 HB3 LEU 116 3HB LEU 116 -3.989 -18.156 29.843 929 HG LEU 116 HG LEU 116 -5.856 -19.344 28.381 930 HD11 LEU 116 1HD1 LEU 116 -5.709 -19.130 26.173 931 HD12 LEU 116 2HD1 LEU 116 -3.959 -19.343 26.195 932 HD13 LEU 116 3HD1 LEU 116 -4.655 -17.746 26.463 933 HD21 LEU 116 3HD2 LEU 116 -3.990 -20.997 27.708 934 HD22 LEU 116 1HD2 LEU 116 -4.269 -20.683 29.421 935 HD23 LEU 116 2HD2 LEU 116 -2.921 -19.906 28.590 936 H GLU 117 H GLU 117 -6.812 -14.799 30.047 937 HA GLU 117 HA GLU 117 -4.401 -13.301 30.740 938 HB2 GLU 117 2HB GLU 117 -5.183 -12.789 28.344 939 HB3 GLU 117 3HB GLU 117 -6.558 -11.994 29.098 940 HG2 GLU 117 2HG GLU 117 -5.081 -10.465 30.253 941 HG3 GLU 117 3HG GLU 117 -3.673 -11.293 29.590 942 H1 GLY -9 H GLY -9 7.438 -12.142 10.685 943 HA2 GLY -9 2HA GLY -9 5.522 -13.240 8.988 944 HA3 GLY -9 3HA GLY -9 7.139 -12.759 8.496 945 H LYS -8 H LYS -8 6.731 -14.623 6.999 946 HA LYS -8 HA LYS -8 7.094 -17.239 8.249 947 HB2 LYS -8 2HB LYS -8 5.439 -16.705 6.322 948 HB3 LYS -8 3HB LYS -8 6.864 -16.762 5.292 949 HG2 LYS -8 2HG LYS -8 7.304 -19.061 6.198 950 HG3 LYS -8 3HG LYS -8 5.718 -18.978 6.969 951 HD2 LYS -8 2HD LYS -8 5.225 -20.049 4.982 952 HD3 LYS -8 3HD LYS -8 4.889 -18.364 4.577 953 HE2 LYS -8 2HE LYS -8 6.141 -19.130 2.767 954 HE3 LYS -8 3HE LYS -8 7.325 -18.287 3.765 955 HZ1 LYS -8 3HZ LYS -8 7.734 -20.711 2.818 956 HZ2 LYS -8 1HZ LYS -8 6.969 -21.136 4.266 957 HZ3 LYS -8 2HZ LYS -8 8.377 -20.200 4.296 958 H PHE -7 H PHE -7 8.501 -15.630 5.391 959 HA PHE -7 HA PHE -7 10.783 -17.194 5.215 960 HB2 PHE -7 2HB PHE -7 10.252 -14.345 4.384 961 HB3 PHE -7 3HB PHE -7 11.778 -15.152 4.038 962 HD1 PHE -7 HD2 PHE -7 8.134 -15.285 3.441 963 HD2 PHE -7 HD1 PHE -7 11.982 -16.649 2.240 964 HE1 PHE -7 HE2 PHE -7 7.149 -16.266 1.412 965 HE2 PHE -7 HE1 PHE -7 11.003 -17.632 0.208 966 HZ PHE -7 HZ PHE -7 8.583 -17.443 -0.208 967 H ILE -6 H ILE -6 10.945 -13.802 6.264 968 HA ILE -6 HA ILE -6 12.282 -12.740 7.769 969 HB ILE -6 HB ILE -6 12.252 -15.308 9.346 970 HG12 ILE -6 2HG1 ILE -6 9.959 -14.826 8.712 971 HG13 ILE -6 3HG1 ILE -6 10.185 -14.430 10.412 972 HG21 ILE -6 1HG2 ILE -6 13.364 -12.765 9.809 973 HG22 ILE -6 2HG2 ILE -6 11.967 -12.907 10.874 974 HG23 ILE -6 3HG2 ILE -6 13.247 -14.118 10.933 975 HD11 ILE -6 3HD1 ILE -6 9.314 -12.446 9.985 976 HD12 ILE -6 1HD1 ILE -6 10.746 -12.078 9.024 977 HD13 ILE -6 2HD1 ILE -6 9.316 -12.763 8.250 978 HA PRO -5 HA PRO -5 16.068 -14.783 6.066 979 HB2 PRO -5 2HB PRO -5 17.093 -12.501 5.012 980 HB3 PRO -5 3HB PRO -5 15.939 -13.524 4.149 981 HG2 PRO -5 2HG PRO -5 15.454 -10.999 5.682 982 HG3 PRO -5 3HG PRO -5 14.791 -11.502 4.116 983 HD2 PRO -5 2HD PRO -5 13.388 -11.702 6.423 984 HD3 PRO -5 3HD PRO -5 13.192 -12.850 5.084 985 H SER -4 H SER -4 16.666 -15.048 8.311 986 HA SER -4 HA SER -4 17.803 -12.821 9.744 987 HB2 SER -4 2HB SER -4 16.746 -14.446 11.111 988 HB3 SER -4 3HB SER -4 17.592 -15.776 10.319 989 HG SER -4 HG SER -4 18.834 -15.540 12.027 990 H ARG -3 H ARG -3 18.890 -14.594 7.219 991 HA ARG -3 HA ARG -3 21.438 -15.455 7.788 992 HB2 ARG -3 2HB ARG -3 20.080 -14.417 5.366 993 HB3 ARG -3 3HB ARG -3 21.837 -14.444 5.322 994 HG2 ARG -3 2HG ARG -3 20.970 -16.934 6.350 995 HG3 ARG -3 3HG ARG -3 20.014 -16.577 4.909 996 HD2 ARG -3 2HD ARG -3 21.751 -17.374 3.753 997 HD3 ARG -3 3HD ARG -3 22.554 -15.856 4.153 998 HE ARG -3 HE ARG -3 23.965 -17.022 5.511 999 HH11 ARG -3 1HH1 ARG -3 21.118 -18.945 4.949 1000 HH12 ARG -3 2HH1 ARG -3 21.738 -20.339 5.770 1001 HH21 ARG -3 1HH2 ARG -3 24.793 -18.851 6.594 1002 HH22 ARG -3 2HH2 ARG -3 23.829 -20.284 6.705 1003 HA PRO -2 HA PRO -2 24.005 -12.006 8.655 1004 HB2 PRO -2 2HB PRO -2 26.260 -12.547 7.243 1005 HB3 PRO -2 3HB PRO -2 25.794 -13.448 8.690 1006 HG2 PRO -2 2HG PRO -2 25.432 -14.175 5.809 1007 HG3 PRO -2 3HG PRO -2 25.957 -15.193 7.162 1008 HD2 PRO -2 2HD PRO -2 23.426 -15.238 6.202 1009 HD3 PRO -2 3HD PRO -2 23.804 -15.524 7.913 1010 H ALA -1 H ALA -1 23.313 -12.712 5.317 1011 HA ALA -1 HA ALA -1 23.025 -11.379 3.493 1012 HB1 ALA -1 1HB ALA -1 21.812 -9.990 5.253 1013 HB2 ALA -1 2HB ALA -1 23.259 -8.981 5.285 1014 HB3 ALA -1 3HB ALA -1 22.339 -9.157 3.791 1015 HA PRO 0 HA PRO 0 27.574 -10.743 3.233 1016 HB2 PRO 0 2HB PRO 0 27.824 -12.002 0.841 1017 HB3 PRO 0 3HB PRO 0 27.825 -12.863 2.385 1018 HG2 PRO 0 2HG PRO 0 25.591 -12.486 0.428 1019 HG3 PRO 0 3HG PRO 0 26.064 -13.945 1.318 1020 HD2 PRO 0 2HD PRO 0 23.995 -12.376 2.085 1021 HD3 PRO 0 3HD PRO 0 25.002 -13.264 3.247 1022 H LYS 1 H LYS 1 28.831 -9.574 1.630 1023 HA LYS 1 HA LYS 1 27.177 -7.637 0.178 1024 HB2 LYS 1 2HB LYS 1 29.897 -7.568 1.398 1025 HB3 LYS 1 3HB LYS 1 29.586 -6.529 0.015 1026 HG2 LYS 1 2HG LYS 1 29.094 -5.150 1.793 1027 HG3 LYS 1 3HG LYS 1 27.503 -5.777 1.355 1028 HD2 LYS 1 2HD LYS 1 27.677 -7.456 3.127 1029 HD3 LYS 1 3HD LYS 1 29.273 -6.837 3.560 1030 HE2 LYS 1 2HE LYS 1 27.644 -5.940 5.085 1031 HE3 LYS 1 3HE LYS 1 28.235 -4.641 4.050 1032 HZ1 LYS 1 3HZ LYS 1 26.149 -4.224 3.491 1033 HZ2 LYS 1 1HZ LYS 1 25.591 -5.527 4.414 1034 HZ3 LYS 1 2HZ LYS 1 26.018 -5.761 2.795 1035 HA PRO 2 HA PRO 2 28.400 -8.989 -3.812 1036 HB2 PRO 2 2HB PRO 2 28.759 -6.649 -5.140 1037 HB3 PRO 2 3HB PRO 2 27.165 -7.255 -4.676 1038 HG2 PRO 2 2HG PRO 2 28.873 -5.196 -3.332 1039 HG3 PRO 2 3HG PRO 2 27.126 -5.175 -3.636 1040 HD2 PRO 2 2HD PRO 2 28.178 -5.818 -1.225 1041 HD3 PRO 2 3HD PRO 2 26.668 -6.531 -1.829 1042 HA PRO 3 HA PRO 3 32.769 -9.064 -4.309 1043 HB2 PRO 3 2HB PRO 3 33.026 -9.260 -7.005 1044 HB3 PRO 3 3HB PRO 3 32.448 -10.591 -5.995 1045 HG2 PRO 3 2HG PRO 3 30.880 -8.642 -7.640 1046 HG3 PRO 3 3HG PRO 3 30.659 -10.393 -7.468 1047 HD2 PRO 3 2HD PRO 3 29.132 -8.595 -6.139 1048 HD3 PRO 3 3HD PRO 3 29.545 -10.182 -5.461 1049 H SER 4 H SER 4 31.004 -6.730 -6.277 1050 HA SER 4 HA SER 4 31.519 -4.646 -7.034 1051 HB2 SER 4 2HB SER 4 33.680 -4.444 -4.960 1052 HB3 SER 4 3HB SER 4 32.556 -3.206 -5.519 1053 HG SER 4 HG SER 4 31.489 -3.743 -3.786 1054 H SER 5 H SER 5 33.012 -6.986 -8.049 1055 HA SER 5 HA SER 5 35.511 -5.673 -8.882 1056 HB2 SER 5 2HB SER 5 36.044 -7.754 -7.876 1057 HB3 SER 5 3HB SER 5 34.727 -8.582 -8.707 1058 HG SER 5 HG SER 5 37.265 -8.147 -9.528 1059 H ALA 6 H ALA 6 35.861 -5.197 -10.974 1060 HA ALA 6 HA ALA 6 33.818 -6.053 -12.920 1061 HB1 ALA 6 1HB ALA 6 35.248 -3.686 -13.735 1062 HB2 ALA 6 2HB ALA 6 33.514 -3.942 -13.542 1063 HB3 ALA 6 3HB ALA 6 34.493 -3.460 -12.157 Start of MODEL 12 1 H1 MET -2 H MET -2 1.674 2.811 0.702 2 HA MET -2 HA MET -2 4.196 2.965 -0.751 3 HB2 MET -2 2HB MET -2 4.839 0.681 -0.152 4 HB3 MET -2 3HB MET -2 4.755 1.707 1.274 5 HG2 MET -2 2HG MET -2 3.612 -0.012 2.136 6 HG3 MET -2 3HG MET -2 2.259 0.701 1.262 7 HE1 MET -2 3HE MET -2 5.037 -2.124 -0.785 8 HE2 MET -2 1HE MET -2 5.380 -1.150 0.644 9 HE3 MET -2 2HE MET -2 4.774 -2.796 0.825 10 H ALA -1 H ALA -1 4.338 1.044 -2.331 11 HA ALA -1 HA ALA -1 1.676 0.234 -3.262 12 HB1 ALA -1 1HB ALA -1 3.483 2.075 -4.593 13 HB2 ALA -1 2HB ALA -1 3.056 0.698 -5.609 14 HB3 ALA -1 3HB ALA -1 1.788 1.715 -4.924 15 HA PRO 1 HA PRO 1 3.444 -3.708 -4.027 16 HB2 PRO 1 2HB PRO 1 2.173 -4.488 -6.296 17 HB3 PRO 1 3HB PRO 1 1.367 -4.399 -4.726 18 HG2 PRO 1 2HG PRO 1 1.331 -2.438 -6.988 19 HG3 PRO 1 3HG PRO 1 -0.009 -2.995 -5.969 20 HD2 PRO 1 2HD PRO 1 1.234 -0.622 -5.574 21 HD3 PRO 1 3HD PRO 1 0.550 -1.575 -4.241 22 H LEU 2 H LEU 2 5.585 -2.795 -4.478 23 HA LEU 2 HA LEU 2 6.331 -2.310 -7.220 24 HB2 LEU 2 2HB LEU 2 8.553 -1.942 -6.358 25 HB3 LEU 2 3HB LEU 2 7.372 -1.083 -5.372 26 HG LEU 2 HG LEU 2 7.882 -3.660 -4.227 27 HD11 LEU 2 1HD1 LEU 2 10.207 -3.515 -3.728 28 HD12 LEU 2 2HD1 LEU 2 10.345 -1.957 -4.542 29 HD13 LEU 2 3HD1 LEU 2 10.032 -3.416 -5.481 30 HD21 LEU 2 3HD2 LEU 2 8.491 -0.853 -3.305 31 HD22 LEU 2 1HD2 LEU 2 8.487 -2.293 -2.287 32 HD23 LEU 2 2HD2 LEU 2 6.988 -1.737 -3.033 33 H PHE 3 H PHE 3 7.708 -3.570 -8.488 34 HA PHE 3 HA PHE 3 7.950 -6.378 -7.627 35 HB2 PHE 3 2HB PHE 3 7.399 -5.201 -10.348 36 HB3 PHE 3 3HB PHE 3 7.953 -6.858 -10.139 37 HD1 PHE 3 HD2 PHE 3 5.348 -4.588 -8.724 38 HD2 PHE 3 HD1 PHE 3 6.344 -8.484 -10.120 39 HE1 PHE 3 HE2 PHE 3 3.026 -5.312 -8.351 40 HE2 PHE 3 HE1 PHE 3 4.023 -9.213 -9.751 41 HZ PHE 3 HZ PHE 3 2.361 -7.627 -8.864 42 H ALA 4 H ALA 4 9.754 -7.573 -8.682 43 HA ALA 4 HA ALA 4 12.020 -5.897 -9.460 44 HB1 ALA 4 1HB ALA 4 11.927 -7.670 -7.049 45 HB2 ALA 4 2HB ALA 4 13.451 -7.352 -7.880 46 HB3 ALA 4 3HB ALA 4 12.524 -6.016 -7.196 47 H VAL 5 H VAL 5 13.860 -7.215 -10.277 48 HA VAL 5 HA VAL 5 12.983 -9.807 -11.361 49 HB VAL 5 HB VAL 5 12.771 -8.116 -13.127 50 HG11 VAL 5 1HG1 VAL 5 14.748 -6.767 -12.066 51 HG12 VAL 5 2HG1 VAL 5 15.728 -7.732 -13.172 52 HG13 VAL 5 3HG1 VAL 5 14.448 -6.696 -13.802 53 HG21 VAL 5 3HG2 VAL 5 14.427 -10.477 -13.242 54 HG22 VAL 5 1HG2 VAL 5 13.246 -9.874 -14.404 55 HG23 VAL 5 2HG2 VAL 5 14.912 -9.299 -14.461 56 H THR 6 H THR 6 14.416 -11.409 -11.143 57 HA THR 6 HA THR 6 16.845 -10.967 -9.711 58 HB THR 6 HB THR 6 16.957 -13.554 -10.789 59 HG1 THR 6 HG1 THR 6 14.686 -14.141 -10.021 60 HG21 THR 6 3HG2 THR 6 17.446 -13.727 -8.614 61 HG22 THR 6 1HG2 THR 6 15.709 -13.787 -8.321 62 HG23 THR 6 2HG2 THR 6 16.567 -12.249 -8.226 63 H LEU 7 H LEU 7 18.935 -10.995 -10.406 64 HA LEU 7 HA LEU 7 19.342 -11.058 -13.323 65 HB2 LEU 7 2HB LEU 7 21.089 -9.656 -11.316 66 HB3 LEU 7 3HB LEU 7 21.117 -9.496 -13.071 67 HG LEU 7 HG LEU 7 18.856 -8.566 -11.302 68 HD11 LEU 7 1HD1 LEU 7 19.950 -6.323 -12.342 69 HD12 LEU 7 2HD1 LEU 7 21.391 -7.308 -12.093 70 HD13 LEU 7 3HD1 LEU 7 20.319 -6.957 -10.738 71 HD21 LEU 7 3HD2 LEU 7 18.979 -7.264 -13.818 72 HD22 LEU 7 1HD2 LEU 7 17.714 -8.318 -13.186 73 HD23 LEU 7 2HD2 LEU 7 19.056 -9.004 -14.103 74 H TYR 8 H TYR 8 20.002 -12.639 -10.435 75 HA TYR 8 HA TYR 8 22.101 -14.216 -11.743 76 HB2 TYR 8 2HB TYR 8 22.215 -13.210 -8.892 77 HB3 TYR 8 3HB TYR 8 23.346 -14.352 -9.609 78 HD1 TYR 8 HD1 TYR 8 22.038 -10.886 -9.978 79 HD2 TYR 8 HD2 TYR 8 25.249 -13.578 -10.721 80 HE1 TYR 8 HE1 TYR 8 23.421 -9.010 -10.763 81 HE2 TYR 8 HE2 TYR 8 26.641 -11.709 -11.507 82 HH TYR 8 HH TYR 8 25.657 -8.402 -11.141 83 H GLU 9 H GLU 9 22.378 -16.364 -10.799 84 HA GLU 9 HA GLU 9 19.810 -17.486 -10.062 85 HB2 GLU 9 2HB GLU 9 21.174 -18.600 -11.767 86 HB3 GLU 9 3HB GLU 9 22.468 -18.822 -10.598 87 HG2 GLU 9 2HG GLU 9 21.558 -20.848 -10.342 88 HG3 GLU 9 3HG GLU 9 20.426 -20.000 -9.290 89 H PHE 10 H PHE 10 19.247 -17.391 -7.987 90 HA PHE 10 HA PHE 10 21.284 -17.606 -5.909 91 HB2 PHE 10 2HB PHE 10 19.421 -15.846 -5.913 92 HB3 PHE 10 3HB PHE 10 18.336 -17.160 -5.472 93 HD1 PHE 10 HD2 PHE 10 21.770 -16.169 -4.395 94 HD2 PHE 10 HD1 PHE 10 17.762 -17.046 -3.260 95 HE1 PHE 10 HE2 PHE 10 22.378 -15.870 -2.030 96 HE2 PHE 10 HE1 PHE 10 18.364 -16.748 -0.893 97 HZ PHE 10 HZ PHE 10 20.675 -16.161 -0.275 98 H LYS 11 H LYS 11 21.425 -19.258 -4.463 99 HA LYS 11 HA LYS 11 19.668 -21.573 -4.949 100 HB2 LYS 11 2HB LYS 11 22.429 -21.687 -3.743 101 HB3 LYS 11 3HB LYS 11 21.471 -23.017 -4.381 102 HG2 LYS 11 2HG LYS 11 22.750 -22.775 -6.197 103 HG3 LYS 11 3HG LYS 11 21.676 -21.424 -6.568 104 HD2 LYS 11 2HD LYS 11 23.234 -19.857 -6.019 105 HD3 LYS 11 3HD LYS 11 23.980 -20.874 -4.784 106 HE2 LYS 11 2HE LYS 11 24.906 -22.286 -6.633 107 HE3 LYS 11 3HE LYS 11 24.308 -21.081 -7.773 108 HZ1 LYS 11 3HZ LYS 11 25.690 -19.422 -6.645 109 HZ2 LYS 11 1HZ LYS 11 26.617 -20.684 -7.285 110 HZ3 LYS 11 2HZ LYS 11 26.304 -20.622 -5.624 111 H ALA 12 H ALA 12 18.096 -21.260 -3.434 112 HA ALA 12 HA ALA 12 18.336 -20.238 -0.884 113 HB1 ALA 12 1HB ALA 12 16.354 -21.996 -0.483 114 HB2 ALA 12 2HB ALA 12 16.145 -20.492 -1.381 115 HB3 ALA 12 3HB ALA 12 16.403 -22.007 -2.246 116 H GLU 13 H GLU 13 18.319 -21.290 1.208 117 HA GLU 13 HA GLU 13 19.893 -23.782 1.214 118 HB2 GLU 13 2HB GLU 13 20.678 -22.949 3.497 119 HB3 GLU 13 3HB GLU 13 21.305 -22.113 2.083 120 HG2 GLU 13 2HG GLU 13 20.203 -20.190 2.553 121 HG3 GLU 13 3HG GLU 13 18.848 -21.022 3.315 122 H ARG 14 H ARG 14 17.220 -22.022 2.631 123 HA ARG 14 HA ARG 14 16.304 -24.527 3.865 124 HB2 ARG 14 2HB ARG 14 16.509 -21.810 5.130 125 HB3 ARG 14 3HB ARG 14 15.311 -22.970 5.688 126 HG2 ARG 14 2HG ARG 14 18.119 -23.893 5.464 127 HG3 ARG 14 3HG ARG 14 17.712 -22.786 6.777 128 HD2 ARG 14 2HD ARG 14 17.512 -25.108 7.495 129 HD3 ARG 14 3HD ARG 14 15.944 -24.302 7.512 130 HE ARG 14 HE ARG 14 15.221 -25.739 5.878 131 HH11 ARG 14 1HH1 ARG 14 18.688 -25.935 6.136 132 HH12 ARG 14 2HH1 ARG 14 18.819 -27.306 5.086 133 HH21 ARG 14 1HH2 ARG 14 15.381 -27.545 4.494 134 HH22 ARG 14 2HH2 ARG 14 16.938 -28.221 4.152 135 H ASP 15 H ASP 15 13.896 -23.999 4.723 136 HA ASP 15 HA ASP 15 12.333 -23.718 2.398 137 HB2 ASP 15 2HB ASP 15 11.426 -25.038 4.141 138 HB3 ASP 15 3HB ASP 15 11.649 -23.760 5.333 139 H ASP 16 H ASP 16 13.060 -21.489 5.043 140 HA ASP 16 HA ASP 16 11.300 -19.433 4.373 141 HB2 ASP 16 2HB ASP 16 13.111 -17.952 5.478 142 HB3 ASP 16 3HB ASP 16 12.350 -19.208 6.452 143 H GLU 17 H GLU 17 14.209 -20.473 2.840 144 HA GLU 17 HA GLU 17 14.394 -18.008 1.271 145 HB2 GLU 17 2HB GLU 17 16.240 -20.262 1.869 146 HB3 GLU 17 3HB GLU 17 16.423 -19.459 0.316 147 HG2 GLU 17 2HG GLU 17 17.913 -18.396 1.792 148 HG3 GLU 17 3HG GLU 17 16.558 -17.289 1.576 149 H LEU 18 H LEU 18 14.414 -18.052 -1.023 150 HA LEU 18 HA LEU 18 13.264 -20.466 -2.245 151 HB2 LEU 18 2HB LEU 18 11.502 -18.786 -1.794 152 HB3 LEU 18 3HB LEU 18 12.378 -17.640 -2.807 153 HG LEU 18 HG LEU 18 11.857 -20.084 -4.248 154 HD11 LEU 18 1HD1 LEU 18 9.818 -20.600 -3.530 155 HD12 LEU 18 2HD1 LEU 18 9.275 -19.068 -4.215 156 HD13 LEU 18 3HD1 LEU 18 9.735 -19.160 -2.515 157 HD21 LEU 18 3HD2 LEU 18 11.600 -18.632 -5.933 158 HD22 LEU 18 1HD2 LEU 18 12.202 -17.431 -4.789 159 HD23 LEU 18 2HD2 LEU 18 10.466 -17.630 -5.026 160 H ASP 19 H ASP 19 14.488 -21.151 -3.860 161 HA ASP 19 HA ASP 19 16.684 -19.709 -4.874 162 HB2 ASP 19 2HB ASP 19 16.964 -21.542 -6.431 163 HB3 ASP 19 3HB ASP 19 16.510 -22.190 -4.857 164 H VAL 20 H VAL 20 17.017 -18.633 -6.796 165 HA VAL 20 HA VAL 20 14.717 -18.230 -8.566 166 HB VAL 20 HB VAL 20 15.493 -15.742 -8.654 167 HG11 VAL 20 1HG1 VAL 20 13.525 -17.156 -7.155 168 HG12 VAL 20 2HG1 VAL 20 14.087 -15.782 -6.201 169 HG13 VAL 20 3HG1 VAL 20 13.446 -15.527 -7.825 170 HG21 VAL 20 3HG2 VAL 20 17.453 -16.124 -7.177 171 HG22 VAL 20 1HG2 VAL 20 16.368 -14.862 -6.592 172 HG23 VAL 20 2HG2 VAL 20 16.341 -16.462 -5.850 173 H SER 21 H SER 21 15.300 -17.292 -10.646 174 HA SER 21 HA SER 21 18.121 -17.784 -11.348 175 HB2 SER 21 2HB SER 21 15.591 -18.588 -12.746 176 HB3 SER 21 3HB SER 21 17.060 -18.314 -13.683 177 HG SER 21 HG SER 21 16.470 -20.518 -12.598 178 HA PRO 22 HA PRO 22 18.341 -13.769 -13.100 179 HB2 PRO 22 2HB PRO 22 19.931 -14.184 -15.261 180 HB3 PRO 22 3HB PRO 22 20.537 -14.222 -13.601 181 HG2 PRO 22 2HG PRO 22 19.793 -16.498 -15.399 182 HG3 PRO 22 3HG PRO 22 21.191 -16.335 -14.321 183 HD2 PRO 22 2HD PRO 22 18.998 -17.776 -13.655 184 HD3 PRO 22 3HD PRO 22 19.974 -16.912 -12.450 185 H GLY 23 H GLY 23 16.648 -12.815 -14.045 186 HA2 GLY 23 2HA GLY 23 15.693 -12.086 -16.153 187 HA3 GLY 23 3HA GLY 23 15.874 -13.732 -16.741 188 H GLU 24 H GLU 24 14.841 -13.861 -13.588 189 HA GLU 24 HA GLU 24 12.128 -14.489 -14.451 190 HB2 GLU 24 2HB GLU 24 13.795 -15.134 -12.062 191 HB3 GLU 24 3HB GLU 24 12.046 -15.152 -11.886 192 HG2 GLU 24 2HG GLU 24 13.615 -16.749 -13.897 193 HG3 GLU 24 3HG GLU 24 12.953 -17.366 -12.384 194 H ASN 25 H ASN 25 10.269 -13.689 -13.325 195 HA ASN 25 HA ASN 25 10.683 -10.968 -12.292 196 HB2 ASN 25 2HB ASN 25 8.136 -12.190 -13.377 197 HB3 ASN 25 3HB ASN 25 8.402 -10.497 -12.968 198 HD21 ASN 25 1HD2 ASN 25 8.823 -9.221 -14.607 199 HD22 ASN 25 2HD2 ASN 25 9.524 -9.691 -16.114 200 H LEU 26 H LEU 26 10.573 -10.766 -10.163 201 HA LEU 26 HA LEU 26 8.758 -12.543 -8.669 202 HB2 LEU 26 2HB LEU 26 11.401 -11.338 -7.888 203 HB3 LEU 26 3HB LEU 26 10.291 -12.052 -6.719 204 HG LEU 26 HG LEU 26 10.555 -14.074 -8.528 205 HD11 LEU 26 1HD1 LEU 26 12.375 -12.540 -9.568 206 HD12 LEU 26 2HD1 LEU 26 12.702 -14.259 -9.348 207 HD13 LEU 26 3HD1 LEU 26 13.354 -13.085 -8.206 208 HD21 LEU 26 3HD2 LEU 26 10.880 -13.807 -5.914 209 HD22 LEU 26 1HD2 LEU 26 12.583 -13.890 -6.366 210 HD23 LEU 26 2HD2 LEU 26 11.493 -15.211 -6.789 211 H SER 27 H SER 27 7.708 -11.646 -6.803 212 HA SER 27 HA SER 27 7.247 -8.752 -7.074 213 HB2 SER 27 2HB SER 27 5.336 -10.468 -7.387 214 HB3 SER 27 3HB SER 27 5.402 -10.646 -5.634 215 HG SER 27 HG SER 27 4.603 -8.687 -5.387 216 H ILE 28 H ILE 28 8.292 -7.591 -5.606 217 HA ILE 28 HA ILE 28 9.220 -8.704 -3.135 218 HB ILE 28 HB ILE 28 9.231 -5.852 -4.129 219 HG12 ILE 28 2HG1 ILE 28 11.385 -7.975 -4.041 220 HG13 ILE 28 3HG1 ILE 28 10.598 -7.350 -5.486 221 HG21 ILE 28 1HG2 ILE 28 9.297 -5.920 -1.697 222 HG22 ILE 28 2HG2 ILE 28 10.633 -7.069 -1.753 223 HG23 ILE 28 3HG2 ILE 28 10.858 -5.425 -2.348 224 HD11 ILE 28 3HD1 ILE 28 12.345 -5.773 -3.611 225 HD12 ILE 28 1HD1 ILE 28 12.814 -6.399 -5.192 226 HD13 ILE 28 2HD1 ILE 28 11.568 -5.156 -5.069 227 H CYS 29 H CYS 29 8.550 -8.245 -1.053 228 HA CYS 29 HA CYS 29 5.905 -6.966 -0.831 229 HB2 CYS 29 2HB CYS 29 7.009 -9.082 1.019 230 HB3 CYS 29 3HB CYS 29 5.360 -8.472 0.952 231 HG CYS 29 HG CYS 29 5.132 -9.508 -1.790 232 H ALA 30 H ALA 30 8.991 -7.521 0.817 233 HA ALA 30 HA ALA 30 8.965 -4.858 1.893 234 HB1 ALA 30 1HB ALA 30 8.064 -7.096 3.529 235 HB2 ALA 30 2HB ALA 30 9.387 -6.185 4.258 236 HB3 ALA 30 3HB ALA 30 7.900 -5.359 3.792 237 H HIS 31 H HIS 31 10.918 -4.630 3.481 238 HA HIS 31 HA HIS 31 13.148 -6.240 2.420 239 HB2 HIS 31 2HB HIS 31 14.550 -4.317 2.387 240 HB3 HIS 31 3HB HIS 31 13.043 -3.841 1.610 241 HD1 HIS 31 HD1 HIS 31 15.398 -2.568 3.893 242 HD2 HIS 31 HD2 HIS 31 11.245 -2.599 3.768 243 HE1 HIS 31 HE1 HIS 31 14.666 -0.710 5.421 244 H TYR 32 H TYR 32 15.181 -5.794 3.922 245 HA TYR 32 HA TYR 32 14.434 -5.713 6.737 246 HB2 TYR 32 2HB TYR 32 14.319 -8.123 5.816 247 HB3 TYR 32 3HB TYR 32 16.076 -8.033 5.751 248 HD1 TYR 32 HD2 TYR 32 13.164 -7.867 8.030 249 HD2 TYR 32 HD1 TYR 32 17.384 -8.295 7.705 250 HE1 TYR 32 HE2 TYR 32 13.277 -8.492 10.406 251 HE2 TYR 32 HE1 TYR 32 17.510 -8.923 10.080 252 HH TYR 32 HH TYR 32 16.384 -9.096 12.001 253 H ASP 33 H ASP 33 15.692 -3.995 7.216 254 HA ASP 33 HA ASP 33 17.557 -2.768 7.654 255 HB2 ASP 33 2HB ASP 33 18.257 -4.790 8.859 256 HB3 ASP 33 3HB ASP 33 18.945 -5.442 7.374 257 H TYR 34 H TYR 34 16.718 -3.544 4.802 258 HA TYR 34 HA TYR 34 17.345 -2.982 2.690 259 HB2 TYR 34 2HB TYR 34 19.639 -1.506 3.993 260 HB3 TYR 34 3HB TYR 34 18.983 -1.232 2.383 261 HD1 TYR 34 HD2 TYR 34 18.391 -0.791 5.985 262 HD2 TYR 34 HD1 TYR 34 16.972 0.048 2.063 263 HE1 TYR 34 HE2 TYR 34 16.845 0.885 6.909 264 HE2 TYR 34 HE1 TYR 34 15.423 1.727 2.975 265 HH TYR 34 HH TYR 34 14.785 2.011 6.321 266 H GLU 35 H GLU 35 18.382 -5.388 4.000 267 HA GLU 35 HA GLU 35 20.692 -5.840 2.236 268 HB2 GLU 35 2HB GLU 35 21.394 -7.518 4.124 269 HB3 GLU 35 3HB GLU 35 21.814 -5.815 4.249 270 HG2 GLU 35 2HG GLU 35 19.902 -5.444 5.716 271 HG3 GLU 35 3HG GLU 35 19.470 -7.148 5.586 272 H TRP 36 H TRP 36 17.593 -6.631 2.938 273 HA TRP 36 HA TRP 36 17.765 -9.096 1.425 274 HB2 TRP 36 2HB TRP 36 16.550 -9.064 4.196 275 HB3 TRP 36 3HB TRP 36 16.492 -10.414 3.066 276 HD1 TRP 36 HD1 TRP 36 18.603 -8.927 5.761 277 HE1 TRP 36 HE1 TRP 36 20.791 -10.262 6.002 278 HE3 TRP 36 HE3 TRP 36 18.302 -11.754 1.512 279 HZ2 TRP 36 HZ2 TRP 36 22.203 -12.249 4.578 280 HZ3 TRP 36 HZ3 TRP 36 20.113 -13.347 1.024 281 HH2 TRP 36 HH2 TRP 36 22.022 -13.587 2.526 282 H PHE 37 H PHE 37 16.011 -9.401 0.163 283 HA PHE 37 HA PHE 37 13.673 -7.676 0.657 284 HB2 PHE 37 2HB PHE 37 15.358 -7.961 -1.711 285 HB3 PHE 37 3HB PHE 37 13.650 -8.198 -2.063 286 HD1 PHE 37 HD1 PHE 37 12.214 -6.360 -0.493 287 HD2 PHE 37 HD2 PHE 37 16.044 -5.855 -2.279 288 HE1 PHE 37 HE1 PHE 37 11.880 -3.922 -0.513 289 HE2 PHE 37 HE2 PHE 37 15.717 -3.417 -2.301 290 HZ PHE 37 HZ PHE 37 13.633 -2.447 -1.417 291 H ILE 38 H ILE 38 11.740 -8.644 0.721 292 HA ILE 38 HA ILE 38 11.635 -11.528 0.410 293 HB ILE 38 HB ILE 38 9.307 -9.778 1.154 294 HG12 ILE 38 2HG1 ILE 38 11.121 -9.096 2.613 295 HG13 ILE 38 3HG1 ILE 38 9.987 -10.087 3.525 296 HG21 ILE 38 1HG2 ILE 38 9.668 -12.541 0.844 297 HG22 ILE 38 2HG2 ILE 38 9.565 -12.254 2.580 298 HG23 ILE 38 3HG2 ILE 38 8.268 -11.707 1.518 299 HD11 ILE 38 3HD1 ILE 38 12.592 -11.043 2.361 300 HD12 ILE 38 1HD1 ILE 38 12.314 -10.614 4.048 301 HD13 ILE 38 2HD1 ILE 38 11.471 -11.991 3.338 302 H ALA 39 H ALA 39 11.675 -11.952 -1.771 303 HA ALA 39 HA ALA 39 9.481 -10.821 -3.378 304 HB1 ALA 39 1HB ALA 39 12.144 -10.780 -3.944 305 HB2 ALA 39 2HB ALA 39 11.614 -12.216 -4.821 306 HB3 ALA 39 3HB ALA 39 10.855 -10.657 -5.142 307 H LYS 40 H LYS 40 8.061 -12.149 -4.405 308 HA LYS 40 HA LYS 40 8.337 -15.032 -3.864 309 HB2 LYS 40 2HB LYS 40 5.977 -15.204 -3.726 310 HB3 LYS 40 3HB LYS 40 6.413 -13.787 -2.779 311 HG2 LYS 40 2HG LYS 40 5.762 -12.336 -4.618 312 HG3 LYS 40 3HG LYS 40 5.365 -13.746 -5.603 313 HD2 LYS 40 2HD LYS 40 3.570 -14.349 -4.160 314 HD3 LYS 40 3HD LYS 40 4.070 -13.170 -2.944 315 HE2 LYS 40 2HE LYS 40 3.632 -11.382 -4.661 316 HE3 LYS 40 3HE LYS 40 2.904 -12.631 -5.670 317 HZ1 LYS 40 3HZ LYS 40 1.818 -11.266 -3.404 318 HZ2 LYS 40 1HZ LYS 40 1.698 -12.946 -3.247 319 HZ3 LYS 40 2HZ LYS 40 1.030 -12.173 -4.594 320 HA PRO 41 HA PRO 41 8.382 -15.900 -8.167 321 HB2 PRO 41 2HB PRO 41 7.098 -18.291 -8.230 322 HB3 PRO 41 3HB PRO 41 8.737 -18.097 -7.597 323 HG2 PRO 41 2HG PRO 41 6.142 -18.269 -6.114 324 HG3 PRO 41 3HG PRO 41 7.696 -19.039 -5.743 325 HD2 PRO 41 2HD PRO 41 6.839 -16.803 -4.479 326 HD3 PRO 41 3HD PRO 41 8.558 -17.127 -4.786 327 H ILE 42 H ILE 42 7.199 -14.835 -9.619 328 HA ILE 42 HA ILE 42 4.364 -14.477 -9.312 329 HB ILE 42 HB ILE 42 6.137 -13.712 -11.634 330 HG12 ILE 42 2HG1 ILE 42 5.191 -12.046 -9.293 331 HG13 ILE 42 3HG1 ILE 42 6.819 -12.689 -9.479 332 HG21 ILE 42 1HG2 ILE 42 3.342 -12.881 -10.877 333 HG22 ILE 42 2HG2 ILE 42 4.316 -12.085 -12.113 334 HG23 ILE 42 3HG2 ILE 42 3.840 -13.771 -12.316 335 HD11 ILE 42 3HD1 ILE 42 5.456 -10.543 -11.055 336 HD12 ILE 42 1HD1 ILE 42 6.983 -10.478 -10.176 337 HD13 ILE 42 2HD1 ILE 42 6.870 -11.390 -11.681 338 H ASN 43 H ASN 43 6.394 -16.739 -10.888 339 HA ASN 43 HA ASN 43 4.668 -17.506 -13.003 340 HB2 ASN 43 2HB ASN 43 7.242 -18.104 -12.320 341 HB3 ASN 43 3HB ASN 43 6.416 -19.597 -11.883 342 HD21 ASN 43 1HD2 ASN 43 7.152 -20.886 -13.477 343 HD22 ASN 43 2HD2 ASN 43 6.832 -20.635 -15.156 344 H ARG 43 H ARG 43 5.348 -19.059 -9.864 345 HA ARG 43 HA ARG 43 3.067 -20.811 -10.164 346 HB2 ARG 43 2HB ARG 43 3.763 -21.759 -8.031 347 HB3 ARG 43 3HB ARG 43 5.140 -21.620 -9.116 348 HG2 ARG 43 2HG ARG 43 6.146 -20.001 -7.861 349 HG3 ARG 43 3HG ARG 43 4.618 -19.399 -7.213 350 HD2 ARG 43 2HD ARG 43 5.970 -21.990 -6.464 351 HD3 ARG 43 3HD ARG 43 5.932 -20.521 -5.489 352 HE ARG 43 HE ARG 43 3.298 -21.258 -6.062 353 HH11 ARG 43 1HH1 ARG 43 6.037 -22.420 -4.254 354 HH12 ARG 43 2HH1 ARG 43 5.074 -23.239 -3.070 355 HH21 ARG 43 1HH2 ARG 43 2.019 -22.332 -4.509 356 HH22 ARG 43 2HH2 ARG 43 2.788 -23.189 -3.216 357 H LEU 44 H LEU 44 1.990 -21.025 -7.699 358 HA LEU 44 HA LEU 44 0.053 -19.066 -7.601 359 HB2 LEU 44 2HB LEU 44 1.065 -21.075 -5.655 360 HB3 LEU 44 3HB LEU 44 -0.049 -19.838 -5.075 361 HG LEU 44 HG LEU 44 -0.711 -21.588 -7.427 362 HD11 LEU 44 1HD1 LEU 44 -1.047 -22.163 -4.497 363 HD12 LEU 44 2HD1 LEU 44 -0.307 -23.176 -5.736 364 HD13 LEU 44 3HD1 LEU 44 -2.051 -22.915 -5.737 365 HD21 LEU 44 3HD2 LEU 44 -3.038 -21.059 -6.531 366 HD22 LEU 44 1HD2 LEU 44 -2.154 -19.742 -7.303 367 HD23 LEU 44 2HD2 LEU 44 -2.252 -19.826 -5.544 368 H GLY 45 H GLY 45 2.396 -19.410 -4.945 369 HA2 GLY 45 2HA GLY 45 3.496 -16.842 -5.083 370 HA3 GLY 45 3HA GLY 45 2.074 -16.754 -4.055 371 H GLY 46 H GLY 46 5.313 -17.996 -4.388 372 HA2 GLY 46 2HA GLY 46 5.208 -18.929 -1.589 373 HA3 GLY 46 3HA GLY 46 6.327 -19.540 -2.799 374 HA PRO 47 HA PRO 47 7.789 -15.103 -1.445 375 HB2 PRO 47 2HB PRO 47 6.834 -14.282 0.960 376 HB3 PRO 47 3HB PRO 47 6.036 -13.902 -0.571 377 HG2 PRO 47 2HG PRO 47 5.392 -16.042 1.421 378 HG3 PRO 47 3HG PRO 47 4.292 -14.963 0.543 379 HD2 PRO 47 2HD PRO 47 4.726 -17.528 -0.209 380 HD3 PRO 47 3HD PRO 47 4.372 -16.238 -1.376 381 H GLY 48 H GLY 48 9.777 -15.990 -1.082 382 HA2 GLY 48 2HA GLY 48 10.256 -17.257 1.535 383 HA3 GLY 48 3HA GLY 48 11.251 -17.480 0.104 384 H LEU 49 H LEU 49 13.024 -16.259 -0.130 385 HA LEU 49 HA LEU 49 13.266 -13.640 0.996 386 HB2 LEU 49 2HB LEU 49 13.688 -15.508 2.841 387 HB3 LEU 49 3HB LEU 49 15.291 -15.506 2.107 388 HG LEU 49 HG LEU 49 14.032 -12.959 3.069 389 HD11 LEU 49 1HD1 LEU 49 14.827 -13.252 5.238 390 HD12 LEU 49 2HD1 LEU 49 15.836 -14.625 4.787 391 HD13 LEU 49 3HD1 LEU 49 14.083 -14.804 4.854 392 HD21 LEU 49 3HD2 LEU 49 16.451 -12.387 3.384 393 HD22 LEU 49 1HD2 LEU 49 15.965 -12.660 1.710 394 HD23 LEU 49 2HD2 LEU 49 16.849 -13.910 2.586 395 H VAL 50 H VAL 50 14.520 -12.523 -0.338 396 HA VAL 50 HA VAL 50 16.781 -13.861 -1.646 397 HB VAL 50 HB VAL 50 14.987 -13.908 -3.284 398 HG11 VAL 50 1HG1 VAL 50 13.633 -12.079 -2.411 399 HG12 VAL 50 2HG1 VAL 50 14.860 -10.916 -2.918 400 HG13 VAL 50 3HG1 VAL 50 13.972 -11.846 -4.125 401 HG21 VAL 50 3HG2 VAL 50 17.185 -13.596 -4.176 402 HG22 VAL 50 1HG2 VAL 50 16.080 -12.563 -5.084 403 HG23 VAL 50 2HG2 VAL 50 17.128 -11.863 -3.850 404 HA PRO 51 HA PRO 51 18.857 -10.194 -0.303 405 HB2 PRO 51 2HB PRO 51 21.154 -10.558 -1.704 406 HB3 PRO 51 3HB PRO 51 20.757 -11.485 -0.253 407 HG2 PRO 51 2HG PRO 51 20.467 -12.255 -3.131 408 HG3 PRO 51 3HG PRO 51 21.069 -13.220 -1.770 409 HD2 PRO 51 2HD PRO 51 18.553 -13.477 -2.738 410 HD3 PRO 51 3HD PRO 51 18.947 -13.722 -1.025 411 H VAL 52 H VAL 52 19.490 -8.162 -1.090 412 HA VAL 52 HA VAL 52 18.194 -7.338 -3.495 413 HB VAL 52 HB VAL 52 20.181 -5.682 -1.955 414 HG11 VAL 52 1HG1 VAL 52 18.413 -5.215 -4.144 415 HG12 VAL 52 2HG1 VAL 52 17.888 -4.246 -2.766 416 HG13 VAL 52 3HG1 VAL 52 19.538 -4.099 -3.371 417 HG21 VAL 52 3HG2 VAL 52 18.895 -6.191 -0.156 418 HG22 VAL 52 1HG2 VAL 52 17.866 -4.936 -0.847 419 HG23 VAL 52 2HG2 VAL 52 17.500 -6.637 -1.139 420 H SER 53 H SER 53 21.352 -8.447 -2.727 421 HA SER 53 HA SER 53 22.698 -7.185 -4.925 422 HB2 SER 53 2HB SER 53 23.589 -9.582 -3.306 423 HB3 SER 53 3HB SER 53 24.607 -8.537 -4.296 424 HG SER 53 HG SER 53 24.062 -8.244 -1.763 425 H TYR 54 H TYR 54 20.430 -9.555 -4.830 426 HA TYR 54 HA TYR 54 21.437 -10.764 -7.320 427 HB2 TYR 54 2HB TYR 54 20.020 -12.117 -5.023 428 HB3 TYR 54 3HB TYR 54 20.172 -12.846 -6.618 429 HD1 TYR 54 HD1 TYR 54 22.226 -11.411 -3.858 430 HD2 TYR 54 HD2 TYR 54 22.044 -14.131 -7.125 431 HE1 TYR 54 HE1 TYR 54 24.432 -12.301 -3.232 432 HE2 TYR 54 HE2 TYR 54 24.249 -15.029 -6.508 433 HH TYR 54 HH TYR 54 25.647 -15.170 -4.370 434 H VAL 55 H VAL 55 19.560 -8.500 -6.671 435 HA VAL 55 HA VAL 55 17.453 -9.327 -8.501 436 HB VAL 55 HB VAL 55 15.630 -8.584 -7.142 437 HG11 VAL 55 1HG1 VAL 55 15.714 -10.192 -5.283 438 HG12 VAL 55 2HG1 VAL 55 16.310 -10.887 -6.792 439 HG13 VAL 55 3HG1 VAL 55 17.448 -10.382 -5.542 440 HG21 VAL 55 3HG2 VAL 55 16.348 -8.073 -4.623 441 HG22 VAL 55 1HG2 VAL 55 17.794 -7.486 -5.444 442 HG23 VAL 55 2HG2 VAL 55 16.215 -6.810 -5.847 443 H ARG 56 H ARG 56 16.144 -7.461 -9.245 444 HA ARG 56 HA ARG 56 17.585 -4.908 -9.008 445 HB2 ARG 56 2HB ARG 56 18.276 -5.772 -11.117 446 HB3 ARG 56 3HB ARG 56 16.640 -6.274 -11.524 447 HG2 ARG 56 2HG ARG 56 15.939 -4.019 -11.823 448 HG3 ARG 56 3HG ARG 56 17.454 -3.402 -11.161 449 HD2 ARG 56 2HD ARG 56 17.555 -5.200 -13.533 450 HD3 ARG 56 3HD ARG 56 17.040 -3.529 -13.762 451 HE ARG 56 HE ARG 56 19.314 -3.248 -12.353 452 HH11 ARG 56 1HH1 ARG 56 18.532 -5.066 -15.217 453 HH12 ARG 56 2HH1 ARG 56 20.126 -4.949 -15.884 454 HH21 ARG 56 1HH2 ARG 56 21.417 -3.087 -13.221 455 HH22 ARG 56 2HH2 ARG 56 21.767 -3.824 -14.748 456 H ILE 57 H ILE 57 16.281 -3.388 -8.252 457 HA ILE 57 HA ILE 57 13.465 -3.731 -8.068 458 HB ILE 57 HB ILE 57 15.101 -1.231 -7.628 459 HG12 ILE 57 2HG1 ILE 57 15.781 -3.135 -6.199 460 HG13 ILE 57 3HG1 ILE 57 15.056 -1.829 -5.268 461 HG21 ILE 57 1HG2 ILE 57 13.159 -0.190 -7.361 462 HG22 ILE 57 2HG2 ILE 57 12.276 -1.691 -7.638 463 HG23 ILE 57 3HG2 ILE 57 12.803 -1.266 -6.009 464 HD11 ILE 57 3HD1 ILE 57 13.047 -3.711 -6.076 465 HD12 ILE 57 1HD1 ILE 57 14.366 -4.530 -5.240 466 HD13 ILE 57 2HD1 ILE 57 13.519 -3.195 -4.457 467 H ILE 58 H ILE 58 12.203 -3.651 -9.812 468 HA ILE 58 HA ILE 58 12.460 -1.329 -11.594 469 HB ILE 58 HB ILE 58 11.787 -2.824 -13.505 470 HG12 ILE 58 2HG1 ILE 58 12.942 -5.192 -12.218 471 HG13 ILE 58 3HG1 ILE 58 11.398 -4.701 -11.530 472 HG21 ILE 58 1HG2 ILE 58 14.310 -4.006 -13.062 473 HG22 ILE 58 2HG2 ILE 58 13.932 -2.567 -14.008 474 HG23 ILE 58 3HG2 ILE 58 14.340 -2.416 -12.300 475 HD11 ILE 58 3HD1 ILE 58 11.263 -4.639 -14.391 476 HD12 ILE 58 1HD1 ILE 58 11.843 -6.209 -13.837 477 HD13 ILE 58 2HD1 ILE 58 10.308 -5.575 -13.241 478 H ASP 59 H ASP 59 10.591 -0.322 -12.032 479 HA ASP 59 HA ASP 59 8.227 -1.033 -10.643 480 HB2 ASP 59 2HB ASP 59 9.090 1.291 -11.552 481 HB3 ASP 59 3HB ASP 59 8.149 0.840 -12.972 482 H LEU 60 H LEU 60 6.266 -1.822 -11.391 483 HA LEU 60 HA LEU 60 6.425 -3.725 -13.503 484 HB2 LEU 60 2HB LEU 60 4.859 -3.423 -11.296 485 HB3 LEU 60 3HB LEU 60 3.747 -2.957 -12.581 486 HG LEU 60 HG LEU 60 5.174 -5.600 -12.297 487 HD11 LEU 60 1HD1 LEU 60 3.236 -6.478 -11.524 488 HD12 LEU 60 2HD1 LEU 60 2.230 -5.356 -12.439 489 HD13 LEU 60 3HD1 LEU 60 3.005 -4.828 -10.946 490 HD21 LEU 60 3HD2 LEU 60 5.065 -5.159 -14.619 491 HD22 LEU 60 1HD2 LEU 60 3.434 -4.500 -14.491 492 HD23 LEU 60 2HD2 LEU 60 3.708 -6.226 -14.256 493 H MET 61 H MET 61 5.029 -0.512 -13.175 494 HA MET 61 HA MET 61 3.797 -0.607 -15.788 495 HB2 MET 61 2HB MET 61 4.142 1.673 -13.833 496 HB3 MET 61 3HB MET 61 3.210 1.758 -15.322 497 HG2 MET 61 2HG MET 61 1.501 1.274 -13.954 498 HG3 MET 61 3HG MET 61 2.057 -0.380 -14.194 499 HE1 MET 61 3HE MET 61 0.987 -1.138 -11.214 500 HE2 MET 61 1HE MET 61 1.796 -1.723 -12.668 501 HE3 MET 61 2HE MET 61 2.629 -1.777 -11.115 502 H ASP 62 H ASP 62 6.803 0.385 -14.407 503 HA ASP 62 HA ASP 62 7.793 1.071 -17.054 504 HB2 ASP 62 2HB ASP 62 6.938 3.164 -15.694 505 HB3 ASP 62 3HB ASP 62 8.480 2.985 -14.862 506 HA PRO 63 HA PRO 63 10.705 -1.424 -14.441 507 HB2 PRO 63 2HB PRO 63 11.249 -3.246 -16.379 508 HB3 PRO 63 3HB PRO 63 9.874 -3.396 -15.278 509 HG2 PRO 63 2HG PRO 63 9.944 -2.383 -18.094 510 HG3 PRO 63 3HG PRO 63 8.766 -3.460 -17.321 511 HD2 PRO 63 2HD PRO 63 8.296 -0.821 -17.702 512 HD3 PRO 63 3HD PRO 63 7.643 -1.717 -16.315 513 H ALA 64 H ALA 64 10.817 0.412 -17.286 514 HA ALA 64 HA ALA 64 13.679 0.032 -17.702 515 HB1 ALA 64 1HB ALA 64 13.441 1.191 -19.718 516 HB2 ALA 64 2HB ALA 64 11.954 0.251 -19.580 517 HB3 ALA 64 3HB ALA 64 11.948 1.973 -19.198 518 H LYS 65 H LYS 65 11.538 2.114 -16.042 519 HA LYS 65 HA LYS 65 13.188 4.452 -16.046 520 HB2 LYS 65 2HB LYS 65 10.625 4.188 -15.557 521 HB3 LYS 65 3HB LYS 65 11.165 3.888 -13.910 522 HG2 LYS 65 2HG LYS 65 12.446 6.079 -14.104 523 HG3 LYS 65 3HG LYS 65 11.488 6.374 -15.557 524 HD2 LYS 65 2HD LYS 65 10.311 5.764 -12.848 525 HD3 LYS 65 3HD LYS 65 10.551 7.396 -13.478 526 HE2 LYS 65 2HE LYS 65 9.199 6.514 -15.519 527 HE3 LYS 65 3HE LYS 65 8.664 5.264 -14.397 528 HZ1 LYS 65 3HZ LYS 65 7.068 6.889 -14.153 529 HZ2 LYS 65 1HZ LYS 65 8.168 8.165 -14.309 530 HZ3 LYS 65 2HZ LYS 65 8.121 7.259 -12.882 531 H TYR 66 H TYR 66 12.497 1.927 -13.633 532 HA TYR 66 HA TYR 66 14.719 2.891 -11.998 533 HB2 TYR 66 2HB TYR 66 12.547 0.856 -11.486 534 HB3 TYR 66 3HB TYR 66 13.871 1.156 -10.367 535 HD1 TYR 66 HD1 TYR 66 10.973 2.761 -12.037 536 HD2 TYR 66 HD2 TYR 66 13.783 2.953 -8.848 537 HE1 TYR 66 HE1 TYR 66 9.693 4.603 -11.029 538 HE2 TYR 66 HE2 TYR 66 12.510 4.795 -7.830 539 HH TYR 66 HH TYR 66 9.551 6.045 -9.352 540 H ALA 67 H ALA 67 14.990 1.426 -14.609 541 HA ALA 67 HA ALA 67 16.206 -1.094 -13.813 542 HB1 ALA 67 1HB ALA 67 15.708 -1.738 -15.877 543 HB2 ALA 67 2HB ALA 67 14.971 -0.159 -16.151 544 HB3 ALA 67 3HB ALA 67 16.665 -0.426 -16.565 545 H SER 68 H SER 68 17.229 1.843 -13.372 546 HA SER 68 HA SER 68 19.966 1.345 -14.344 547 HB2 SER 68 2HB SER 68 20.281 3.824 -14.141 548 HB3 SER 68 3HB SER 68 19.083 3.355 -15.347 549 HG SER 68 HG SER 68 18.754 4.974 -13.295 550 H VAL 69 H VAL 69 17.951 1.924 -11.604 551 HA VAL 69 HA VAL 69 19.757 2.862 -9.716 552 HB VAL 69 HB VAL 69 17.366 2.678 -9.257 553 HG11 VAL 69 1HG1 VAL 69 17.340 0.313 -10.390 554 HG12 VAL 69 2HG1 VAL 69 17.611 -0.247 -8.739 555 HG13 VAL 69 3HG1 VAL 69 16.183 0.715 -9.122 556 HG21 VAL 69 3HG2 VAL 69 17.531 1.679 -6.961 557 HG22 VAL 69 1HG2 VAL 69 19.166 1.163 -7.376 558 HG23 VAL 69 2HG2 VAL 69 18.766 2.880 -7.338 559 H ASP 70 H ASP 70 21.256 1.943 -8.386 560 HA ASP 70 HA ASP 70 22.114 -0.767 -9.100 561 HB2 ASP 70 2HB ASP 70 23.618 1.294 -7.478 562 HB3 ASP 70 3HB ASP 70 24.263 -0.189 -8.177 563 H THR 71 H THR 71 20.768 -2.055 -7.885 564 HA THR 71 HA THR 71 19.908 -1.701 -5.294 565 HB THR 71 HB THR 71 20.190 -4.384 -5.297 566 HG1 THR 71 HG1 THR 71 21.354 -4.339 -7.295 567 HG21 THR 71 3HG2 THR 71 17.963 -4.506 -6.191 568 HG22 THR 71 1HG2 THR 71 18.148 -2.947 -6.995 569 HG23 THR 71 2HG2 THR 71 18.090 -3.031 -5.234 570 H TYR 72 H TYR 72 23.040 -2.737 -6.432 571 HA TYR 72 HA TYR 72 24.062 -3.914 -4.124 572 HB2 TYR 72 2HB TYR 72 25.307 -4.084 -6.154 573 HB3 TYR 72 3HB TYR 72 25.414 -2.335 -6.314 574 HD1 TYR 72 HD2 TYR 72 26.036 -4.392 -3.281 575 HD2 TYR 72 HD1 TYR 72 27.726 -1.957 -6.334 576 HE1 TYR 72 HE2 TYR 72 28.194 -4.421 -2.101 577 HE2 TYR 72 HE1 TYR 72 29.889 -1.981 -5.163 578 HH TYR 72 HH TYR 72 31.063 -2.866 -3.481 579 H ASP 73 H ASP 73 24.249 -0.514 -5.164 580 HA ASP 73 HA ASP 73 25.590 0.422 -2.869 581 HB2 ASP 73 2HB ASP 73 25.141 1.554 -5.200 582 HB3 ASP 73 3HB ASP 73 23.707 2.181 -4.392 583 H ARG 74 H ARG 74 24.829 0.224 -0.869 584 HA ARG 74 HA ARG 74 22.181 -0.185 -0.129 585 HB2 ARG 74 2HB ARG 74 22.882 0.088 2.109 586 HB3 ARG 74 3HB ARG 74 24.281 -0.553 1.259 587 HG2 ARG 74 2HG ARG 74 23.879 2.377 1.797 588 HG3 ARG 74 3HG ARG 74 24.753 1.295 2.883 589 HD2 ARG 74 2HD ARG 74 25.441 1.989 0.034 590 HD3 ARG 74 3HD ARG 74 26.350 2.400 1.487 591 HE ARG 74 HE ARG 74 26.485 -0.035 0.023 592 HH11 ARG 74 1HH1 ARG 74 26.675 1.293 3.236 593 HH12 ARG 74 2HH1 ARG 74 27.686 0.023 3.842 594 HH21 ARG 74 1HH2 ARG 74 27.816 -1.713 0.809 595 HH22 ARG 74 2HH2 ARG 74 28.335 -1.686 2.460 596 H GLU 75 H GLU 75 23.841 2.738 -0.918 597 HA GLU 75 HA GLU 75 22.161 4.572 0.432 598 HB2 GLU 75 2HB GLU 75 24.210 4.709 -1.701 599 HB3 GLU 75 3HB GLU 75 23.045 6.025 -1.665 600 HG2 GLU 75 2HG GLU 75 23.613 6.380 0.729 601 HG3 GLU 75 3HG GLU 75 24.884 5.171 0.556 602 H GLN 76 H GLN 76 22.213 3.506 -2.968 603 HA GLN 76 HA GLN 76 19.948 4.928 -3.793 604 HB2 GLN 76 2HB GLN 76 21.008 2.305 -4.860 605 HB3 GLN 76 3HB GLN 76 19.878 3.365 -5.691 606 HG2 GLN 76 2HG GLN 76 22.068 4.970 -5.021 607 HG3 GLN 76 3HG GLN 76 22.742 3.452 -5.614 608 HE21 GLN 76 1HE2 GLN 76 22.837 3.138 -7.735 609 HE22 GLN 76 2HE2 GLN 76 22.070 4.122 -8.930 610 H VAL 77 H VAL 77 20.188 1.459 -2.984 611 HA VAL 77 HA VAL 77 17.511 0.813 -3.126 612 HB VAL 77 HB VAL 77 19.562 -0.698 -2.644 613 HG11 VAL 77 1HG1 VAL 77 19.922 -1.298 -0.346 614 HG12 VAL 77 2HG1 VAL 77 20.129 0.447 -0.512 615 HG13 VAL 77 3HG1 VAL 77 18.645 -0.204 0.185 616 HG21 VAL 77 3HG2 VAL 77 16.731 -0.992 -1.999 617 HG22 VAL 77 1HG2 VAL 77 17.809 -2.066 -2.890 618 HG23 VAL 77 2HG2 VAL 77 17.770 -2.120 -1.128 619 H MET 78 H MET 78 19.243 2.470 -0.576 620 HA MET 78 HA MET 78 17.236 2.255 1.415 621 HB2 MET 78 2HB MET 78 19.736 3.773 1.037 622 HB3 MET 78 3HB MET 78 18.549 4.542 2.082 623 HG2 MET 78 2HG MET 78 18.438 2.344 3.334 624 HG3 MET 78 3HG MET 78 19.870 1.871 2.424 625 HE1 MET 78 3HE MET 78 22.155 3.808 2.473 626 HE2 MET 78 1HE MET 78 22.734 3.464 4.103 627 HE3 MET 78 2HE MET 78 22.056 2.168 3.116 628 H LYS 79 H LYS 79 18.100 4.902 -0.808 629 HA LYS 79 HA LYS 79 16.126 6.708 -0.062 630 HB2 LYS 79 2HB LYS 79 17.410 6.236 -2.755 631 HB3 LYS 79 3HB LYS 79 16.372 7.610 -2.400 632 HG2 LYS 79 2HG LYS 79 17.930 8.622 -1.065 633 HG3 LYS 79 3HG LYS 79 18.714 7.099 -0.637 634 HD2 LYS 79 2HD LYS 79 19.724 6.950 -2.819 635 HD3 LYS 79 3HD LYS 79 18.830 8.368 -3.372 636 HE2 LYS 79 2HE LYS 79 20.605 8.593 -0.984 637 HE3 LYS 79 3HE LYS 79 21.324 8.577 -2.593 638 HZ1 LYS 79 3HZ LYS 79 19.439 10.369 -2.983 639 HZ2 LYS 79 1HZ LYS 79 20.964 10.786 -2.381 640 HZ3 LYS 79 2HZ LYS 79 19.657 10.605 -1.322 641 H ILE 80 H ILE 80 16.005 4.171 -2.547 642 HA ILE 80 HA ILE 80 13.409 4.701 -3.465 643 HB ILE 80 HB ILE 80 15.096 2.215 -3.481 644 HG12 ILE 80 2HG1 ILE 80 14.399 2.909 -6.063 645 HG13 ILE 80 3HG1 ILE 80 14.556 4.470 -5.265 646 HG21 ILE 80 1HG2 ILE 80 12.256 2.525 -4.416 647 HG22 ILE 80 2HG2 ILE 80 13.335 1.282 -5.044 648 HG23 ILE 80 3HG2 ILE 80 12.924 1.307 -3.330 649 HD11 ILE 80 3HD1 ILE 80 16.797 4.197 -4.878 650 HD12 ILE 80 1HD1 ILE 80 16.701 2.436 -4.920 651 HD13 ILE 80 2HD1 ILE 80 16.606 3.361 -6.419 652 H ILE 81 H ILE 81 14.515 2.268 -1.103 653 HA ILE 81 HA ILE 81 12.008 1.270 -0.409 654 HB ILE 81 HB ILE 81 14.549 1.465 1.200 655 HG12 ILE 81 2HG1 ILE 81 13.190 -0.902 -0.105 656 HG13 ILE 81 3HG1 ILE 81 14.512 0.008 -0.829 657 HG21 ILE 81 1HG2 ILE 81 13.248 1.134 2.997 658 HG22 ILE 81 2HG2 ILE 81 11.857 0.655 2.025 659 HG23 ILE 81 3HG2 ILE 81 13.122 -0.518 2.393 660 HD11 ILE 81 3HD1 ILE 81 14.981 -1.045 1.883 661 HD12 ILE 81 1HD1 ILE 81 14.863 -2.230 0.582 662 HD13 ILE 81 2HD1 ILE 81 16.065 -0.942 0.497 663 H ASP 82 H ASP 82 13.748 4.091 0.764 664 HA ASP 82 HA ASP 82 11.983 4.648 2.929 665 HB2 ASP 82 2HB ASP 82 14.189 5.562 3.033 666 HB3 ASP 82 3HB ASP 82 14.009 6.338 1.462 667 H GLU 83 H GLU 83 12.357 6.090 -0.308 668 HA GLU 83 HA GLU 83 10.231 7.895 -0.129 669 HB2 GLU 83 2HB GLU 83 11.577 6.551 -2.458 670 HB3 GLU 83 3HB GLU 83 10.228 7.652 -2.697 671 HG2 GLU 83 2HG GLU 83 11.716 9.215 -1.164 672 HG3 GLU 83 3HG GLU 83 13.003 8.208 -1.825 673 H PHE 84 H PHE 84 10.303 4.603 -1.474 674 HA PHE 84 HA PHE 84 7.548 4.536 -2.132 675 HB2 PHE 84 2HB PHE 84 9.668 2.428 -1.810 676 HB3 PHE 84 3HB PHE 84 7.990 1.983 -2.108 677 HD1 PHE 84 HD1 PHE 84 10.433 4.462 -3.466 678 HD2 PHE 84 HD2 PHE 84 7.500 1.487 -4.283 679 HE1 PHE 84 HE1 PHE 84 10.781 4.787 -5.881 680 HE2 PHE 84 HE2 PHE 84 7.844 1.807 -6.698 681 HZ PHE 84 HZ PHE 84 9.486 3.457 -7.500 682 H LYS 85 H LYS 85 9.197 4.305 0.824 683 HA LYS 85 HA LYS 85 8.532 3.894 2.959 684 HB2 LYS 85 2HB LYS 85 5.735 4.021 1.818 685 HB3 LYS 85 3HB LYS 85 6.179 4.193 3.511 686 HG2 LYS 85 2HG LYS 85 7.290 6.060 1.457 687 HG3 LYS 85 3HG LYS 85 5.671 6.303 2.117 688 HD2 LYS 85 2HD LYS 85 6.638 6.303 4.392 689 HD3 LYS 85 3HD LYS 85 8.247 6.155 3.682 690 HE2 LYS 85 2HE LYS 85 6.491 8.370 2.754 691 HE3 LYS 85 3HE LYS 85 7.229 8.503 4.350 692 HZ1 LYS 85 3HZ LYS 85 8.818 9.458 3.032 693 HZ2 LYS 85 1HZ LYS 85 8.511 8.449 1.709 694 HZ3 LYS 85 2HZ LYS 85 9.368 7.859 3.043 695 H ILE 86 H ILE 86 9.352 1.681 1.680 696 HA ILE 86 HA ILE 86 7.400 -0.429 1.811 697 HB ILE 86 HB ILE 86 10.396 -0.711 1.588 698 HG12 ILE 86 2HG1 ILE 86 8.352 -0.492 -0.632 699 HG13 ILE 86 3HG1 ILE 86 9.480 0.778 -0.171 700 HG21 ILE 86 1HG2 ILE 86 10.075 -2.900 1.188 701 HG22 ILE 86 2HG2 ILE 86 8.556 -2.640 2.044 702 HG23 ILE 86 3HG2 ILE 86 8.589 -2.623 0.281 703 HD11 ILE 86 3HD1 ILE 86 10.275 -1.943 -1.176 704 HD12 ILE 86 1HD1 ILE 86 10.190 -0.482 -2.160 705 HD13 ILE 86 2HD1 ILE 86 11.348 -0.587 -0.833 706 HA PRO 87 HA PRO 87 7.898 -1.133 6.170 707 HB2 PRO 87 2HB PRO 87 6.367 -3.371 6.285 708 HB3 PRO 87 3HB PRO 87 5.684 -1.746 6.160 709 HG2 PRO 87 2HG PRO 87 6.123 -3.786 4.014 710 HG3 PRO 87 3HG PRO 87 4.721 -2.735 4.289 711 HD2 PRO 87 2HD PRO 87 6.609 -2.189 2.426 712 HD3 PRO 87 3HD PRO 87 5.734 -0.915 3.300 713 H THR 88 H THR 88 8.582 -2.953 7.584 714 HA THR 88 HA THR 88 10.786 -4.376 6.339 715 HB THR 88 HB THR 88 10.573 -5.079 9.079 716 HG1 THR 88 HG1 THR 88 10.783 -2.668 9.714 717 HG21 THR 88 3HG2 THR 88 12.370 -3.185 7.568 718 HG22 THR 88 1HG2 THR 88 12.675 -4.880 7.947 719 HG23 THR 88 2HG2 THR 88 12.645 -3.679 9.239 720 H VAL 89 H VAL 89 11.194 -6.671 7.057 721 HA VAL 89 HA VAL 89 9.263 -8.389 6.105 722 HB VAL 89 HB VAL 89 11.405 -9.024 8.139 723 HG11 VAL 89 1HG1 VAL 89 10.561 -11.076 8.201 724 HG12 VAL 89 2HG1 VAL 89 9.314 -10.638 7.031 725 HG13 VAL 89 3HG1 VAL 89 10.880 -11.228 6.474 726 HG21 VAL 89 3HG2 VAL 89 12.318 -8.035 6.115 727 HG22 VAL 89 1HG2 VAL 89 12.710 -9.753 6.189 728 HG23 VAL 89 2HG2 VAL 89 11.422 -9.187 5.125 729 H GLU 90 H GLU 90 10.093 -7.930 9.549 730 HA GLU 90 HA GLU 90 8.100 -9.478 10.659 731 HB2 GLU 90 2HB GLU 90 9.144 -6.870 11.777 732 HB3 GLU 90 3HB GLU 90 8.371 -8.159 12.689 733 HG2 GLU 90 2HG GLU 90 10.285 -9.637 11.835 734 HG3 GLU 90 3HG GLU 90 11.083 -8.119 11.427 735 H GLN 91 H GLN 91 7.954 -6.025 9.827 736 HA GLN 91 HA GLN 91 5.372 -5.506 10.724 737 HB2 GLN 91 2HB GLN 91 7.152 -4.287 8.662 738 HB3 GLN 91 3HB GLN 91 5.465 -3.793 8.709 739 HG2 GLN 91 2HG GLN 91 7.151 -2.399 10.013 740 HG3 GLN 91 3HG GLN 91 5.664 -2.870 10.834 741 HE21 GLN 91 1HE2 GLN 91 8.999 -3.956 10.338 742 HE22 GLN 91 2HE2 GLN 91 9.218 -4.575 11.936 743 H TRP 92 H TRP 92 6.491 -7.010 7.766 744 HA TRP 92 HA TRP 92 4.044 -6.896 6.350 745 HB2 TRP 92 2HB TRP 92 6.245 -7.346 5.291 746 HB3 TRP 92 3HB TRP 92 6.274 -8.923 6.075 747 HD1 TRP 92 HD1 TRP 92 3.447 -7.189 4.043 748 HE1 TRP 92 HE1 TRP 92 2.690 -8.821 2.203 749 HE3 TRP 92 HE3 TRP 92 6.730 -11.004 4.940 750 HZ2 TRP 92 HZ2 TRP 92 3.391 -11.386 1.256 751 HZ3 TRP 92 HZ3 TRP 92 6.621 -13.012 3.522 752 HH2 TRP 92 HH2 TRP 92 4.985 -13.197 1.719 753 H LYS 93 H LYS 93 5.459 -9.297 8.524 754 HA LYS 93 HA LYS 93 3.450 -11.262 8.167 755 HB2 LYS 93 2HB LYS 93 5.536 -10.758 10.269 756 HB3 LYS 93 3HB LYS 93 4.337 -12.027 10.487 757 HG2 LYS 93 2HG LYS 93 5.174 -13.302 8.763 758 HG3 LYS 93 3HG LYS 93 5.923 -11.919 7.962 759 HD2 LYS 93 2HD LYS 93 6.897 -12.682 10.669 760 HD3 LYS 93 3HD LYS 93 7.359 -13.693 9.298 761 HE2 LYS 93 2HE LYS 93 8.530 -11.974 8.266 762 HE3 LYS 93 3HE LYS 93 7.672 -10.720 9.160 763 HZ1 LYS 93 3HZ LYS 93 9.812 -10.828 10.084 764 HZ2 LYS 93 1HZ LYS 93 9.808 -12.519 10.144 765 HZ3 LYS 93 2HZ LYS 93 8.820 -11.633 11.193 766 H ASP 94 H ASP 94 3.953 -8.804 10.690 767 HA ASP 94 HA ASP 94 1.670 -9.414 12.205 768 HB2 ASP 94 2HB ASP 94 3.494 -8.025 13.069 769 HB3 ASP 94 3HB ASP 94 3.104 -6.767 11.899 770 H GLN 95 H GLN 95 2.152 -7.239 9.467 771 HA GLN 95 HA GLN 95 -0.392 -6.020 9.545 772 HB2 GLN 95 2HB GLN 95 1.786 -6.274 7.531 773 HB3 GLN 95 3HB GLN 95 0.199 -5.774 6.961 774 HG2 GLN 95 2HG GLN 95 1.850 -4.409 9.075 775 HG3 GLN 95 3HG GLN 95 1.580 -3.848 7.425 776 HE21 GLN 95 1HE2 GLN 95 -0.787 -3.608 6.847 777 HE22 GLN 95 2HE2 GLN 95 -1.797 -2.867 8.037 778 H THR 96 H THR 96 0.848 -8.762 7.650 779 HA THR 96 HA THR 96 -1.548 -9.313 6.282 780 HB THR 96 HB THR 96 -0.520 -11.691 6.127 781 HG1 THR 96 HG1 THR 96 0.939 -11.585 7.825 782 HG21 THR 96 3HG2 THR 96 0.890 -11.011 4.342 783 HG22 THR 96 1HG2 THR 96 1.162 -9.427 5.066 784 HG23 THR 96 2HG2 THR 96 -0.422 -9.836 4.408 785 H ARG 97 H ARG 97 -0.352 -10.293 9.431 786 HA ARG 97 HA ARG 97 -2.257 -12.339 9.903 787 HB2 ARG 97 2HB ARG 97 -0.458 -10.709 11.673 788 HB3 ARG 97 3HB ARG 97 -1.638 -11.814 12.365 789 HG2 ARG 97 2HG ARG 97 -0.364 -13.344 10.455 790 HG3 ARG 97 3HG ARG 97 0.931 -12.363 11.144 791 HD2 ARG 97 2HD ARG 97 -1.039 -13.954 12.778 792 HD3 ARG 97 3HD ARG 97 0.551 -14.547 12.299 793 HE ARG 97 HE ARG 97 0.873 -12.078 13.577 794 HH11 ARG 97 1HH1 ARG 97 -0.107 -15.338 14.307 795 HH12 ARG 97 2HH1 ARG 97 0.419 -15.265 15.956 796 HH21 ARG 97 1HH2 ARG 97 1.569 -11.970 15.746 797 HH22 ARG 97 2HH2 ARG 97 1.371 -13.349 16.774 798 H ARG 98 H ARG 98 -2.066 -9.020 11.205 799 HA ARG 98 HA ARG 98 -4.617 -9.054 12.392 800 HB2 ARG 98 2HB ARG 98 -4.377 -6.578 12.457 801 HB3 ARG 98 3HB ARG 98 -2.977 -7.434 13.091 802 HG2 ARG 98 2HG ARG 98 -1.847 -5.984 11.804 803 HG3 ARG 98 3HG ARG 98 -2.223 -7.141 10.526 804 HD2 ARG 98 2HD ARG 98 -2.964 -5.237 9.521 805 HD3 ARG 98 3HD ARG 98 -4.435 -5.693 10.378 806 HE ARG 98 HE ARG 98 -2.856 -4.037 12.021 807 HH11 ARG 98 1HH1 ARG 98 -4.850 -3.914 9.170 808 HH12 ARG 98 2HH1 ARG 98 -5.300 -2.257 9.397 809 HH21 ARG 98 1HH2 ARG 98 -3.441 -1.854 12.331 810 HH22 ARG 98 2HH2 ARG 98 -4.498 -1.086 11.196 811 H TYR 99 H TYR 99 -3.580 -8.524 9.137 812 HA TYR 99 HA TYR 99 -6.037 -7.247 8.308 813 HB2 TYR 99 2HB TYR 99 -4.002 -6.614 7.170 814 HB3 TYR 99 3HB TYR 99 -3.670 -8.288 6.741 815 HD1 TYR 99 HD1 TYR 99 -6.251 -5.635 6.259 816 HD2 TYR 99 HD2 TYR 99 -4.319 -9.071 4.657 817 HE1 TYR 99 HE1 TYR 99 -7.471 -5.329 4.146 818 HE2 TYR 99 HE2 TYR 99 -5.533 -8.774 2.539 819 HH TYR 99 HH TYR 99 -6.629 -6.734 1.316 820 H LYS 100 H LYS 100 -4.672 -10.453 8.377 821 HA LYS 100 HA LYS 100 -6.703 -11.575 6.650 822 HB2 LYS 100 2HB LYS 100 -4.353 -12.660 8.155 823 HB3 LYS 100 3HB LYS 100 -5.596 -13.765 7.583 824 HG2 LYS 100 2HG LYS 100 -5.077 -13.432 5.381 825 HG3 LYS 100 3HG LYS 100 -4.440 -11.810 5.663 826 HD2 LYS 100 2HD LYS 100 -2.458 -12.870 5.373 827 HD3 LYS 100 3HD LYS 100 -2.668 -13.230 7.088 828 HE2 LYS 100 2HE LYS 100 -3.201 -15.423 6.701 829 HE3 LYS 100 3HE LYS 100 -3.862 -15.094 5.101 830 HZ1 LYS 100 3HZ LYS 100 -1.256 -15.936 5.807 831 HZ2 LYS 100 1HZ LYS 100 -1.173 -14.465 4.975 832 HZ3 LYS 100 2HZ LYS 100 -1.947 -15.792 4.270 833 H GLU 101 H GLU 101 -6.372 -10.836 9.958 834 HA GLU 101 HA GLU 101 -7.779 -12.814 11.264 835 HB2 GLU 101 2HB GLU 101 -8.126 -11.286 13.006 836 HB3 GLU 101 3HB GLU 101 -6.666 -10.707 12.217 837 HG2 GLU 101 2HG GLU 101 -8.166 -9.135 10.913 838 HG3 GLU 101 3HG GLU 101 -9.439 -9.577 12.049 839 H SER 102 H SER 102 -10.033 -12.652 12.151 840 HA SER 102 HA SER 102 -11.874 -12.466 9.959 841 HB2 SER 102 2HB SER 102 -13.542 -12.996 11.914 842 HB3 SER 102 3HB SER 102 -12.411 -14.234 11.368 843 HG SER 102 HG SER 102 -11.584 -12.499 13.394 844 H SER 103 H SER 103 -12.012 -10.317 9.356 845 HA SER 103 HA SER 103 -13.685 -8.671 11.073 846 HB2 SER 103 2HB SER 103 -11.044 -7.651 9.996 847 HB3 SER 103 3HB SER 103 -12.237 -6.701 10.882 848 HG SER 103 HG SER 103 -10.548 -7.458 12.235 849 H ILE 104 H ILE 104 -13.751 -6.355 9.704 850 HA ILE 104 HA ILE 104 -15.322 -6.981 7.448 851 HB ILE 104 HB ILE 104 -14.079 -4.298 8.044 852 HG12 ILE 104 2HG1 ILE 104 -15.179 -5.082 10.059 853 HG13 ILE 104 3HG1 ILE 104 -16.167 -3.831 9.311 854 HG21 ILE 104 1HG2 ILE 104 -16.069 -5.292 6.150 855 HG22 ILE 104 2HG2 ILE 104 -16.597 -3.882 7.066 856 HG23 ILE 104 3HG2 ILE 104 -15.112 -3.812 6.118 857 HD11 ILE 104 3HD1 ILE 104 -17.118 -6.188 8.219 858 HD12 ILE 104 1HD1 ILE 104 -16.804 -6.581 9.908 859 HD13 ILE 104 2HD1 ILE 104 -17.868 -5.235 9.499 860 H GLN 105 H GLN 105 -14.903 -6.990 5.295 861 HA GLN 105 HA GLN 105 -12.691 -5.834 4.029 862 HB2 GLN 105 2HB GLN 105 -11.433 -7.938 3.472 863 HB3 GLN 105 3HB GLN 105 -11.287 -7.409 5.142 864 HG2 GLN 105 2HG GLN 105 -12.998 -9.057 5.787 865 HG3 GLN 105 3HG GLN 105 -13.058 -9.615 4.116 866 HE21 GLN 105 1HE2 GLN 105 -12.515 -11.432 5.993 867 HE22 GLN 105 2HE2 GLN 105 -10.851 -11.895 5.951 868 H ILE 106 H ILE 106 -12.354 -6.839 1.771 869 HA ILE 106 HA ILE 106 -14.768 -8.154 0.775 870 HB ILE 106 HB ILE 106 -15.287 -6.567 -0.850 871 HG12 ILE 106 2HG1 ILE 106 -13.057 -6.168 -1.723 872 HG13 ILE 106 3HG1 ILE 106 -13.832 -4.624 -1.381 873 HG21 ILE 106 1HG2 ILE 106 -14.415 -4.984 1.565 874 HG22 ILE 106 2HG2 ILE 106 -15.569 -4.449 0.344 875 HG23 ILE 106 3HG2 ILE 106 -15.951 -5.828 1.374 876 HD11 ILE 106 3HD1 ILE 106 -11.657 -5.996 0.161 877 HD12 ILE 106 1HD1 ILE 106 -11.622 -4.419 -0.628 878 HD13 ILE 106 2HD1 ILE 106 -12.593 -4.657 0.825 879 H GLY 107 H GLY 107 -14.478 -8.546 -1.702 880 HA2 GLY 107 2HA GLY 107 -12.903 -8.957 -3.487 881 HA3 GLY 107 3HA GLY 107 -11.659 -9.194 -2.269 882 H ASN 108 H ASN 108 -14.510 -10.604 -3.766 883 HA ASN 108 HA ASN 108 -14.325 -13.093 -2.380 884 HB2 ASN 108 2HB ASN 108 -15.743 -12.431 -4.971 885 HB3 ASN 108 3HB ASN 108 -15.995 -13.879 -4.000 886 HD21 ASN 108 1HD2 ASN 108 -16.328 -13.175 -1.546 887 HD22 ASN 108 2HD2 ASN 108 -17.588 -12.011 -1.337 888 H GLY 109 H GLY 109 -12.961 -14.712 -2.739 889 HA2 GLY 109 2HA GLY 109 -12.265 -15.862 -5.126 890 HA3 GLY 109 3HA GLY 109 -11.071 -14.594 -4.893 891 H HIS 110 H HIS 110 -12.138 -17.723 -3.940 892 HA HIS 110 HA HIS 110 -9.791 -17.953 -2.174 893 HB2 HIS 110 2HB HIS 110 -12.175 -18.003 -1.100 894 HB3 HIS 110 3HB HIS 110 -12.236 -19.639 -1.750 895 HD1 HIS 110 HD1 HIS 110 -10.925 -21.430 -0.532 896 HD2 HIS 110 HD2 HIS 110 -10.197 -17.608 0.923 897 HE1 HIS 110 HE1 HIS 110 -9.609 -21.757 1.586 898 H GLY 111 H GLY 111 -8.971 -20.196 -1.967 899 HA2 GLY 111 2HA GLY 111 -9.729 -22.158 -3.911 900 HA3 GLY 111 3HA GLY 111 -8.258 -21.312 -4.371 901 H GLN 112 H GLN 112 -7.822 -23.839 -4.128 902 HA GLN 112 HA GLN 112 -6.244 -24.067 -1.705 903 HB2 GLN 112 2HB GLN 112 -7.147 -26.268 -1.108 904 HB3 GLN 112 3HB GLN 112 -8.382 -25.020 -1.011 905 HG2 GLN 112 2HG GLN 112 -9.159 -25.725 -3.276 906 HG3 GLN 112 3HG GLN 112 -8.033 -27.078 -3.174 907 HE21 GLN 112 1HE2 GLN 112 -9.650 -28.614 -3.246 908 HE22 GLN 112 2HE2 GLN 112 -10.728 -28.894 -1.925 909 H SER 113 H SER 113 -4.866 -26.066 -1.759 910 HA SER 113 HA SER 113 -4.466 -27.287 -4.349 911 HB2 SER 113 2HB SER 113 -1.961 -26.571 -4.228 912 HB3 SER 113 3HB SER 113 -3.145 -25.437 -4.878 913 HG SER 113 HG SER 113 -1.499 -24.918 -2.994 914 H GLN 114 H GLN 114 -3.309 -29.193 -4.250 915 HA GLN 114 HA GLN 114 -3.195 -30.474 -1.722 916 HB2 GLN 114 2HB GLN 114 -2.269 -31.254 -4.478 917 HB3 GLN 114 3HB GLN 114 -1.992 -32.289 -3.083 918 HG2 GLN 114 2HG GLN 114 -3.944 -33.177 -3.806 919 HG3 GLN 114 3HG GLN 114 -4.588 -31.920 -2.750 920 HE21 GLN 114 1HE2 GLN 114 -3.878 -32.767 -6.078 921 HE22 GLN 114 2HE2 GLN 114 -5.003 -31.670 -6.796 922 H GLY 115 H GLY 115 -1.504 -30.929 -0.388 923 HA2 GLY 115 2HA GLY 115 1.145 -29.903 -1.193 924 HA3 GLY 115 3HA GLY 115 0.470 -29.547 0.390 925 H LEU 116 H LEU 116 1.931 -31.974 -1.634 926 HA LEU 116 HA LEU 116 2.352 -33.632 0.762 927 HB2 LEU 116 2HB LEU 116 2.383 -35.589 -0.872 928 HB3 LEU 116 3HB LEU 116 0.818 -34.894 -0.452 929 HG LEU 116 HG LEU 116 1.737 -33.576 -2.787 930 HD11 LEU 116 1HD1 LEU 116 3.115 -35.173 -3.615 931 HD12 LEU 116 2HD1 LEU 116 1.583 -35.857 -4.154 932 HD13 LEU 116 3HD1 LEU 116 2.355 -36.470 -2.692 933 HD21 LEU 116 3HD2 LEU 116 -0.367 -34.018 -3.504 934 HD22 LEU 116 1HD2 LEU 116 -0.604 -34.393 -1.797 935 HD23 LEU 116 2HD2 LEU 116 -0.324 -35.694 -2.954 936 H GLU 117 H GLU 117 3.549 -32.624 -2.401 937 HA GLU 117 HA GLU 117 6.097 -33.898 -2.091 938 HB2 GLU 117 2HB GLU 117 4.802 -32.134 -4.088 939 HB3 GLU 117 3HB GLU 117 6.557 -32.070 -4.017 940 HG2 GLU 117 2HG GLU 117 6.699 -34.446 -4.416 941 HG3 GLU 117 3HG GLU 117 4.943 -34.583 -4.378 942 H1 GLY -9 H GLY -9 7.656 -12.578 12.794 943 HA2 GLY -9 2HA GLY -9 10.076 -12.356 12.504 944 HA3 GLY -9 3HA GLY -9 10.253 -12.914 14.161 945 H LYS -8 H LYS -8 8.924 -13.962 11.030 946 HA LYS -8 HA LYS -8 9.433 -16.744 11.764 947 HB2 LYS -8 2HB LYS -8 8.053 -15.569 9.343 948 HB3 LYS -8 3HB LYS -8 8.190 -17.286 9.700 949 HG2 LYS -8 2HG LYS -8 6.700 -17.170 11.470 950 HG3 LYS -8 3HG LYS -8 6.915 -15.429 11.666 951 HD2 LYS -8 2HD LYS -8 4.742 -15.929 10.683 952 HD3 LYS -8 3HD LYS -8 5.759 -15.051 9.538 953 HE2 LYS -8 2HE LYS -8 6.020 -16.870 8.167 954 HE3 LYS -8 3HE LYS -8 5.796 -18.026 9.479 955 HZ1 LYS -8 3HZ LYS -8 3.408 -16.663 9.250 956 HZ2 LYS -8 1HZ LYS -8 3.721 -18.258 8.781 957 HZ3 LYS -8 2HZ LYS -8 3.881 -17.001 7.661 958 H PHE -7 H PHE -7 10.402 -14.314 9.400 959 HA PHE -7 HA PHE -7 12.249 -16.158 8.121 960 HB2 PHE -7 2HB PHE -7 11.586 -13.256 7.598 961 HB3 PHE -7 3HB PHE -7 12.784 -14.163 6.682 962 HD1 PHE -7 HD1 PHE -7 9.218 -13.731 7.373 963 HD2 PHE -7 HD2 PHE -7 12.124 -15.849 5.096 964 HE1 PHE -7 HE1 PHE -7 7.445 -14.545 5.872 965 HE2 PHE -7 HE2 PHE -7 10.357 -16.665 3.592 966 HZ PHE -7 HZ PHE -7 8.014 -16.013 3.978 967 H ILE -6 H ILE -6 12.781 -12.789 9.107 968 HA ILE -6 HA ILE -6 14.606 -11.763 10.015 969 HB ILE -6 HB ILE -6 14.800 -14.229 11.740 970 HG12 ILE -6 2HG1 ILE -6 12.483 -13.486 11.726 971 HG13 ILE -6 3HG1 ILE -6 13.227 -13.071 13.266 972 HG21 ILE -6 1HG2 ILE -6 16.249 -13.084 12.985 973 HG22 ILE -6 2HG2 ILE -6 16.338 -11.930 11.655 974 HG23 ILE -6 3HG2 ILE -6 15.222 -11.651 12.992 975 HD11 ILE -6 3HD1 ILE -6 12.277 -11.080 12.904 976 HD12 ILE -6 1HD1 ILE -6 13.673 -10.807 11.861 977 HD13 ILE -6 2HD1 ILE -6 12.143 -11.344 11.165 978 HA PRO -5 HA PRO -5 17.610 -14.234 7.511 979 HB2 PRO -5 2HB PRO -5 18.468 -12.116 6.047 980 HB3 PRO -5 3HB PRO -5 17.047 -13.072 5.611 981 HG2 PRO -5 2HG PRO -5 17.197 -10.436 7.021 982 HG3 PRO -5 3HG PRO -5 16.089 -10.957 5.738 983 HD2 PRO -5 2HD PRO -5 15.372 -10.904 8.348 984 HD3 PRO -5 3HD PRO -5 14.726 -12.098 7.204 985 H SER -4 H SER -4 18.823 -14.462 9.478 986 HA SER -4 HA SER -4 20.432 -12.284 10.443 987 HB2 SER -4 2HB SER -4 21.435 -14.054 11.919 988 HB3 SER -4 3HB SER -4 19.682 -13.914 12.049 989 HG SER -4 HG SER -4 20.395 -16.096 11.869 990 H ARG -3 H ARG -3 20.667 -14.181 7.772 991 HA ARG -3 HA ARG -3 23.245 -15.119 7.607 992 HB2 ARG -3 2HB ARG -3 21.356 -13.983 5.582 993 HB3 ARG -3 3HB ARG -3 23.002 -14.370 5.101 994 HG2 ARG -3 2HG ARG -3 21.157 -16.340 6.424 995 HG3 ARG -3 3HG ARG -3 21.310 -16.161 4.675 996 HD2 ARG -3 2HD ARG -3 23.728 -16.611 6.383 997 HD3 ARG -3 3HD ARG -3 22.713 -17.966 5.892 998 HE ARG -3 HE ARG -3 24.573 -16.547 4.268 999 HH11 ARG -3 1HH1 ARG -3 21.539 -18.251 4.201 1000 HH12 ARG -3 2HH1 ARG -3 21.679 -18.701 2.534 1001 HH21 ARG -3 1HH2 ARG -3 24.769 -17.133 2.072 1002 HH22 ARG -3 2HH2 ARG -3 23.517 -18.065 1.324 1003 HA PRO -2 HA PRO -2 26.030 -11.731 7.575 1004 HB2 PRO -2 2HB PRO -2 27.825 -12.463 5.674 1005 HB3 PRO -2 3HB PRO -2 27.726 -13.248 7.255 1006 HG2 PRO -2 2HG PRO -2 26.609 -14.138 4.623 1007 HG3 PRO -2 3HG PRO -2 27.439 -15.092 5.867 1008 HD2 PRO -2 2HD PRO -2 24.745 -15.081 5.595 1009 HD3 PRO -2 3HD PRO -2 25.545 -15.276 7.168 1010 H ALA -1 H ALA -1 24.383 -12.572 4.650 1011 HA ALA -1 HA ALA -1 23.655 -11.335 2.882 1012 HB1 ALA -1 1HB ALA -1 23.131 -9.736 4.805 1013 HB2 ALA -1 2HB ALA -1 24.573 -8.854 4.299 1014 HB3 ALA -1 3HB ALA -1 23.224 -9.055 3.181 1015 HA PRO 0 HA PRO 0 27.948 -11.125 1.246 1016 HB2 PRO 0 2HB PRO 0 27.383 -12.537 -1.003 1017 HB3 PRO 0 3HB PRO 0 27.786 -13.305 0.538 1018 HG2 PRO 0 2HG PRO 0 25.101 -12.841 -0.701 1019 HG3 PRO 0 3HG PRO 0 25.717 -14.282 0.128 1020 HD2 PRO 0 2HD PRO 0 24.085 -12.491 1.337 1021 HD3 PRO 0 3HD PRO 0 25.330 -13.398 2.221 1022 H LYS 1 H LYS 1 28.760 -10.093 -0.668 1023 HA LYS 1 HA LYS 1 26.866 -8.148 -1.767 1024 HB2 LYS 1 2HB LYS 1 29.822 -8.199 -1.359 1025 HB3 LYS 1 3HB LYS 1 29.176 -7.205 -2.658 1026 HG2 LYS 1 2HG LYS 1 29.281 -5.720 -0.901 1027 HG3 LYS 1 3HG LYS 1 27.604 -6.266 -0.829 1028 HD2 LYS 1 2HD LYS 1 28.331 -6.361 1.392 1029 HD3 LYS 1 3HD LYS 1 28.455 -8.030 0.829 1030 HE2 LYS 1 2HE LYS 1 30.461 -7.641 1.974 1031 HE3 LYS 1 3HE LYS 1 30.884 -7.477 0.271 1032 HZ1 LYS 1 3HZ LYS 1 31.183 -5.240 0.464 1033 HZ2 LYS 1 1HZ LYS 1 31.633 -5.708 2.027 1034 HZ3 LYS 1 2HZ LYS 1 30.091 -5.073 1.746 1035 HA PRO 2 HA PRO 2 26.871 -9.805 -5.829 1036 HB2 PRO 2 2HB PRO 2 26.970 -7.574 -7.374 1037 HB3 PRO 2 3HB PRO 2 25.536 -8.041 -6.451 1038 HG2 PRO 2 2HG PRO 2 27.652 -6.033 -5.777 1039 HG3 PRO 2 3HG PRO 2 25.892 -5.908 -5.595 1040 HD2 PRO 2 2HD PRO 2 27.533 -6.484 -3.520 1041 HD3 PRO 2 3HD PRO 2 25.881 -7.124 -3.637 1042 HA PRO 3 HA PRO 3 30.899 -10.194 -7.549 1043 HB2 PRO 3 2HB PRO 3 30.395 -10.404 -10.208 1044 HB3 PRO 3 3HB PRO 3 30.017 -11.689 -9.054 1045 HG2 PRO 3 2HG PRO 3 28.210 -9.622 -10.247 1046 HG3 PRO 3 3HG PRO 3 27.914 -11.351 -9.988 1047 HD2 PRO 3 2HD PRO 3 26.946 -9.443 -8.328 1048 HD3 PRO 3 3HD PRO 3 27.410 -11.059 -7.758 1049 H SER 4 H SER 4 32.260 -9.345 -9.540 1050 HA SER 4 HA SER 4 31.714 -6.758 -10.546 1051 HB2 SER 4 2HB SER 4 32.096 -5.943 -8.326 1052 HB3 SER 4 3HB SER 4 33.544 -6.933 -8.147 1053 HG SER 4 HG SER 4 34.155 -4.833 -8.633 1054 H SER 5 H SER 5 32.973 -6.382 -12.274 1055 HA SER 5 HA SER 5 35.448 -7.958 -12.544 1056 HB2 SER 5 2HB SER 5 33.224 -7.531 -14.524 1057 HB3 SER 5 3HB SER 5 34.859 -7.907 -15.069 1058 HG SER 5 HG SER 5 33.054 -9.615 -14.327 1059 H ALA 6 H ALA 6 37.219 -6.892 -13.229 1060 HA ALA 6 HA ALA 6 36.930 -4.016 -13.732 1061 HB1 ALA 6 1HB ALA 6 39.436 -5.550 -13.060 1062 HB2 ALA 6 2HB ALA 6 39.236 -3.798 -13.093 1063 HB3 ALA 6 3HB ALA 6 38.398 -4.758 -11.874 Start of MODEL 13 1 H1 MET -2 H MET -2 0.619 -4.429 -3.248 2 HA MET -2 HA MET -2 1.377 -1.852 -4.457 3 HB2 MET -2 2HB MET -2 3.709 -2.454 -3.696 4 HB3 MET -2 3HB MET -2 2.563 -2.096 -2.412 5 HG2 MET -2 2HG MET -2 2.540 -4.230 -1.640 6 HG3 MET -2 3HG MET -2 2.857 -4.926 -3.228 7 HE1 MET -2 3HE MET -2 4.931 -6.618 -1.508 8 HE2 MET -2 1HE MET -2 4.434 -6.396 -3.186 9 HE3 MET -2 2HE MET -2 6.133 -6.234 -2.741 10 H ALA -1 H ALA -1 3.019 -1.914 -6.126 11 HA ALA -1 HA ALA -1 2.474 -3.645 -8.205 12 HB1 ALA -1 1HB ALA -1 3.606 -1.887 -9.039 13 HB2 ALA -1 2HB ALA -1 4.607 -1.710 -7.597 14 HB3 ALA -1 3HB ALA -1 5.007 -2.932 -8.805 15 HA PRO 1 HA PRO 1 4.590 -7.424 -7.500 16 HB2 PRO 1 2HB PRO 1 5.570 -8.018 -9.961 17 HB3 PRO 1 3HB PRO 1 3.850 -8.115 -9.563 18 HG2 PRO 1 2HG PRO 1 5.348 -5.940 -10.974 19 HG3 PRO 1 3HG PRO 1 3.767 -6.644 -11.362 20 HD2 PRO 1 2HD PRO 1 4.032 -4.279 -10.069 21 HD3 PRO 1 3HD PRO 1 2.675 -5.385 -9.769 22 H LEU 2 H LEU 2 6.464 -7.854 -6.530 23 HA LEU 2 HA LEU 2 8.872 -6.414 -7.424 24 HB2 LEU 2 2HB LEU 2 7.792 -6.233 -5.004 25 HB3 LEU 2 3HB LEU 2 8.747 -7.691 -4.746 26 HG LEU 2 HG LEU 2 10.079 -5.923 -3.968 27 HD11 LEU 2 1HD1 LEU 2 11.034 -7.571 -5.779 28 HD12 LEU 2 2HD1 LEU 2 12.005 -6.236 -5.160 29 HD13 LEU 2 3HD1 LEU 2 11.197 -6.089 -6.721 30 HD21 LEU 2 3HD2 LEU 2 8.779 -4.098 -4.973 31 HD22 LEU 2 1HD2 LEU 2 9.507 -4.455 -6.540 32 HD23 LEU 2 2HD2 LEU 2 10.514 -3.884 -5.210 33 H PHE 3 H PHE 3 10.459 -7.574 -8.284 34 HA PHE 3 HA PHE 3 10.803 -10.368 -7.487 35 HB2 PHE 3 2HB PHE 3 10.444 -9.395 -10.322 36 HB3 PHE 3 3HB PHE 3 11.171 -10.950 -9.931 37 HD1 PHE 3 HD1 PHE 3 8.079 -8.950 -9.681 38 HD2 PHE 3 HD2 PHE 3 9.843 -12.810 -9.353 39 HE1 PHE 3 HE1 PHE 3 5.839 -9.960 -9.566 40 HE2 PHE 3 HE2 PHE 3 7.605 -13.826 -9.239 41 HZ PHE 3 HZ PHE 3 5.600 -12.401 -9.346 42 H ALA 4 H ALA 4 12.896 -11.056 -7.455 43 HA ALA 4 HA ALA 4 14.945 -9.188 -8.450 44 HB1 ALA 4 1HB ALA 4 14.539 -10.225 -5.729 45 HB2 ALA 4 2HB ALA 4 16.198 -10.289 -6.323 46 HB3 ALA 4 3HB ALA 4 15.336 -8.751 -6.278 47 H VAL 5 H VAL 5 17.052 -10.183 -8.838 48 HA VAL 5 HA VAL 5 16.878 -13.072 -9.390 49 HB VAL 5 HB VAL 5 16.640 -11.939 -11.509 50 HG11 VAL 5 1HG1 VAL 5 19.280 -10.580 -11.013 51 HG12 VAL 5 2HG1 VAL 5 18.155 -10.316 -12.347 52 HG13 VAL 5 3HG1 VAL 5 17.723 -9.808 -10.714 53 HG21 VAL 5 3HG2 VAL 5 17.918 -13.493 -12.455 54 HG22 VAL 5 1HG2 VAL 5 19.382 -12.611 -12.020 55 HG23 VAL 5 2HG2 VAL 5 18.680 -13.767 -10.888 56 H THR 6 H THR 6 18.394 -14.173 -8.356 57 HA THR 6 HA THR 6 20.469 -12.977 -6.882 58 HB THR 6 HB THR 6 21.326 -15.563 -7.181 59 HG1 THR 6 HG1 THR 6 19.728 -16.483 -8.270 60 HG21 THR 6 3HG2 THR 6 20.005 -13.971 -5.228 61 HG22 THR 6 1HG2 THR 6 21.006 -15.402 -4.983 62 HG23 THR 6 2HG2 THR 6 19.267 -15.573 -5.222 63 H LEU 7 H LEU 7 22.461 -12.356 -7.420 64 HA LEU 7 HA LEU 7 23.417 -12.966 -10.126 65 HB2 LEU 7 2HB LEU 7 24.323 -10.857 -8.172 66 HB3 LEU 7 3HB LEU 7 24.941 -11.073 -9.808 67 HG LEU 7 HG LEU 7 22.054 -10.440 -9.246 68 HD11 LEU 7 1HD1 LEU 7 22.984 -8.099 -10.100 69 HD12 LEU 7 2HD1 LEU 7 24.424 -8.665 -9.255 70 HD13 LEU 7 3HD1 LEU 7 22.896 -8.517 -8.388 71 HD21 LEU 7 3HD2 LEU 7 23.808 -10.168 -11.685 72 HD22 LEU 7 1HD2 LEU 7 22.134 -9.627 -11.570 73 HD23 LEU 7 2HD2 LEU 7 22.515 -11.344 -11.443 74 H TYR 8 H TYR 8 23.946 -13.747 -6.868 75 HA TYR 8 HA TYR 8 26.421 -15.141 -7.595 76 HB2 TYR 8 2HB TYR 8 26.101 -13.689 -4.967 77 HB3 TYR 8 3HB TYR 8 27.549 -14.468 -5.594 78 HD1 TYR 8 HD2 TYR 8 25.291 -11.574 -6.005 79 HD2 TYR 8 HD1 TYR 8 29.019 -13.324 -7.075 80 HE1 TYR 8 HE2 TYR 8 26.003 -9.438 -6.995 81 HE2 TYR 8 HE1 TYR 8 29.741 -11.192 -8.067 82 HH TYR 8 HH TYR 8 27.574 -8.383 -8.165 83 H GLU 9 H GLU 9 26.934 -16.944 -6.189 84 HA GLU 9 HA GLU 9 24.556 -18.368 -5.406 85 HB2 GLU 9 2HB GLU 9 26.264 -19.615 -6.539 86 HB3 GLU 9 3HB GLU 9 27.482 -19.106 -5.378 87 HG2 GLU 9 2HG GLU 9 26.879 -20.651 -3.858 88 HG3 GLU 9 3HG GLU 9 25.167 -20.540 -4.261 89 H PHE 10 H PHE 10 23.643 -17.771 -3.537 90 HA PHE 10 HA PHE 10 25.319 -17.113 -1.241 91 HB2 PHE 10 2HB PHE 10 23.380 -15.662 -1.857 92 HB3 PHE 10 3HB PHE 10 22.307 -17.007 -1.481 93 HD1 PHE 10 HD2 PHE 10 24.808 -14.703 -0.024 94 HD2 PHE 10 HD1 PHE 10 21.630 -17.434 0.720 95 HE1 PHE 10 HE2 PHE 10 24.757 -13.996 2.332 96 HE2 PHE 10 HE1 PHE 10 21.574 -16.732 3.077 97 HZ PHE 10 HZ PHE 10 23.139 -15.011 3.886 98 H LYS 11 H LYS 11 26.078 -18.939 -0.321 99 HA LYS 11 HA LYS 11 24.457 -21.300 -0.042 100 HB2 LYS 11 2HB LYS 11 27.133 -20.696 1.224 101 HB3 LYS 11 3HB LYS 11 26.391 -22.279 1.035 102 HG2 LYS 11 2HG LYS 11 27.719 -22.407 -0.765 103 HG3 LYS 11 3HG LYS 11 26.445 -21.457 -1.534 104 HD2 LYS 11 2HD LYS 11 27.668 -19.511 -1.463 105 HD3 LYS 11 3HD LYS 11 28.616 -20.033 -0.068 106 HE2 LYS 11 2HE LYS 11 28.921 -21.557 -2.597 107 HE3 LYS 11 3HE LYS 11 29.627 -19.943 -2.526 108 HZ1 LYS 11 3HZ LYS 11 30.588 -22.345 -1.395 109 HZ2 LYS 11 1HZ LYS 11 30.318 -21.215 -0.165 110 HZ3 LYS 11 2HZ LYS 11 31.335 -20.829 -1.459 111 H ALA 12 H ALA 12 23.052 -21.667 1.533 112 HA ALA 12 HA ALA 12 22.699 -19.885 3.713 113 HB1 ALA 12 1HB ALA 12 21.214 -21.975 4.469 114 HB2 ALA 12 2HB ALA 12 20.701 -20.834 3.226 115 HB3 ALA 12 3HB ALA 12 21.420 -22.377 2.764 116 H GLU 13 H GLU 13 23.059 -20.188 5.914 117 HA GLU 13 HA GLU 13 25.001 -22.305 6.573 118 HB2 GLU 13 2HB GLU 13 25.765 -20.709 8.385 119 HB3 GLU 13 3HB GLU 13 26.138 -20.232 6.735 120 HG2 GLU 13 2HG GLU 13 24.124 -18.769 6.774 121 HG3 GLU 13 3HG GLU 13 23.942 -19.157 8.484 122 H ARG 14 H ARG 14 22.048 -20.709 7.439 123 HA ARG 14 HA ARG 14 21.731 -22.588 9.686 124 HB2 ARG 14 2HB ARG 14 20.788 -19.725 9.483 125 HB3 ARG 14 3HB ARG 14 20.253 -20.844 10.730 126 HG2 ARG 14 2HG ARG 14 23.145 -20.166 10.281 127 HG3 ARG 14 3HG ARG 14 22.098 -19.259 11.374 128 HD2 ARG 14 2HD ARG 14 21.579 -21.687 12.295 129 HD3 ARG 14 3HD ARG 14 23.170 -22.021 11.612 130 HE ARG 14 HE ARG 14 23.362 -19.703 13.155 131 HH11 ARG 14 1HH1 ARG 14 22.750 -23.104 13.574 132 HH12 ARG 14 2HH1 ARG 14 23.407 -23.158 15.176 133 HH21 ARG 14 1HH2 ARG 14 24.229 -19.761 15.264 134 HH22 ARG 14 2HH2 ARG 14 24.247 -21.255 16.137 135 H ASP 15 H ASP 15 19.230 -22.590 10.292 136 HA ASP 15 HA ASP 15 17.917 -23.795 8.081 137 HB2 ASP 15 2HB ASP 15 17.453 -24.604 10.299 138 HB3 ASP 15 3HB ASP 15 16.923 -23.009 10.825 139 H ASP 16 H ASP 16 17.944 -20.592 9.404 140 HA ASP 16 HA ASP 16 15.519 -19.731 8.128 141 HB2 ASP 16 2HB ASP 16 16.403 -17.426 8.759 142 HB3 ASP 16 3HB ASP 16 16.110 -18.541 10.090 143 H GLU 17 H GLU 17 18.921 -19.780 7.334 144 HA GLU 17 HA GLU 17 18.725 -17.990 5.112 145 HB2 GLU 17 2HB GLU 17 20.847 -20.002 5.875 146 HB3 GLU 17 3HB GLU 17 20.998 -18.859 4.548 147 HG2 GLU 17 2HG GLU 17 20.374 -17.827 7.267 148 HG3 GLU 17 3HG GLU 17 22.019 -18.347 6.903 149 H LEU 18 H LEU 18 18.770 -18.486 2.904 150 HA LEU 18 HA LEU 18 17.974 -21.242 2.229 151 HB2 LEU 18 2HB LEU 18 16.183 -19.416 2.120 152 HB3 LEU 18 3HB LEU 18 17.065 -18.811 0.719 153 HG LEU 18 HG LEU 18 16.751 -21.293 -0.122 154 HD11 LEU 18 1HD1 LEU 18 15.547 -22.533 1.283 155 HD12 LEU 18 2HD1 LEU 18 14.159 -21.580 0.762 156 HD13 LEU 18 3HD1 LEU 18 15.040 -21.128 2.221 157 HD21 LEU 18 3HD2 LEU 18 14.902 -18.955 -0.214 158 HD22 LEU 18 1HD2 LEU 18 14.410 -20.475 -0.963 159 HD23 LEU 18 2HD2 LEU 18 15.886 -19.667 -1.494 160 H ASP 19 H ASP 19 19.021 -22.211 0.585 161 HA ASP 19 HA ASP 19 21.344 -20.898 -0.505 162 HB2 ASP 19 2HB ASP 19 21.955 -23.027 -1.374 163 HB3 ASP 19 3HB ASP 19 21.247 -23.329 0.210 164 H VAL 20 H VAL 20 21.585 -20.033 -2.476 165 HA VAL 20 HA VAL 20 19.662 -20.634 -4.585 166 HB VAL 20 HB VAL 20 18.683 -18.702 -3.438 167 HG11 VAL 20 1HG1 VAL 20 19.818 -16.570 -3.340 168 HG12 VAL 20 2HG1 VAL 20 20.790 -17.796 -2.523 169 HG13 VAL 20 3HG1 VAL 20 21.233 -17.253 -4.142 170 HG21 VAL 20 3HG2 VAL 20 18.125 -17.577 -5.355 171 HG22 VAL 20 1HG2 VAL 20 19.785 -17.547 -5.950 172 HG23 VAL 20 2HG2 VAL 20 18.841 -19.033 -6.048 173 H SER 21 H SER 21 20.425 -20.248 -6.666 174 HA SER 21 HA SER 21 23.312 -19.701 -6.819 175 HB2 SER 21 2HB SER 21 21.499 -21.555 -8.265 176 HB3 SER 21 3HB SER 21 22.790 -20.816 -9.213 177 HG SER 21 HG SER 21 24.277 -21.812 -8.000 178 HA PRO 22 HA PRO 22 22.748 -16.116 -9.282 179 HB2 PRO 22 2HB PRO 22 24.748 -16.339 -11.104 180 HB3 PRO 22 3HB PRO 22 25.037 -15.956 -9.403 181 HG2 PRO 22 2HG PRO 22 25.277 -18.581 -10.821 182 HG3 PRO 22 3HG PRO 22 26.362 -17.854 -9.622 183 HD2 PRO 22 2HD PRO 22 24.567 -19.777 -8.984 184 HD3 PRO 22 3HD PRO 22 25.039 -18.497 -7.848 185 H GLY 23 H GLY 23 21.217 -15.684 -10.736 186 HA2 GLY 23 2HA GLY 23 20.555 -15.666 -13.069 187 HA3 GLY 23 3HA GLY 23 21.097 -17.334 -13.178 188 H GLU 24 H GLU 24 19.581 -17.038 -10.272 189 HA GLU 24 HA GLU 24 17.168 -18.290 -11.326 190 HB2 GLU 24 2HB GLU 24 18.423 -18.109 -8.606 191 HB3 GLU 24 3HB GLU 24 16.738 -18.578 -8.776 192 HG2 GLU 24 2HG GLU 24 18.794 -19.991 -10.395 193 HG3 GLU 24 3HG GLU 24 18.638 -20.373 -8.682 194 H ASN 25 H ASN 25 15.060 -17.711 -10.322 195 HA ASN 25 HA ASN 25 14.879 -14.793 -9.957 196 HB2 ASN 25 2HB ASN 25 12.805 -16.697 -11.071 197 HB3 ASN 25 3HB ASN 25 12.597 -14.959 -10.873 198 HD21 ASN 25 1HD2 ASN 25 12.657 -14.015 -12.771 199 HD22 ASN 25 2HD2 ASN 25 13.765 -14.364 -14.050 200 H LEU 26 H LEU 26 14.279 -14.122 -8.013 201 HA LEU 26 HA LEU 26 12.739 -15.962 -6.303 202 HB2 LEU 26 2HB LEU 26 14.736 -13.852 -5.497 203 HB3 LEU 26 3HB LEU 26 13.779 -14.822 -4.380 204 HG LEU 26 HG LEU 26 15.888 -15.822 -4.368 205 HD11 LEU 26 1HD1 LEU 26 14.351 -17.372 -6.444 206 HD12 LEU 26 2HD1 LEU 26 14.015 -17.407 -4.714 207 HD13 LEU 26 3HD1 LEU 26 15.559 -18.001 -5.324 208 HD21 LEU 26 3HD2 LEU 26 16.149 -16.205 -7.283 209 HD22 LEU 26 1HD2 LEU 26 17.378 -15.863 -6.065 210 HD23 LEU 26 2HD2 LEU 26 16.366 -14.559 -6.687 211 H SER 27 H SER 27 11.146 -15.059 -4.930 212 HA SER 27 HA SER 27 10.014 -12.570 -5.987 213 HB2 SER 27 2HB SER 27 8.872 -15.052 -5.316 214 HB3 SER 27 3HB SER 27 8.308 -13.920 -4.087 215 HG SER 27 HG SER 27 7.398 -14.189 -6.527 216 H ILE 28 H ILE 28 10.527 -10.792 -4.906 217 HA ILE 28 HA ILE 28 11.388 -10.859 -2.166 218 HB ILE 28 HB ILE 28 10.955 -8.614 -4.124 219 HG12 ILE 28 2HG1 ILE 28 13.466 -9.541 -2.721 220 HG13 ILE 28 3HG1 ILE 28 12.962 -10.138 -4.299 221 HG21 ILE 28 1HG2 ILE 28 10.347 -7.673 -2.025 222 HG22 ILE 28 2HG2 ILE 28 11.711 -8.445 -1.215 223 HG23 ILE 28 3HG2 ILE 28 11.993 -7.146 -2.375 224 HD11 ILE 28 3HD1 ILE 28 14.672 -8.336 -4.361 225 HD12 ILE 28 1HD1 ILE 28 13.204 -7.980 -5.270 226 HD13 ILE 28 2HD1 ILE 28 13.466 -7.239 -3.691 227 H CYS 29 H CYS 29 10.348 -10.064 -0.368 228 HA CYS 29 HA CYS 29 7.489 -9.437 -0.707 229 HB2 CYS 29 2HB CYS 29 8.857 -11.361 1.026 230 HB3 CYS 29 3HB CYS 29 7.732 -10.321 1.892 231 HG CYS 29 HG CYS 29 5.821 -11.975 1.424 232 H ALA 30 H ALA 30 10.394 -8.842 1.218 233 HA ALA 30 HA ALA 30 9.622 -6.097 1.612 234 HB1 ALA 30 1HB ALA 30 9.500 -8.069 3.851 235 HB2 ALA 30 2HB ALA 30 9.970 -6.400 4.174 236 HB3 ALA 30 3HB ALA 30 8.399 -6.749 3.454 237 H HIS 31 H HIS 31 11.310 -5.012 3.136 238 HA HIS 31 HA HIS 31 13.952 -6.227 2.671 239 HB2 HIS 31 2HB HIS 31 14.872 -4.114 2.023 240 HB3 HIS 31 3HB HIS 31 13.425 -4.371 1.053 241 HD1 HIS 31 HD1 HIS 31 15.016 -1.700 2.505 242 HD2 HIS 31 HD2 HIS 31 11.117 -3.103 2.814 243 HE1 HIS 31 HE1 HIS 31 13.652 0.268 3.275 244 H TYR 32 H TYR 32 15.650 -4.773 3.954 245 HA TYR 32 HA TYR 32 14.567 -4.103 6.595 246 HB2 TYR 32 2HB TYR 32 15.366 -6.468 6.626 247 HB3 TYR 32 3HB TYR 32 16.973 -5.892 6.195 248 HD1 TYR 32 HD2 TYR 32 14.400 -5.902 8.838 249 HD2 TYR 32 HD1 TYR 32 18.413 -4.913 7.828 250 HE1 TYR 32 HE2 TYR 32 14.910 -5.565 11.220 251 HE2 TYR 32 HE1 TYR 32 18.935 -4.573 10.208 252 HH TYR 32 HH TYR 32 16.481 -4.475 12.631 253 H ASP 33 H ASP 33 15.015 -1.965 6.519 254 HA ASP 33 HA ASP 33 16.199 -0.021 6.481 255 HB2 ASP 33 2HB ASP 33 17.324 -1.219 8.374 256 HB3 ASP 33 3HB ASP 33 18.547 -1.770 7.233 257 H TYR 34 H TYR 34 16.101 -1.728 4.042 258 HA TYR 34 HA TYR 34 16.858 -1.641 1.899 259 HB2 TYR 34 2HB TYR 34 18.568 0.693 2.768 260 HB3 TYR 34 3HB TYR 34 17.995 0.328 1.143 261 HD1 TYR 34 HD2 TYR 34 17.061 1.646 4.437 262 HD2 TYR 34 HD1 TYR 34 15.732 0.856 0.473 263 HE1 TYR 34 HE2 TYR 34 15.087 3.060 4.824 264 HE2 TYR 34 HE1 TYR 34 13.754 2.269 0.849 265 HH TYR 34 HH TYR 34 12.426 3.131 2.672 266 H GLU 35 H GLU 35 18.443 -2.876 4.248 267 HA GLU 35 HA GLU 35 21.053 -3.104 2.922 268 HB2 GLU 35 2HB GLU 35 20.366 -4.172 5.652 269 HB3 GLU 35 3HB GLU 35 21.956 -3.828 4.986 270 HG2 GLU 35 2HG GLU 35 19.862 -1.819 5.778 271 HG3 GLU 35 3HG GLU 35 21.378 -2.157 6.612 272 H TRP 36 H TRP 36 18.549 -5.120 4.447 273 HA TRP 36 HA TRP 36 19.514 -7.387 2.832 274 HB2 TRP 36 2HB TRP 36 18.006 -7.383 5.455 275 HB3 TRP 36 3HB TRP 36 18.388 -8.830 4.526 276 HD1 TRP 36 HD1 TRP 36 20.098 -6.083 6.603 277 HE1 TRP 36 HE1 TRP 36 22.399 -6.952 7.361 278 HE3 TRP 36 HE3 TRP 36 20.205 -10.475 3.990 279 HZ2 TRP 36 HZ2 TRP 36 24.042 -9.202 6.909 280 HZ3 TRP 36 HZ3 TRP 36 22.179 -11.929 4.207 281 HH2 TRP 36 HH2 TRP 36 24.057 -11.304 5.636 282 H PHE 37 H PHE 37 17.792 -8.959 2.199 283 HA PHE 37 HA PHE 37 15.175 -7.706 1.784 284 HB2 PHE 37 2HB PHE 37 17.141 -8.436 -0.292 285 HB3 PHE 37 3HB PHE 37 15.496 -8.985 -0.595 286 HD1 PHE 37 HD2 PHE 37 17.251 -5.901 0.566 287 HD2 PHE 37 HD1 PHE 37 14.143 -7.590 -1.801 288 HE1 PHE 37 HE2 PHE 37 16.657 -3.657 -0.250 289 HE2 PHE 37 HE1 PHE 37 13.545 -5.348 -2.622 290 HZ PHE 37 HZ PHE 37 14.802 -3.378 -1.845 291 H ILE 38 H ILE 38 13.476 -9.212 1.271 292 HA ILE 38 HA ILE 38 14.083 -11.945 2.192 293 HB ILE 38 HB ILE 38 11.361 -10.673 2.325 294 HG12 ILE 38 2HG1 ILE 38 12.823 -9.225 3.606 295 HG13 ILE 38 3HG1 ILE 38 11.851 -10.186 4.714 296 HG21 ILE 38 1HG2 ILE 38 11.330 -12.384 4.306 297 HG22 ILE 38 2HG2 ILE 38 11.082 -12.930 2.648 298 HG23 ILE 38 3HG2 ILE 38 12.659 -13.126 3.414 299 HD11 ILE 38 3HD1 ILE 38 14.669 -9.938 4.576 300 HD12 ILE 38 1HD1 ILE 38 13.694 -10.861 5.719 301 HD13 ILE 38 2HD1 ILE 38 14.240 -11.611 4.219 302 H ALA 39 H ALA 39 14.445 -12.914 0.223 303 HA ALA 39 HA ALA 39 12.252 -12.811 -1.737 304 HB1 ALA 39 1HB ALA 39 13.787 -12.693 -3.337 305 HB2 ALA 39 2HB ALA 39 15.009 -12.523 -2.077 306 HB3 ALA 39 3HB ALA 39 14.621 -14.119 -2.719 307 H LYS 40 H LYS 40 11.391 -14.709 -2.582 308 HA LYS 40 HA LYS 40 12.025 -17.149 -1.055 309 HB2 LYS 40 2HB LYS 40 9.385 -16.374 -2.308 310 HB3 LYS 40 3HB LYS 40 9.700 -17.835 -1.382 311 HG2 LYS 40 2HG LYS 40 10.255 -16.372 0.571 312 HG3 LYS 40 3HG LYS 40 9.679 -15.000 -0.380 313 HD2 LYS 40 2HD LYS 40 7.617 -16.761 -0.650 314 HD3 LYS 40 3HD LYS 40 8.176 -17.120 0.985 315 HE2 LYS 40 2HE LYS 40 7.276 -14.463 -0.113 316 HE3 LYS 40 3HE LYS 40 6.496 -15.429 1.138 317 HZ1 LYS 40 3HZ LYS 40 8.428 -15.065 2.557 318 HZ2 LYS 40 1HZ LYS 40 7.720 -13.597 2.102 319 HZ3 LYS 40 2HZ LYS 40 9.149 -14.112 1.359 320 HA PRO 41 HA PRO 41 13.036 -19.230 -4.786 321 HB2 PRO 41 2HB PRO 41 12.213 -21.754 -4.217 322 HB3 PRO 41 3HB PRO 41 13.643 -21.021 -3.482 323 HG2 PRO 41 2HG PRO 41 10.880 -21.314 -2.367 324 HG3 PRO 41 3HG PRO 41 12.442 -21.574 -1.569 325 HD2 PRO 41 2HD PRO 41 10.993 -19.311 -1.234 326 HD3 PRO 41 3HD PRO 41 12.768 -19.323 -1.196 327 H ILE 42 H ILE 42 11.977 -18.906 -6.636 328 HA ILE 42 HA ILE 42 9.105 -19.333 -6.792 329 HB ILE 42 HB ILE 42 10.947 -18.372 -8.980 330 HG12 ILE 42 2HG1 ILE 42 9.380 -16.754 -6.958 331 HG13 ILE 42 3HG1 ILE 42 11.133 -16.914 -7.010 332 HG21 ILE 42 1HG2 ILE 42 9.128 -18.348 -10.248 333 HG22 ILE 42 2HG2 ILE 42 8.200 -19.046 -8.921 334 HG23 ILE 42 3HG2 ILE 42 8.316 -17.294 -9.090 335 HD11 ILE 42 3HD1 ILE 42 9.375 -15.591 -9.060 336 HD12 ILE 42 1HD1 ILE 42 10.503 -14.808 -7.953 337 HD13 ILE 42 2HD1 ILE 42 11.110 -15.848 -9.242 338 H ASN 43 H ASN 43 12.032 -20.915 -7.682 339 HA ASN 43 HA ASN 43 10.960 -22.517 -9.789 340 HB2 ASN 43 2HB ASN 43 13.370 -22.070 -9.601 341 HB3 ASN 43 3HB ASN 43 13.418 -22.950 -8.076 342 HD21 ASN 43 1HD2 ASN 43 12.846 -23.251 -11.524 343 HD22 ASN 43 2HD2 ASN 43 13.217 -24.935 -11.628 344 H ARG 43 H ARG 43 12.126 -23.511 -6.566 345 HA ARG 43 HA ARG 43 10.643 -25.955 -6.657 346 HB2 ARG 43 2HB ARG 43 11.472 -26.302 -4.380 347 HB3 ARG 43 3HB ARG 43 12.770 -25.801 -5.456 348 HG2 ARG 43 2HG ARG 43 12.839 -23.636 -4.533 349 HG3 ARG 43 3HG ARG 43 11.300 -23.861 -3.700 350 HD2 ARG 43 2HD ARG 43 12.990 -24.062 -2.054 351 HD3 ARG 43 3HD ARG 43 12.414 -25.696 -2.381 352 HE ARG 43 HE ARG 43 14.480 -26.227 -3.234 353 HH11 ARG 43 1HH1 ARG 43 14.230 -22.777 -2.838 354 HH12 ARG 43 2HH1 ARG 43 15.910 -22.488 -3.149 355 HH21 ARG 43 1HH2 ARG 43 16.693 -25.860 -3.645 356 HH22 ARG 43 2HH2 ARG 43 17.310 -24.243 -3.608 357 H LEU 44 H LEU 44 9.520 -26.347 -4.258 358 HA LEU 44 HA LEU 44 6.995 -25.213 -4.467 359 HB2 LEU 44 2HB LEU 44 8.453 -26.652 -2.301 360 HB3 LEU 44 3HB LEU 44 6.898 -25.906 -1.936 361 HG LEU 44 HG LEU 44 7.251 -27.880 -4.179 362 HD11 LEU 44 1HD1 LEU 44 6.615 -28.398 -1.282 363 HD12 LEU 44 2HD1 LEU 44 7.945 -29.061 -2.231 364 HD13 LEU 44 3HD1 LEU 44 6.286 -29.544 -2.581 365 HD21 LEU 44 3HD2 LEU 44 4.922 -26.683 -2.712 366 HD22 LEU 44 1HD2 LEU 44 4.775 -28.192 -3.614 367 HD23 LEU 44 2HD2 LEU 44 5.244 -26.709 -4.446 368 H GLY 45 H GLY 45 9.068 -24.630 -1.633 369 HA2 GLY 45 2HA GLY 45 8.959 -21.784 -1.898 370 HA3 GLY 45 3HA GLY 45 7.809 -22.370 -0.706 371 H GLY 46 H GLY 46 9.842 -20.650 0.013 372 HA2 GLY 46 2HA GLY 46 10.925 -21.802 2.261 373 HA3 GLY 46 3HA GLY 46 12.126 -22.061 1.004 374 HA PRO 47 HA PRO 47 11.679 -17.268 1.643 375 HB2 PRO 47 2HB PRO 47 10.445 -16.511 3.940 376 HB3 PRO 47 3HB PRO 47 9.580 -16.739 2.415 377 HG2 PRO 47 2HG PRO 47 9.827 -18.597 4.749 378 HG3 PRO 47 3HG PRO 47 8.397 -18.207 3.776 379 HD2 PRO 47 2HD PRO 47 9.834 -20.473 3.410 380 HD3 PRO 47 3HD PRO 47 9.005 -19.642 2.078 381 H GLY 48 H GLY 48 13.784 -16.958 2.086 382 HA2 GLY 48 2HA GLY 48 14.697 -17.494 4.845 383 HA3 GLY 48 3HA GLY 48 15.726 -17.673 3.432 384 H LEU 49 H LEU 49 17.256 -16.165 3.579 385 HA LEU 49 HA LEU 49 16.432 -13.372 3.698 386 HB2 LEU 49 2HB LEU 49 17.276 -14.568 5.986 387 HB3 LEU 49 3HB LEU 49 18.800 -13.964 5.337 388 HG LEU 49 HG LEU 49 18.138 -12.241 6.718 389 HD11 LEU 49 1HD1 LEU 49 17.533 -10.399 5.331 390 HD12 LEU 49 2HD1 LEU 49 16.783 -11.465 4.144 391 HD13 LEU 49 3HD1 LEU 49 18.532 -11.489 4.369 392 HD21 LEU 49 3HD2 LEU 49 15.653 -11.406 6.506 393 HD22 LEU 49 1HD2 LEU 49 16.071 -12.763 7.552 394 HD23 LEU 49 2HD2 LEU 49 15.378 -13.060 5.957 395 H VAL 50 H VAL 50 17.502 -12.196 2.246 396 HA VAL 50 HA VAL 50 20.208 -12.970 1.454 397 HB VAL 50 HB VAL 50 18.706 -14.076 -0.158 398 HG11 VAL 50 1HG1 VAL 50 17.252 -12.865 -1.596 399 HG12 VAL 50 2HG1 VAL 50 16.887 -12.351 0.053 400 HG13 VAL 50 3HG1 VAL 50 17.850 -11.316 -1.002 401 HG21 VAL 50 3HG2 VAL 50 20.914 -13.341 -0.879 402 HG22 VAL 50 1HG2 VAL 50 19.748 -13.195 -2.194 403 HG23 VAL 50 2HG2 VAL 50 20.262 -11.760 -1.308 404 HA PRO 51 HA PRO 51 20.690 -8.579 1.772 405 HB2 PRO 51 2HB PRO 51 23.211 -8.449 0.773 406 HB3 PRO 51 3HB PRO 51 22.853 -9.028 2.405 407 HG2 PRO 51 2HG PRO 51 23.395 -10.597 -0.086 408 HG3 PRO 51 3HG PRO 51 23.992 -10.871 1.561 409 HD2 PRO 51 2HD PRO 51 21.930 -12.275 0.507 410 HD3 PRO 51 3HD PRO 51 22.036 -11.888 2.236 411 H VAL 52 H VAL 52 21.100 -6.728 0.388 412 HA VAL 52 HA VAL 52 19.868 -6.987 -2.161 413 HB VAL 52 HB VAL 52 21.429 -4.588 -1.220 414 HG11 VAL 52 1HG1 VAL 52 18.918 -4.170 -2.620 415 HG12 VAL 52 2HG1 VAL 52 20.522 -3.512 -2.951 416 HG13 VAL 52 3HG1 VAL 52 20.075 -5.102 -3.570 417 HG21 VAL 52 3HG2 VAL 52 18.728 -4.183 -0.630 418 HG22 VAL 52 1HG2 VAL 52 19.106 -5.793 -0.017 419 HG23 VAL 52 2HG2 VAL 52 20.050 -4.401 0.516 420 H SER 53 H SER 53 23.123 -7.157 -1.070 421 HA SER 53 HA SER 53 24.319 -6.502 -3.608 422 HB2 SER 53 2HB SER 53 25.566 -7.813 -1.180 423 HB3 SER 53 3HB SER 53 26.432 -7.105 -2.544 424 HG SER 53 HG SER 53 25.098 -5.135 -1.879 425 H TYR 54 H TYR 54 22.573 -9.073 -2.630 426 HA TYR 54 HA TYR 54 24.045 -10.915 -4.397 427 HB2 TYR 54 2HB TYR 54 22.760 -11.402 -1.740 428 HB3 TYR 54 3HB TYR 54 22.790 -12.703 -2.925 429 HD1 TYR 54 HD1 TYR 54 25.028 -10.289 -1.177 430 HD2 TYR 54 HD2 TYR 54 24.669 -14.067 -3.101 431 HE1 TYR 54 HE1 TYR 54 27.324 -10.848 -0.496 432 HE2 TYR 54 HE2 TYR 54 26.963 -14.637 -2.424 433 HH TYR 54 HH TYR 54 29.031 -12.292 -0.783 434 H VAL 55 H VAL 55 21.600 -8.973 -4.526 435 HA VAL 55 HA VAL 55 20.057 -10.691 -6.280 436 HB VAL 55 HB VAL 55 17.888 -9.946 -5.217 437 HG11 VAL 55 1HG1 VAL 55 19.658 -11.748 -3.568 438 HG12 VAL 55 2HG1 VAL 55 17.894 -11.730 -3.564 439 HG13 VAL 55 3HG1 VAL 55 18.768 -12.228 -5.013 440 HG21 VAL 55 3HG2 VAL 55 17.899 -8.577 -3.468 441 HG22 VAL 55 1HG2 VAL 55 18.899 -9.707 -2.555 442 HG23 VAL 55 2HG2 VAL 55 19.657 -8.485 -3.576 443 H ARG 56 H ARG 56 19.103 -9.588 -7.926 444 HA ARG 56 HA ARG 56 19.429 -6.661 -7.898 445 HB2 ARG 56 2HB ARG 56 20.821 -7.545 -9.597 446 HB3 ARG 56 3HB ARG 56 19.580 -8.666 -10.139 447 HG2 ARG 56 2HG ARG 56 18.249 -6.792 -10.971 448 HG3 ARG 56 3HG ARG 56 19.500 -5.670 -10.430 449 HD2 ARG 56 2HD ARG 56 20.350 -7.892 -12.193 450 HD3 ARG 56 3HD ARG 56 19.376 -6.618 -12.926 451 HE ARG 56 HE ARG 56 21.270 -5.222 -11.626 452 HH11 ARG 56 1HH1 ARG 56 21.433 -7.925 -13.813 453 HH12 ARG 56 2HH1 ARG 56 22.982 -7.483 -14.451 454 HH21 ARG 56 1HH2 ARG 56 23.309 -4.629 -12.458 455 HH22 ARG 56 2HH2 ARG 56 24.049 -5.608 -13.679 456 H ILE 57 H ILE 57 17.613 -5.534 -7.781 457 HA ILE 57 HA ILE 57 15.046 -6.708 -7.958 458 HB ILE 57 HB ILE 57 15.608 -3.756 -8.171 459 HG12 ILE 57 2HG1 ILE 57 16.911 -4.532 -6.300 460 HG13 ILE 57 3HG1 ILE 57 15.467 -3.746 -5.669 461 HG21 ILE 57 1HG2 ILE 57 13.446 -3.859 -6.689 462 HG22 ILE 57 2HG2 ILE 57 13.344 -4.003 -8.443 463 HG23 ILE 57 3HG2 ILE 57 13.269 -5.447 -7.434 464 HD11 ILE 57 3HD1 ILE 57 14.778 -6.431 -5.946 465 HD12 ILE 57 1HD1 ILE 57 16.410 -6.428 -5.279 466 HD13 ILE 57 2HD1 ILE 57 15.118 -5.557 -4.453 467 H ILE 58 H ILE 58 14.227 -7.448 -9.806 468 HA ILE 58 HA ILE 58 14.286 -5.674 -12.151 469 HB ILE 58 HB ILE 58 14.357 -7.790 -13.562 470 HG12 ILE 58 2HG1 ILE 58 15.871 -9.207 -11.496 471 HG13 ILE 58 3HG1 ILE 58 14.161 -9.044 -11.111 472 HG21 ILE 58 1HG2 ILE 58 16.544 -7.401 -13.900 473 HG22 ILE 58 2HG2 ILE 58 16.317 -6.123 -12.706 474 HG23 ILE 58 3HG2 ILE 58 16.960 -7.689 -12.211 475 HD11 ILE 58 3HD1 ILE 58 15.340 -10.961 -12.728 476 HD12 ILE 58 1HD1 ILE 58 13.617 -10.628 -12.557 477 HD13 ILE 58 2HD1 ILE 58 14.540 -9.859 -13.849 478 H ASP 59 H ASP 59 12.345 -5.292 -12.998 479 HA ASP 59 HA ASP 59 9.984 -6.297 -11.835 480 HB2 ASP 59 2HB ASP 59 10.634 -4.218 -13.556 481 HB3 ASP 59 3HB ASP 59 9.620 -5.270 -14.539 482 H LEU 60 H LEU 60 8.879 -8.104 -12.189 483 HA LEU 60 HA LEU 60 9.795 -10.165 -13.832 484 HB2 LEU 60 2HB LEU 60 8.432 -10.775 -12.030 485 HB3 LEU 60 3HB LEU 60 7.171 -9.631 -12.484 486 HG LEU 60 HG LEU 60 6.561 -11.042 -14.381 487 HD11 LEU 60 1HD1 LEU 60 8.559 -13.040 -13.345 488 HD12 LEU 60 2HD1 LEU 60 8.866 -11.969 -14.712 489 HD13 LEU 60 3HD1 LEU 60 7.565 -13.156 -14.797 490 HD21 LEU 60 3HD2 LEU 60 5.312 -12.507 -13.155 491 HD22 LEU 60 1HD2 LEU 60 5.830 -11.416 -11.870 492 HD23 LEU 60 2HD2 LEU 60 6.659 -12.954 -12.106 493 H MET 61 H MET 61 7.610 -7.528 -14.481 494 HA MET 61 HA MET 61 6.753 -8.664 -17.015 495 HB2 MET 61 2HB MET 61 6.171 -5.872 -16.061 496 HB3 MET 61 3HB MET 61 5.235 -6.868 -17.167 497 HG2 MET 61 2HG MET 61 5.546 -7.290 -14.204 498 HG3 MET 61 3HG MET 61 4.115 -6.692 -15.040 499 HE1 MET 61 3HE MET 61 5.317 -9.344 -13.157 500 HE2 MET 61 1HE MET 61 3.566 -9.144 -13.096 501 HE3 MET 61 2HE MET 61 4.260 -10.682 -13.609 502 H ASP 62 H ASP 62 9.467 -7.162 -15.976 503 HA ASP 62 HA ASP 62 10.414 -6.623 -18.588 504 HB2 ASP 62 2HB ASP 62 8.883 -4.581 -17.847 505 HB3 ASP 62 3HB ASP 62 10.351 -4.098 -17.002 506 HA PRO 63 HA PRO 63 13.613 -7.515 -15.401 507 HB2 PRO 63 2HB PRO 63 14.989 -9.255 -16.966 508 HB3 PRO 63 3HB PRO 63 13.596 -9.735 -15.990 509 HG2 PRO 63 2HG PRO 63 13.733 -9.096 -18.912 510 HG3 PRO 63 3HG PRO 63 12.871 -10.413 -18.093 511 HD2 PRO 63 2HD PRO 63 11.629 -8.156 -18.929 512 HD3 PRO 63 3HD PRO 63 11.112 -9.052 -17.487 513 H ALA 64 H ALA 64 13.514 -6.060 -18.446 514 HA ALA 64 HA ALA 64 16.378 -5.427 -18.435 515 HB1 ALA 64 1HB ALA 64 16.183 -4.825 -20.693 516 HB2 ALA 64 2HB ALA 64 15.176 -6.263 -20.522 517 HB3 ALA 64 3HB ALA 64 14.429 -4.667 -20.589 518 H LYS 65 H LYS 65 13.589 -4.214 -17.190 519 HA LYS 65 HA LYS 65 14.015 -1.419 -17.769 520 HB2 LYS 65 2HB LYS 65 11.752 -2.413 -17.377 521 HB3 LYS 65 3HB LYS 65 12.202 -2.665 -15.696 522 HG2 LYS 65 2HG LYS 65 12.081 -0.443 -15.183 523 HG3 LYS 65 3HG LYS 65 12.453 0.071 -16.830 524 HD2 LYS 65 2HD LYS 65 10.067 0.440 -16.008 525 HD3 LYS 65 3HD LYS 65 10.264 -0.352 -17.573 526 HE2 LYS 65 2HE LYS 65 9.465 -2.334 -16.819 527 HE3 LYS 65 3HE LYS 65 10.152 -2.122 -15.210 528 HZ1 LYS 65 3HZ LYS 65 7.543 -1.369 -16.220 529 HZ2 LYS 65 1HZ LYS 65 8.286 -0.217 -15.229 530 HZ3 LYS 65 2HZ LYS 65 8.020 -1.783 -14.651 531 H TYR 66 H TYR 66 14.212 -3.455 -14.851 532 HA TYR 66 HA TYR 66 15.847 -1.369 -13.583 533 HB2 TYR 66 2HB TYR 66 14.332 -3.702 -12.402 534 HB3 TYR 66 3HB TYR 66 15.382 -2.641 -11.470 535 HD1 TYR 66 HD2 TYR 66 12.402 -2.552 -13.709 536 HD2 TYR 66 HD1 TYR 66 14.499 -0.729 -10.487 537 HE1 TYR 66 HE2 TYR 66 10.523 -1.001 -13.371 538 HE2 TYR 66 HE1 TYR 66 12.625 0.826 -10.139 539 HH TYR 66 HH TYR 66 10.639 1.736 -11.898 540 H ALA 67 H ALA 67 16.719 -3.412 -15.603 541 HA ALA 67 HA ALA 67 18.425 -5.229 -14.160 542 HB1 ALA 67 1HB ALA 67 19.182 -4.968 -16.907 543 HB2 ALA 67 2HB ALA 67 18.418 -6.330 -16.086 544 HB3 ALA 67 3HB ALA 67 17.424 -5.050 -16.782 545 H SER 68 H SER 68 18.636 -2.002 -15.257 546 HA SER 68 HA SER 68 21.571 -2.038 -15.078 547 HB2 SER 68 2HB SER 68 21.173 0.395 -16.023 548 HB3 SER 68 3HB SER 68 21.117 -1.003 -17.096 549 HG SER 68 HG SER 68 19.279 0.721 -16.935 550 H VAL 69 H VAL 69 19.553 -2.015 -12.845 551 HA VAL 69 HA VAL 69 19.989 0.595 -11.628 552 HB VAL 69 HB VAL 69 17.779 -0.590 -11.461 553 HG11 VAL 69 1HG1 VAL 69 17.480 -2.520 -10.258 554 HG12 VAL 69 2HG1 VAL 69 19.074 -2.819 -10.954 555 HG13 VAL 69 3HG1 VAL 69 18.928 -2.268 -9.284 556 HG21 VAL 69 3HG2 VAL 69 18.466 -0.329 -8.653 557 HG22 VAL 69 1HG2 VAL 69 19.113 0.991 -9.627 558 HG23 VAL 69 2HG2 VAL 69 17.384 0.646 -9.646 559 H ASP 70 H ASP 70 21.058 0.905 -9.654 560 HA ASP 70 HA ASP 70 23.126 -1.097 -9.109 561 HB2 ASP 70 2HB ASP 70 22.926 1.803 -8.266 562 HB3 ASP 70 3HB ASP 70 24.275 0.731 -7.900 563 H THR 71 H THR 71 21.760 -2.521 -7.924 564 HA THR 71 HA THR 71 20.138 -1.920 -5.780 565 HB THR 71 HB THR 71 21.266 -4.284 -4.961 566 HG1 THR 71 HG1 THR 71 21.808 -5.428 -6.814 567 HG21 THR 71 3HG2 THR 71 19.272 -5.194 -5.592 568 HG22 THR 71 1HG2 THR 71 19.301 -4.433 -7.182 569 HG23 THR 71 2HG2 THR 71 18.849 -3.491 -5.761 570 H TYR 72 H TYR 72 23.636 -2.515 -5.769 571 HA TYR 72 HA TYR 72 24.098 -2.460 -3.039 572 HB2 TYR 72 2HB TYR 72 25.862 -3.075 -4.553 573 HB3 TYR 72 3HB TYR 72 25.830 -1.490 -5.317 574 HD1 TYR 72 HD2 TYR 72 26.428 -3.090 -1.999 575 HD2 TYR 72 HD1 TYR 72 27.346 0.125 -4.631 576 HE1 TYR 72 HE2 TYR 72 28.154 -2.307 -0.431 577 HE2 TYR 72 HE1 TYR 72 29.076 0.915 -3.071 578 HH TYR 72 HH TYR 72 30.021 0.641 -1.076 579 H ASP 73 H ASP 73 23.802 0.226 -5.313 580 HA ASP 73 HA ASP 73 24.527 2.285 -3.533 581 HB2 ASP 73 2HB ASP 73 24.391 2.530 -6.008 582 HB3 ASP 73 3HB ASP 73 22.635 2.466 -5.885 583 H ARG 74 H ARG 74 23.558 2.552 -1.624 584 HA ARG 74 HA ARG 74 21.019 1.753 -0.883 585 HB2 ARG 74 2HB ARG 74 21.288 3.062 1.074 586 HB3 ARG 74 3HB ARG 74 22.906 2.546 0.615 587 HG2 ARG 74 2HG ARG 74 21.765 5.226 -0.123 588 HG3 ARG 74 3HG ARG 74 22.688 4.934 1.353 589 HD2 ARG 74 2HD ARG 74 23.620 4.642 -1.496 590 HD3 ARG 74 3HD ARG 74 24.195 5.789 -0.286 591 HE ARG 74 HE ARG 74 24.688 3.331 0.802 592 HH11 ARG 74 1HH1 ARG 74 25.547 4.938 -2.165 593 HH12 ARG 74 2HH1 ARG 74 27.054 4.101 -2.334 594 HH21 ARG 74 1HH2 ARG 74 26.670 2.222 0.590 595 HH22 ARG 74 2HH2 ARG 74 27.692 2.555 -0.767 596 H GLU 75 H GLU 75 22.017 4.601 -2.614 597 HA GLU 75 HA GLU 75 19.685 6.153 -2.211 598 HB2 GLU 75 2HB GLU 75 21.866 6.173 -4.278 599 HB3 GLU 75 3HB GLU 75 20.479 7.244 -4.420 600 HG2 GLU 75 2HG GLU 75 21.069 8.480 -2.571 601 HG3 GLU 75 3HG GLU 75 22.031 7.177 -1.876 602 H GLN 76 H GLN 76 20.705 4.197 -5.015 603 HA GLN 76 HA GLN 76 18.333 4.458 -6.470 604 HB2 GLN 76 2HB GLN 76 20.206 2.087 -6.491 605 HB3 GLN 76 3HB GLN 76 19.093 2.558 -7.769 606 HG2 GLN 76 2HG GLN 76 20.886 4.715 -7.081 607 HG3 GLN 76 3HG GLN 76 21.765 3.256 -7.535 608 HE21 GLN 76 1HE2 GLN 76 21.822 2.642 -9.625 609 HE22 GLN 76 2HE2 GLN 76 21.057 3.500 -10.914 610 H VAL 77 H VAL 77 19.387 1.722 -4.436 611 HA VAL 77 HA VAL 77 17.097 0.181 -4.606 612 HB VAL 77 HB VAL 77 19.338 -0.348 -3.445 613 HG11 VAL 77 1HG1 VAL 77 19.215 1.532 -1.848 614 HG12 VAL 77 2HG1 VAL 77 17.827 0.759 -1.080 615 HG13 VAL 77 3HG1 VAL 77 19.405 -0.029 -1.051 616 HG21 VAL 77 3HG2 VAL 77 16.630 -1.307 -2.924 617 HG22 VAL 77 1HG2 VAL 77 18.101 -2.206 -3.294 618 HG23 VAL 77 2HG2 VAL 77 17.773 -1.693 -1.639 619 H MET 78 H MET 78 17.720 3.026 -2.666 620 HA MET 78 HA MET 78 15.510 2.766 -0.915 621 HB2 MET 78 2HB MET 78 17.472 4.854 -1.604 622 HB3 MET 78 3HB MET 78 15.926 5.454 -1.020 623 HG2 MET 78 2HG MET 78 16.181 3.964 0.962 624 HG3 MET 78 3HG MET 78 17.806 3.583 0.395 625 HE1 MET 78 3HE MET 78 19.713 4.634 0.952 626 HE2 MET 78 1HE MET 78 19.608 6.031 -0.121 627 HE3 MET 78 2HE MET 78 19.971 6.258 1.590 628 H LYS 79 H LYS 79 15.972 4.792 -3.814 629 HA LYS 79 HA LYS 79 13.413 5.867 -3.937 630 HB2 LYS 79 2HB LYS 79 15.408 5.231 -6.106 631 HB3 LYS 79 3HB LYS 79 13.891 6.058 -6.433 632 HG2 LYS 79 2HG LYS 79 14.669 8.003 -5.682 633 HG3 LYS 79 3HG LYS 79 15.375 7.263 -4.243 634 HD2 LYS 79 2HD LYS 79 17.262 6.466 -5.670 635 HD3 LYS 79 3HD LYS 79 16.581 7.397 -7.006 636 HE2 LYS 79 2HE LYS 79 18.170 8.839 -6.122 637 HE3 LYS 79 3HE LYS 79 16.676 9.387 -5.363 638 HZ1 LYS 79 3HZ LYS 79 18.140 7.346 -3.913 639 HZ2 LYS 79 1HZ LYS 79 17.366 8.738 -3.342 640 HZ3 LYS 79 2HZ LYS 79 18.912 8.848 -4.019 641 H ILE 80 H ILE 80 14.641 2.803 -5.183 642 HA ILE 80 HA ILE 80 12.349 2.066 -6.648 643 HB ILE 80 HB ILE 80 14.435 0.316 -5.342 644 HG12 ILE 80 2HG1 ILE 80 14.145 1.247 -8.207 645 HG13 ILE 80 3HG1 ILE 80 15.290 1.905 -7.042 646 HG21 ILE 80 1HG2 ILE 80 12.336 -0.357 -7.398 647 HG22 ILE 80 2HG2 ILE 80 13.666 -1.414 -6.930 648 HG23 ILE 80 3HG2 ILE 80 12.434 -0.971 -5.748 649 HD11 ILE 80 3HD1 ILE 80 15.591 -0.928 -7.155 650 HD12 ILE 80 1HD1 ILE 80 15.641 -0.264 -8.788 651 HD13 ILE 80 2HD1 ILE 80 16.753 0.336 -7.558 652 H ILE 81 H ILE 81 13.416 1.048 -3.400 653 HA ILE 81 HA ILE 81 11.138 -0.447 -2.763 654 HB ILE 81 HB ILE 81 13.034 1.023 -0.930 655 HG12 ILE 81 2HG1 ILE 81 12.892 -1.918 -1.618 656 HG13 ILE 81 3HG1 ILE 81 13.975 -0.780 -2.412 657 HG21 ILE 81 1HG2 ILE 81 11.588 0.584 0.702 658 HG22 ILE 81 2HG2 ILE 81 10.565 -0.370 -0.372 659 HG23 ILE 81 3HG2 ILE 81 11.934 -1.126 0.444 660 HD11 ILE 81 3HD1 ILE 81 15.453 -0.953 -0.777 661 HD12 ILE 81 1HD1 ILE 81 14.232 -0.607 0.447 662 HD13 ILE 81 2HD1 ILE 81 14.473 -2.261 -0.116 663 H ASP 82 H ASP 82 11.819 2.986 -2.453 664 HA ASP 82 HA ASP 82 9.555 3.623 -0.861 665 HB2 ASP 82 2HB ASP 82 11.624 5.050 -1.169 666 HB3 ASP 82 3HB ASP 82 10.994 5.483 -2.756 667 H GLU 83 H GLU 83 10.187 3.885 -4.353 668 HA GLU 83 HA GLU 83 7.663 4.896 -5.060 669 HB2 GLU 83 2HB GLU 83 9.726 3.344 -6.617 670 HB3 GLU 83 3HB GLU 83 8.242 3.937 -7.349 671 HG2 GLU 83 2HG GLU 83 9.869 5.899 -5.855 672 HG3 GLU 83 3HG GLU 83 10.526 5.304 -7.379 673 H PHE 84 H PHE 84 8.890 1.578 -4.878 674 HA PHE 84 HA PHE 84 6.437 0.407 -5.778 675 HB2 PHE 84 2HB PHE 84 9.028 -0.619 -4.705 676 HB3 PHE 84 3HB PHE 84 7.632 -1.692 -4.692 677 HD1 PHE 84 HD1 PHE 84 9.267 0.697 -7.052 678 HD2 PHE 84 HD2 PHE 84 7.430 -3.100 -6.481 679 HE1 PHE 84 HE1 PHE 84 9.674 0.148 -9.416 680 HE2 PHE 84 HE2 PHE 84 7.835 -3.655 -8.844 681 HZ PHE 84 HZ PHE 84 8.959 -2.030 -10.314 682 H LYS 85 H LYS 85 7.579 1.605 -2.798 683 HA LYS 85 HA LYS 85 6.675 1.701 -0.713 684 HB2 LYS 85 2HB LYS 85 4.180 0.526 -1.944 685 HB3 LYS 85 3HB LYS 85 4.295 1.473 -0.466 686 HG2 LYS 85 2HG LYS 85 5.006 2.559 -3.177 687 HG3 LYS 85 3HG LYS 85 3.395 2.685 -2.467 688 HD2 LYS 85 2HD LYS 85 4.203 4.009 -0.664 689 HD3 LYS 85 3HD LYS 85 5.884 3.679 -1.092 690 HE2 LYS 85 2HE LYS 85 5.363 4.824 -3.311 691 HE3 LYS 85 3HE LYS 85 3.883 5.393 -2.540 692 HZ1 LYS 85 3HZ LYS 85 5.068 7.055 -1.715 693 HZ2 LYS 85 1HZ LYS 85 6.515 6.403 -2.301 694 HZ3 LYS 85 2HZ LYS 85 5.938 5.948 -0.778 695 H ILE 86 H ILE 86 8.288 -0.412 -1.081 696 HA ILE 86 HA ILE 86 7.024 -2.897 -0.393 697 HB ILE 86 HB ILE 86 9.960 -2.256 -0.160 698 HG12 ILE 86 2HG1 ILE 86 8.442 -3.232 -2.590 699 HG13 ILE 86 3HG1 ILE 86 9.143 -1.629 -2.400 700 HG21 ILE 86 1HG2 ILE 86 8.955 -4.385 0.820 701 HG22 ILE 86 2HG2 ILE 86 8.682 -4.883 -0.849 702 HG23 ILE 86 3HG2 ILE 86 10.321 -4.571 -0.279 703 HD11 ILE 86 3HD1 ILE 86 11.325 -3.097 -1.964 704 HD12 ILE 86 1HD1 ILE 86 10.436 -4.208 -3.007 705 HD13 ILE 86 2HD1 ILE 86 10.815 -2.580 -3.571 706 HA PRO 87 HA PRO 87 6.799 -2.142 3.968 707 HB2 PRO 87 2HB PRO 87 6.162 -4.677 4.702 708 HB3 PRO 87 3HB PRO 87 5.001 -3.573 3.957 709 HG2 PRO 87 2HG PRO 87 6.594 -5.775 2.703 710 HG3 PRO 87 3HG PRO 87 4.890 -5.348 2.459 711 HD2 PRO 87 2HD PRO 87 6.834 -4.635 0.715 712 HD3 PRO 87 3HD PRO 87 5.397 -3.634 1.005 713 H THR 88 H THR 88 7.820 -2.884 5.950 714 HA THR 88 HA THR 88 10.543 -3.797 5.457 715 HB THR 88 HB THR 88 10.075 -3.287 8.231 716 HG1 THR 88 HG1 THR 88 9.144 -1.253 6.459 717 HG21 THR 88 3HG2 THR 88 11.698 -1.448 7.804 718 HG22 THR 88 1HG2 THR 88 11.569 -1.785 6.078 719 HG23 THR 88 2HG2 THR 88 12.222 -3.007 7.169 720 H VAL 89 H VAL 89 11.527 -5.290 7.101 721 HA VAL 89 HA VAL 89 10.376 -7.790 7.036 722 HB VAL 89 HB VAL 89 12.304 -6.727 9.106 723 HG11 VAL 89 1HG1 VAL 89 12.142 -8.695 10.119 724 HG12 VAL 89 2HG1 VAL 89 10.966 -9.246 8.924 725 HG13 VAL 89 3HG1 VAL 89 12.691 -9.479 8.638 726 HG21 VAL 89 3HG2 VAL 89 13.386 -6.463 7.069 727 HG22 VAL 89 1HG2 VAL 89 13.911 -8.067 7.581 728 HG23 VAL 89 2HG2 VAL 89 12.639 -7.900 6.371 729 H GLU 90 H GLU 90 10.434 -5.576 9.834 730 HA GLU 90 HA GLU 90 8.953 -7.080 11.606 731 HB2 GLU 90 2HB GLU 90 9.202 -4.111 11.214 732 HB3 GLU 90 3HB GLU 90 8.169 -4.771 12.474 733 HG2 GLU 90 2HG GLU 90 10.127 -5.981 13.383 734 HG3 GLU 90 3HG GLU 90 11.135 -5.182 12.178 735 H GLN 91 H GLN 91 7.739 -4.732 9.226 736 HA GLN 91 HA GLN 91 5.027 -4.944 9.815 737 HB2 GLN 91 2HB GLN 91 6.190 -4.514 7.062 738 HB3 GLN 91 3HB GLN 91 4.612 -3.996 7.642 739 HG2 GLN 91 2HG GLN 91 7.302 -2.946 8.477 740 HG3 GLN 91 3HG GLN 91 6.048 -2.099 7.572 741 HE21 GLN 91 1HE2 GLN 91 7.441 -1.703 10.249 742 HE22 GLN 91 2HE2 GLN 91 6.141 -1.413 11.349 743 H TRP 92 H TRP 92 6.985 -6.803 7.509 744 HA TRP 92 HA TRP 92 4.928 -8.369 6.447 745 HB2 TRP 92 2HB TRP 92 7.213 -8.222 5.498 746 HB3 TRP 92 3HB TRP 92 7.818 -9.164 6.857 747 HD1 TRP 92 HD1 TRP 92 4.995 -9.681 4.224 748 HE1 TRP 92 HE1 TRP 92 5.129 -12.117 3.403 749 HE3 TRP 92 HE3 TRP 92 8.933 -11.279 7.065 750 HZ2 TRP 92 HZ2 TRP 92 6.696 -14.412 3.896 751 HZ3 TRP 92 HZ3 TRP 92 9.687 -13.609 6.832 752 HH2 TRP 92 HH2 TRP 92 8.590 -15.142 5.280 753 H LYS 93 H LYS 93 6.883 -8.781 9.348 754 HA LYS 93 HA LYS 93 6.017 -11.405 9.966 755 HB2 LYS 93 2HB LYS 93 7.006 -9.264 11.858 756 HB3 LYS 93 3HB LYS 93 6.946 -10.991 12.182 757 HG2 LYS 93 2HG LYS 93 8.480 -10.107 9.808 758 HG3 LYS 93 3HG LYS 93 9.161 -9.759 11.399 759 HD2 LYS 93 2HD LYS 93 9.921 -11.847 11.472 760 HD3 LYS 93 3HD LYS 93 8.249 -12.413 11.505 761 HE2 LYS 93 2HE LYS 93 9.187 -13.533 9.685 762 HE3 LYS 93 3HE LYS 93 8.327 -12.180 8.952 763 HZ1 LYS 93 3HZ LYS 93 11.179 -11.921 9.640 764 HZ2 LYS 93 1HZ LYS 93 10.282 -11.084 8.475 765 HZ3 LYS 93 2HZ LYS 93 10.721 -12.696 8.207 766 H ASP 94 H ASP 94 4.882 -8.200 10.962 767 HA ASP 94 HA ASP 94 2.905 -9.110 12.762 768 HB2 ASP 94 2HB ASP 94 3.594 -6.841 12.943 769 HB3 ASP 94 3HB ASP 94 3.246 -6.525 11.245 770 H GLN 95 H GLN 95 2.892 -8.497 9.301 771 HA GLN 95 HA GLN 95 0.068 -8.759 8.987 772 HB2 GLN 95 2HB GLN 95 2.269 -9.035 6.933 773 HB3 GLN 95 3HB GLN 95 0.556 -8.849 6.583 774 HG2 GLN 95 2HG GLN 95 0.548 -6.633 7.074 775 HG3 GLN 95 3HG GLN 95 1.839 -6.778 8.265 776 HE21 GLN 95 1HE2 GLN 95 2.281 -4.727 6.884 777 HE22 GLN 95 2HE2 GLN 95 3.397 -4.954 5.585 778 H THR 96 H THR 96 2.815 -10.948 8.729 779 HA THR 96 HA THR 96 1.287 -13.143 7.711 780 HB THR 96 HB THR 96 3.365 -14.473 8.484 781 HG1 THR 96 HG1 THR 96 4.693 -13.327 9.659 782 HG21 THR 96 3HG2 THR 96 4.577 -13.844 6.522 783 HG22 THR 96 1HG2 THR 96 3.829 -12.248 6.501 784 HG23 THR 96 2HG2 THR 96 2.861 -13.680 6.154 785 H ARG 97 H ARG 97 2.549 -12.246 10.903 786 HA ARG 97 HA ARG 97 1.634 -14.562 12.245 787 HB2 ARG 97 2HB ARG 97 2.126 -13.380 14.284 788 HB3 ARG 97 3HB ARG 97 3.385 -13.016 13.111 789 HG2 ARG 97 2HG ARG 97 3.046 -10.895 13.718 790 HG3 ARG 97 3HG ARG 97 1.630 -10.987 12.668 791 HD2 ARG 97 2HD ARG 97 0.619 -10.235 14.563 792 HD3 ARG 97 3HD ARG 97 0.531 -11.968 14.873 793 HE ARG 97 HE ARG 97 1.978 -11.688 16.621 794 HH11 ARG 97 1HH1 ARG 97 2.117 -8.876 14.573 795 HH12 ARG 97 2HH1 ARG 97 3.125 -7.976 15.657 796 HH21 ARG 97 1HH2 ARG 97 3.305 -10.513 18.056 797 HH22 ARG 97 2HH2 ARG 97 3.801 -8.908 17.637 798 H ARG 98 H ARG 98 0.158 -11.465 11.511 799 HA ARG 98 HA ARG 98 -2.144 -11.934 13.179 800 HB2 ARG 98 2HB ARG 98 -2.910 -9.825 12.479 801 HB3 ARG 98 3HB ARG 98 -1.161 -9.658 12.544 802 HG2 ARG 98 2HG ARG 98 -1.037 -9.954 10.125 803 HG3 ARG 98 3HG ARG 98 -2.791 -10.137 10.057 804 HD2 ARG 98 2HD ARG 98 -2.667 -7.808 11.351 805 HD3 ARG 98 3HD ARG 98 -1.140 -7.711 10.474 806 HE ARG 98 HE ARG 98 -2.335 -7.285 8.586 807 HH11 ARG 98 1HH1 ARG 98 -4.408 -8.927 10.850 808 HH12 ARG 98 2HH1 ARG 98 -5.817 -8.804 9.849 809 HH21 ARG 98 1HH2 ARG 98 -4.183 -7.117 7.259 810 HH22 ARG 98 2HH2 ARG 98 -5.688 -7.775 7.806 811 H TYR 99 H TYR 99 -1.272 -12.373 9.821 812 HA TYR 99 HA TYR 99 -3.969 -12.926 8.968 813 HB2 TYR 99 2HB TYR 99 -2.585 -11.980 7.300 814 HB3 TYR 99 3HB TYR 99 -1.276 -13.111 7.628 815 HD1 TYR 99 HD1 TYR 99 -4.916 -13.471 6.825 816 HD2 TYR 99 HD2 TYR 99 -0.911 -14.538 5.861 817 HE1 TYR 99 HE1 TYR 99 -5.744 -14.938 5.033 818 HE2 TYR 99 HE2 TYR 99 -1.728 -16.007 4.066 819 HH TYR 99 HH TYR 99 -3.586 -16.439 2.743 820 H LYS 100 H LYS 100 -1.314 -14.706 10.260 821 HA LYS 100 HA LYS 100 -2.345 -17.275 9.374 822 HB2 LYS 100 2HB LYS 100 0.086 -16.367 10.871 823 HB3 LYS 100 3HB LYS 100 -0.407 -18.053 10.963 824 HG2 LYS 100 2HG LYS 100 -0.093 -16.720 8.307 825 HG3 LYS 100 3HG LYS 100 1.317 -17.324 9.181 826 HD2 LYS 100 2HD LYS 100 -1.058 -19.097 8.797 827 HD3 LYS 100 3HD LYS 100 0.077 -18.858 7.467 828 HE2 LYS 100 2HE LYS 100 0.987 -19.650 10.218 829 HE3 LYS 100 3HE LYS 100 0.480 -20.844 9.024 830 HZ1 LYS 100 3HZ LYS 100 2.424 -18.878 8.125 831 HZ2 LYS 100 1HZ LYS 100 2.328 -20.536 7.799 832 HZ3 LYS 100 2HZ LYS 100 2.980 -19.998 9.264 833 H GLU 101 H GLU 101 -2.720 -15.151 12.009 834 HA GLU 101 HA GLU 101 -3.105 -16.791 14.189 835 HB2 GLU 101 2HB GLU 101 -4.329 -15.044 15.170 836 HB3 GLU 101 3HB GLU 101 -3.249 -14.238 14.041 837 HG2 GLU 101 2HG GLU 101 -5.191 -14.310 12.393 838 HG3 GLU 101 3HG GLU 101 -6.194 -14.724 13.782 839 H SER 102 H SER 102 -5.258 -17.317 15.226 840 HA SER 102 HA SER 102 -6.826 -18.842 13.304 841 HB2 SER 102 2HB SER 102 -7.874 -19.818 15.378 842 HB3 SER 102 3HB SER 102 -6.132 -20.066 15.252 843 HG SER 102 HG SER 102 -6.845 -19.342 17.345 844 H SER 103 H SER 103 -7.808 -16.923 12.360 845 HA SER 103 HA SER 103 -9.832 -15.630 14.044 846 HB2 SER 103 2HB SER 103 -8.744 -14.904 11.315 847 HB3 SER 103 3HB SER 103 -10.045 -14.031 12.125 848 HG SER 103 HG SER 103 -7.779 -13.247 12.388 849 H ILE 104 H ILE 104 -11.765 -14.912 12.372 850 HA ILE 104 HA ILE 104 -12.925 -17.478 11.566 851 HB ILE 104 HB ILE 104 -14.445 -14.894 11.706 852 HG12 ILE 104 2HG1 ILE 104 -13.317 -15.071 13.850 853 HG13 ILE 104 3HG1 ILE 104 -15.021 -15.465 14.052 854 HG21 ILE 104 1HG2 ILE 104 -16.066 -16.889 12.594 855 HG22 ILE 104 2HG2 ILE 104 -15.975 -16.334 10.924 856 HG23 ILE 104 3HG2 ILE 104 -15.052 -17.747 11.435 857 HD11 ILE 104 3HD1 ILE 104 -13.859 -17.909 13.558 858 HD12 ILE 104 1HD1 ILE 104 -12.665 -17.075 14.552 859 HD13 ILE 104 2HD1 ILE 104 -14.318 -17.268 15.136 860 H GLN 105 H GLN 105 -14.266 -17.538 9.610 861 HA GLN 105 HA GLN 105 -12.846 -16.534 7.365 862 HB2 GLN 105 2HB GLN 105 -15.640 -17.632 7.233 863 HB3 GLN 105 3HB GLN 105 -14.356 -17.752 6.038 864 HG2 GLN 105 2HG GLN 105 -13.272 -19.016 8.216 865 HG3 GLN 105 3HG GLN 105 -14.973 -19.470 8.302 866 HE21 GLN 105 1HE2 GLN 105 -15.840 -20.784 6.743 867 HE22 GLN 105 2HE2 GLN 105 -14.886 -21.600 5.557 868 H ILE 106 H ILE 106 -14.717 -15.773 5.530 869 HA ILE 106 HA ILE 106 -15.958 -13.363 6.673 870 HB ILE 106 HB ILE 106 -14.472 -13.416 4.046 871 HG12 ILE 106 2HG1 ILE 106 -13.304 -11.628 5.931 872 HG13 ILE 106 3HG1 ILE 106 -13.463 -13.199 6.709 873 HG21 ILE 106 1HG2 ILE 106 -14.712 -10.922 4.278 874 HG22 ILE 106 2HG2 ILE 106 -16.209 -11.802 3.973 875 HG23 ILE 106 3HG2 ILE 106 -15.838 -11.231 5.600 876 HD11 ILE 106 3HD1 ILE 106 -12.148 -14.249 5.047 877 HD12 ILE 106 1HD1 ILE 106 -12.195 -12.821 4.013 878 HD13 ILE 106 2HD1 ILE 106 -11.295 -12.784 5.530 879 H GLY 107 H GLY 107 -17.973 -12.924 5.970 880 HA2 GLY 107 2HA GLY 107 -19.268 -14.871 4.274 881 HA3 GLY 107 3HA GLY 107 -20.038 -13.520 5.093 882 H ASN 108 H ASN 108 -17.670 -14.073 2.483 883 HA ASN 108 HA ASN 108 -18.885 -11.825 1.029 884 HB2 ASN 108 2HB ASN 108 -16.810 -11.691 -0.236 885 HB3 ASN 108 3HB ASN 108 -16.458 -11.651 1.490 886 HD21 ASN 108 1HD2 ASN 108 -14.961 -12.532 -0.994 887 HD22 ASN 108 2HD2 ASN 108 -14.354 -14.096 -0.580 888 H GLY 109 H GLY 109 -19.649 -12.067 -1.041 889 HA2 GLY 109 2HA GLY 109 -19.931 -14.857 -1.952 890 HA3 GLY 109 3HA GLY 109 -21.060 -13.561 -2.316 891 H HIS 110 H HIS 110 -20.441 -14.862 -4.450 892 HA HIS 110 HA HIS 110 -18.193 -13.460 -5.734 893 HB2 HIS 110 2HB HIS 110 -19.562 -16.049 -6.488 894 HB3 HIS 110 3HB HIS 110 -18.297 -15.277 -7.438 895 HD1 HIS 110 HD1 HIS 110 -18.707 -17.863 -5.063 896 HD2 HIS 110 HD2 HIS 110 -15.856 -14.897 -5.645 897 HE1 HIS 110 HE1 HIS 110 -16.659 -18.646 -3.830 898 H GLY 111 H GLY 111 -18.500 -12.889 -8.037 899 HA2 GLY 111 2HA GLY 111 -20.969 -11.453 -8.359 900 HA3 GLY 111 3HA GLY 111 -19.624 -11.484 -9.490 901 H GLN 112 H GLN 112 -21.364 -11.566 -11.101 902 HA GLN 112 HA GLN 112 -21.899 -14.315 -11.835 903 HB2 GLN 112 2HB GLN 112 -24.327 -13.885 -12.198 904 HB3 GLN 112 3HB GLN 112 -23.855 -13.882 -10.504 905 HG2 GLN 112 2HG GLN 112 -23.940 -11.300 -11.979 906 HG3 GLN 112 3HG GLN 112 -25.452 -12.049 -11.467 907 HE21 GLN 112 1HE2 GLN 112 -25.545 -12.684 -9.149 908 HE22 GLN 112 2HE2 GLN 112 -24.821 -11.619 -7.998 909 H SER 113 H SER 113 -22.553 -14.556 -14.042 910 HA SER 113 HA SER 113 -22.324 -12.141 -15.694 911 HB2 SER 113 2HB SER 113 -20.895 -14.706 -16.401 912 HB3 SER 113 3HB SER 113 -20.730 -13.127 -17.168 913 HG SER 113 HG SER 113 -19.010 -13.661 -15.693 914 H GLN 114 H GLN 114 -23.876 -12.018 -17.175 915 HA GLN 114 HA GLN 114 -24.872 -14.285 -18.591 916 HB2 GLN 114 2HB GLN 114 -27.188 -14.189 -17.796 917 HB3 GLN 114 3HB GLN 114 -26.085 -14.622 -16.496 918 HG2 GLN 114 2HG GLN 114 -26.120 -12.209 -15.802 919 HG3 GLN 114 3HG GLN 114 -27.426 -11.976 -16.964 920 HE21 GLN 114 1HE2 GLN 114 -29.148 -11.640 -15.716 921 HE22 GLN 114 2HE2 GLN 114 -29.711 -12.714 -14.485 922 H GLY 115 H GLY 115 -25.912 -13.698 -20.454 923 HA2 GLY 115 2HA GLY 115 -26.604 -10.852 -20.772 924 HA3 GLY 115 3HA GLY 115 -25.554 -11.638 -21.942 925 H LEU 116 H LEU 116 -28.784 -11.105 -20.923 926 HA LEU 116 HA LEU 116 -29.945 -13.180 -22.552 927 HB2 LEU 116 2HB LEU 116 -31.275 -10.803 -21.262 928 HB3 LEU 116 3HB LEU 116 -32.076 -12.237 -21.902 929 HG LEU 116 HG LEU 116 -30.193 -12.245 -19.545 930 HD11 LEU 116 1HD1 LEU 116 -33.204 -12.377 -19.552 931 HD12 LEU 116 2HD1 LEU 116 -32.259 -10.954 -19.116 932 HD13 LEU 116 3HD1 LEU 116 -32.141 -12.421 -18.145 933 HD21 LEU 116 3HD2 LEU 116 -31.805 -14.448 -19.388 934 HD22 LEU 116 1HD2 LEU 116 -30.157 -14.431 -20.018 935 HD23 LEU 116 2HD2 LEU 116 -31.526 -14.312 -21.125 936 H GLU 117 H GLU 117 -30.184 -9.617 -22.632 937 HA GLU 117 HA GLU 117 -30.572 -9.811 -25.545 938 HB2 GLU 117 2HB GLU 117 -32.354 -8.764 -23.905 939 HB3 GLU 117 3HB GLU 117 -31.304 -7.358 -24.003 940 HG2 GLU 117 2HG GLU 117 -32.363 -8.730 -26.449 941 HG3 GLU 117 3HG GLU 117 -33.261 -7.465 -25.612 942 H1 GLY -9 H GLY -9 10.221 -10.503 16.207 943 HA2 GLY -9 2HA GLY -9 8.912 -11.616 13.967 944 HA3 GLY -9 3HA GLY -9 10.351 -10.763 13.427 945 H LYS -8 H LYS -8 10.769 -13.080 12.722 946 HA LYS -8 HA LYS -8 12.129 -14.524 14.902 947 HB2 LYS -8 2HB LYS -8 11.743 -16.595 13.612 948 HB3 LYS -8 3HB LYS -8 10.241 -15.815 14.090 949 HG2 LYS -8 2HG LYS -8 10.485 -14.714 11.693 950 HG3 LYS -8 3HG LYS -8 11.420 -16.182 11.396 951 HD2 LYS -8 2HD LYS -8 8.732 -16.354 12.698 952 HD3 LYS -8 3HD LYS -8 8.855 -16.168 10.947 953 HE2 LYS -8 2HE LYS -8 8.863 -18.442 11.075 954 HE3 LYS -8 3HE LYS -8 10.594 -18.146 11.234 955 HZ1 LYS -8 3HZ LYS -8 8.730 -19.205 13.156 956 HZ2 LYS -8 1HZ LYS -8 9.735 -17.999 13.785 957 HZ3 LYS -8 2HZ LYS -8 10.410 -19.376 13.071 958 H PHE -7 H PHE -7 12.273 -13.393 11.592 959 HA PHE -7 HA PHE -7 14.783 -14.593 10.969 960 HB2 PHE -7 2HB PHE -7 13.186 -12.370 9.706 961 HB3 PHE -7 3HB PHE -7 14.759 -12.862 9.085 962 HD1 PHE -7 HD2 PHE -7 11.427 -14.263 9.977 963 HD2 PHE -7 HD1 PHE -7 14.879 -14.534 7.502 964 HE1 PHE -7 HE2 PHE -7 10.347 -16.047 8.671 965 HE2 PHE -7 HE1 PHE -7 13.804 -16.317 6.191 966 HZ PHE -7 HZ PHE -7 11.536 -17.077 6.776 967 H ILE -6 H ILE -6 14.112 -11.105 11.063 968 HA ILE -6 HA ILE -6 15.418 -9.338 11.673 969 HB ILE -6 HB ILE -6 16.329 -11.135 13.919 970 HG12 ILE -6 2HG1 ILE -6 13.896 -11.216 13.781 971 HG13 ILE -6 3HG1 ILE -6 14.386 -10.259 15.175 972 HG21 ILE -6 1HG2 ILE -6 17.596 -9.196 14.037 973 HG22 ILE -6 2HG2 ILE -6 16.273 -8.177 13.470 974 HG23 ILE -6 3HG2 ILE -6 16.239 -8.839 15.104 975 HD11 ILE -6 3HD1 ILE -6 14.151 -8.341 13.275 976 HD12 ILE -6 1HD1 ILE -6 12.900 -9.481 12.780 977 HD13 ILE -6 2HD1 ILE -6 12.880 -8.801 14.407 978 HA PRO -5 HA PRO -5 19.216 -11.066 9.711 979 HB2 PRO -5 2HB PRO -5 19.430 -9.076 7.876 980 HB3 PRO -5 3HB PRO -5 18.420 -10.506 7.629 981 HG2 PRO -5 2HG PRO -5 17.630 -7.761 8.526 982 HG3 PRO -5 3HG PRO -5 16.827 -8.834 7.365 983 HD2 PRO -5 2HD PRO -5 15.981 -8.560 9.922 984 HD3 PRO -5 3HD PRO -5 15.821 -10.081 9.022 985 H SER -4 H SER -4 20.143 -10.443 11.823 986 HA SER -4 HA SER -4 21.122 -7.714 12.049 987 HB2 SER -4 2HB SER -4 20.268 -8.843 14.060 988 HB3 SER -4 3HB SER -4 21.498 -10.094 13.885 989 HG SER -4 HG SER -4 22.595 -8.789 15.130 990 H ARG -3 H ARG -3 22.078 -10.259 10.310 991 HA ARG -3 HA ARG -3 24.726 -10.783 10.853 992 HB2 ARG -3 2HB ARG -3 22.989 -10.928 8.504 993 HB3 ARG -3 3HB ARG -3 24.681 -10.676 8.097 994 HG2 ARG -3 2HG ARG -3 24.224 -13.024 8.107 995 HG3 ARG -3 3HG ARG -3 25.261 -12.643 9.483 996 HD2 ARG -3 2HD ARG -3 23.141 -12.511 10.864 997 HD3 ARG -3 3HD ARG -3 22.310 -13.225 9.484 998 HE ARG -3 HE ARG -3 24.080 -14.554 11.327 999 HH11 ARG -3 1HH1 ARG -3 22.638 -14.622 8.159 1000 HH12 ARG -3 2HH1 ARG -3 22.817 -16.335 7.971 1001 HH21 ARG -3 1HH2 ARG -3 24.321 -16.810 11.092 1002 HH22 ARG -3 2HH2 ARG -3 23.773 -17.579 9.641 1003 HA PRO -2 HA PRO -2 27.118 -7.201 10.019 1004 HB2 PRO -2 2HB PRO -2 29.252 -8.193 8.665 1005 HB3 PRO -2 3HB PRO -2 28.997 -8.470 10.392 1006 HG2 PRO -2 2HG PRO -2 28.401 -10.271 8.077 1007 HG3 PRO -2 3HG PRO -2 29.129 -10.668 9.645 1008 HD2 PRO -2 2HD PRO -2 26.523 -11.148 9.085 1009 HD3 PRO -2 3HD PRO -2 27.089 -10.735 10.717 1010 H ALA -1 H ALA -1 26.157 -9.175 7.314 1011 HA ALA -1 HA ALA -1 25.608 -8.672 5.163 1012 HB1 ALA -1 1HB ALA -1 25.823 -5.745 5.642 1013 HB2 ALA -1 2HB ALA -1 24.604 -6.661 4.753 1014 HB3 ALA -1 3HB ALA -1 24.588 -6.652 6.516 1015 HA PRO 0 HA PRO 0 30.005 -8.065 4.065 1016 HB2 PRO 0 2HB PRO 0 29.997 -9.973 2.134 1017 HB3 PRO 0 3HB PRO 0 30.227 -10.341 3.847 1018 HG2 PRO 0 2HG PRO 0 27.750 -10.555 2.180 1019 HG3 PRO 0 3HG PRO 0 28.388 -11.688 3.387 1020 HD2 PRO 0 2HD PRO 0 26.374 -9.961 3.930 1021 HD3 PRO 0 3HD PRO 0 27.554 -10.468 5.156 1022 H LYS 1 H LYS 1 30.988 -7.284 2.130 1023 HA LYS 1 HA LYS 1 29.112 -5.857 0.414 1024 HB2 LYS 1 2HB LYS 1 31.721 -5.332 1.456 1025 HB3 LYS 1 3HB LYS 1 31.809 -5.305 -0.301 1026 HG2 LYS 1 2HG LYS 1 29.508 -3.864 0.329 1027 HG3 LYS 1 3HG LYS 1 30.716 -3.357 1.513 1028 HD2 LYS 1 2HD LYS 1 31.886 -3.543 -1.112 1029 HD3 LYS 1 3HD LYS 1 30.464 -2.498 -1.141 1030 HE2 LYS 1 2HE LYS 1 31.400 -1.254 0.787 1031 HE3 LYS 1 3HE LYS 1 32.851 -2.250 0.686 1032 HZ1 LYS 1 3HZ LYS 1 32.787 -1.403 -1.786 1033 HZ2 LYS 1 1HZ LYS 1 33.498 -0.480 -0.558 1034 HZ3 LYS 1 2HZ LYS 1 31.934 -0.117 -1.092 1035 HA PRO 2 HA PRO 2 29.574 -8.497 -3.067 1036 HB2 PRO 2 2HB PRO 2 29.238 -6.712 -5.084 1037 HB3 PRO 2 3HB PRO 2 27.909 -7.263 -4.057 1038 HG2 PRO 2 2HG PRO 2 29.505 -4.736 -3.896 1039 HG3 PRO 2 3HG PRO 2 27.756 -4.967 -3.721 1040 HD2 PRO 2 2HD PRO 2 29.406 -4.676 -1.594 1041 HD3 PRO 2 3HD PRO 2 27.940 -5.676 -1.536 1042 HA PRO 3 HA PRO 3 33.658 -8.362 -4.691 1043 HB2 PRO 3 2HB PRO 3 33.320 -9.325 -7.207 1044 HB3 PRO 3 3HB PRO 3 33.196 -10.340 -5.765 1045 HG2 PRO 3 2HG PRO 3 31.018 -9.097 -7.398 1046 HG3 PRO 3 3HG PRO 3 31.110 -10.731 -6.715 1047 HD2 PRO 3 2HD PRO 3 29.672 -8.749 -5.561 1048 HD3 PRO 3 3HD PRO 3 30.465 -10.027 -4.618 1049 H SER 4 H SER 4 34.543 -6.403 -5.004 1050 HA SER 4 HA SER 4 33.527 -4.317 -6.526 1051 HB2 SER 4 2HB SER 4 36.491 -4.615 -6.278 1052 HB3 SER 4 3HB SER 4 35.485 -3.185 -6.047 1053 HG SER 4 HG SER 4 34.667 -4.365 -4.130 1054 H SER 5 H SER 5 35.749 -6.903 -7.443 1055 HA SER 5 HA SER 5 36.570 -6.017 -9.926 1056 HB2 SER 5 2HB SER 5 36.591 -8.547 -10.498 1057 HB3 SER 5 3HB SER 5 37.602 -7.980 -9.169 1058 HG SER 5 HG SER 5 36.556 -9.361 -7.996 1059 H ALA 6 H ALA 6 33.518 -7.476 -8.992 1060 HA ALA 6 HA ALA 6 32.572 -7.740 -11.699 1061 HB1 ALA 6 1HB ALA 6 31.793 -9.309 -10.046 1062 HB2 ALA 6 2HB ALA 6 31.142 -8.000 -9.058 1063 HB3 ALA 6 3HB ALA 6 30.428 -8.357 -10.631 Start of MODEL 14 1 H1 MET -2 H MET -2 0.246 -8.136 -2.963 2 HA MET -2 HA MET -2 0.389 -6.497 -5.394 3 HB2 MET -2 2HB MET -2 2.813 -6.681 -5.190 4 HB3 MET -2 3HB MET -2 2.112 -6.073 -3.696 5 HG2 MET -2 2HG MET -2 2.643 -7.941 -2.516 6 HG3 MET -2 3HG MET -2 2.542 -8.994 -3.925 7 HE1 MET -2 3HE MET -2 6.220 -9.672 -3.046 8 HE2 MET -2 1HE MET -2 4.810 -9.602 -1.989 9 HE3 MET -2 2HE MET -2 4.684 -10.359 -3.576 10 H ALA -1 H ALA -1 2.203 -7.590 -6.931 11 HA ALA -1 HA ALA -1 1.001 -10.131 -7.722 12 HB1 ALA -1 1HB ALA -1 1.434 -9.543 -9.835 13 HB2 ALA -1 2HB ALA -1 1.739 -7.935 -9.177 14 HB3 ALA -1 3HB ALA -1 3.082 -9.043 -9.457 15 HA PRO 1 HA PRO 1 4.375 -12.690 -6.573 16 HB2 PRO 1 2HB PRO 1 4.531 -14.419 -8.660 17 HB3 PRO 1 3HB PRO 1 3.218 -14.457 -7.477 18 HG2 PRO 1 2HG PRO 1 3.264 -13.254 -10.218 19 HG3 PRO 1 3HG PRO 1 1.991 -14.210 -9.437 20 HD2 PRO 1 2HD PRO 1 1.887 -11.510 -9.609 21 HD3 PRO 1 3HD PRO 1 1.196 -12.407 -8.242 22 H LEU 2 H LEU 2 6.430 -12.046 -6.519 23 HA LEU 2 HA LEU 2 7.782 -11.441 -9.067 24 HB2 LEU 2 2HB LEU 2 8.984 -9.722 -8.074 25 HB3 LEU 2 3HB LEU 2 7.363 -9.536 -7.410 26 HG LEU 2 HG LEU 2 8.671 -11.143 -5.564 27 HD11 LEU 2 1HD1 LEU 2 10.547 -9.204 -6.831 28 HD12 LEU 2 2HD1 LEU 2 10.849 -10.828 -6.215 29 HD13 LEU 2 3HD1 LEU 2 10.637 -9.485 -5.092 30 HD21 LEU 2 3HD2 LEU 2 8.629 -9.064 -4.181 31 HD22 LEU 2 1HD2 LEU 2 7.098 -9.446 -4.969 32 HD23 LEU 2 2HD2 LEU 2 8.134 -8.178 -5.624 33 H PHE 3 H PHE 3 10.054 -11.943 -9.176 34 HA PHE 3 HA PHE 3 11.023 -13.859 -7.184 35 HB2 PHE 3 2HB PHE 3 10.902 -14.370 -10.161 36 HB3 PHE 3 3HB PHE 3 11.812 -15.358 -9.023 37 HD1 PHE 3 HD2 PHE 3 8.404 -14.215 -9.902 38 HD2 PHE 3 HD1 PHE 3 10.771 -17.062 -7.803 39 HE1 PHE 3 HE2 PHE 3 6.393 -15.567 -9.477 40 HE2 PHE 3 HE1 PHE 3 8.764 -18.420 -7.375 41 HZ PHE 3 HZ PHE 3 6.571 -17.672 -8.211 42 H ALA 4 H ALA 4 13.362 -14.330 -7.454 43 HA ALA 4 HA ALA 4 14.818 -12.169 -8.812 44 HB1 ALA 4 1HB ALA 4 14.853 -12.850 -5.921 45 HB2 ALA 4 2HB ALA 4 16.370 -12.363 -6.679 46 HB3 ALA 4 3HB ALA 4 14.978 -11.281 -6.718 47 H VAL 5 H VAL 5 17.210 -12.648 -8.907 48 HA VAL 5 HA VAL 5 17.706 -15.544 -9.114 49 HB VAL 5 HB VAL 5 17.345 -14.678 -11.363 50 HG11 VAL 5 1HG1 VAL 5 18.103 -12.324 -10.694 51 HG12 VAL 5 2HG1 VAL 5 19.737 -12.897 -11.032 52 HG13 VAL 5 3HG1 VAL 5 18.521 -12.893 -12.310 53 HG21 VAL 5 3HG2 VAL 5 19.675 -16.012 -10.450 54 HG22 VAL 5 1HG2 VAL 5 18.874 -16.148 -12.015 55 HG23 VAL 5 2HG2 VAL 5 20.144 -14.948 -11.775 56 H THR 6 H THR 6 19.494 -16.222 -8.123 57 HA THR 6 HA THR 6 21.131 -14.394 -6.670 58 HB THR 6 HB THR 6 22.538 -16.665 -6.454 59 HG1 THR 6 HG1 THR 6 20.662 -18.297 -6.417 60 HG21 THR 6 3HG2 THR 6 20.335 -15.440 -5.022 61 HG22 THR 6 1HG2 THR 6 21.792 -16.210 -4.397 62 HG23 THR 6 2HG2 THR 6 20.376 -17.187 -4.787 63 H LEU 7 H LEU 7 23.167 -13.673 -7.066 64 HA LEU 7 HA LEU 7 24.335 -14.387 -9.674 65 HB2 LEU 7 2HB LEU 7 24.750 -11.826 -8.147 66 HB3 LEU 7 3HB LEU 7 25.281 -12.188 -9.788 67 HG LEU 7 HG LEU 7 22.375 -12.055 -9.016 68 HD11 LEU 7 1HD1 LEU 7 22.890 -9.883 -8.567 69 HD12 LEU 7 2HD1 LEU 7 22.681 -9.773 -10.314 70 HD13 LEU 7 3HD1 LEU 7 24.301 -9.879 -9.625 71 HD21 LEU 7 3HD2 LEU 7 23.601 -11.580 -11.710 72 HD22 LEU 7 1HD2 LEU 7 21.941 -12.018 -11.304 73 HD23 LEU 7 2HD2 LEU 7 23.232 -13.210 -11.147 74 H TYR 8 H TYR 8 24.769 -14.444 -6.312 75 HA TYR 8 HA TYR 8 27.542 -15.325 -6.675 76 HB2 TYR 8 2HB TYR 8 26.636 -13.466 -4.467 77 HB3 TYR 8 3HB TYR 8 28.258 -14.116 -4.677 78 HD1 TYR 8 HD2 TYR 8 25.723 -11.895 -6.226 79 HD2 TYR 8 HD1 TYR 8 29.819 -13.039 -6.076 80 HE1 TYR 8 HE2 TYR 8 26.309 -9.960 -7.626 81 HE2 TYR 8 HE1 TYR 8 30.416 -11.106 -7.475 82 HH TYR 8 HH TYR 8 29.333 -9.612 -9.110 83 H GLU 9 H GLU 9 28.335 -16.675 -4.923 84 HA GLU 9 HA GLU 9 26.258 -18.438 -3.956 85 HB2 GLU 9 2HB GLU 9 28.221 -19.489 -4.834 86 HB3 GLU 9 3HB GLU 9 29.270 -18.530 -3.799 87 HG2 GLU 9 2HG GLU 9 28.940 -19.850 -2.001 88 HG3 GLU 9 3HG GLU 9 27.268 -20.204 -2.429 89 H PHE 10 H PHE 10 25.161 -17.729 -2.229 90 HA PHE 10 HA PHE 10 26.523 -16.301 -0.096 91 HB2 PHE 10 2HB PHE 10 24.283 -15.573 -0.922 92 HB3 PHE 10 3HB PHE 10 23.608 -17.079 -0.307 93 HD1 PHE 10 HD2 PHE 10 25.628 -14.165 0.844 94 HD2 PHE 10 HD1 PHE 10 22.690 -17.093 1.799 95 HE1 PHE 10 HE2 PHE 10 25.298 -13.112 3.043 96 HE2 PHE 10 HE1 PHE 10 22.355 -16.044 3.999 97 HZ PHE 10 HZ PHE 10 23.661 -14.052 4.625 98 H LYS 11 H LYS 11 27.689 -17.597 1.195 99 HA LYS 11 HA LYS 11 26.829 -20.258 1.876 100 HB2 LYS 11 2HB LYS 11 29.170 -18.552 2.706 101 HB3 LYS 11 3HB LYS 11 28.869 -20.132 3.417 102 HG2 LYS 11 2HG LYS 11 29.523 -21.244 1.565 103 HG3 LYS 11 3HG LYS 11 28.901 -20.008 0.469 104 HD2 LYS 11 2HD LYS 11 30.833 -18.802 0.516 105 HD3 LYS 11 3HD LYS 11 31.215 -19.275 2.173 106 HE2 LYS 11 2HE LYS 11 31.452 -21.047 -0.257 107 HE3 LYS 11 3HE LYS 11 32.791 -20.228 0.545 108 HZ1 LYS 11 3HZ LYS 11 32.919 -21.853 2.026 109 HZ2 LYS 11 1HZ LYS 11 31.773 -22.721 1.135 110 HZ3 LYS 11 2HZ LYS 11 31.276 -21.729 2.411 111 H ALA 12 H ALA 12 25.258 -20.579 3.304 112 HA ALA 12 HA ALA 12 24.497 -18.646 5.256 113 HB1 ALA 12 1HB ALA 12 22.669 -19.860 4.677 114 HB2 ALA 12 2HB ALA 12 23.587 -21.351 4.462 115 HB3 ALA 12 3HB ALA 12 23.168 -20.799 6.084 116 H GLU 13 H GLU 13 24.327 -19.150 7.595 117 HA GLU 13 HA GLU 13 26.688 -20.650 8.525 118 HB2 GLU 13 2HB GLU 13 26.815 -19.055 10.406 119 HB3 GLU 13 3HB GLU 13 27.027 -18.271 8.847 120 HG2 GLU 13 2HG GLU 13 24.840 -17.359 8.911 121 HG3 GLU 13 3HG GLU 13 24.402 -18.343 10.306 122 H ARG 14 H ARG 14 23.317 -19.884 9.024 123 HA ARG 14 HA ARG 14 23.110 -22.181 10.831 124 HB2 ARG 14 2HB ARG 14 21.895 -19.464 11.367 125 HB3 ARG 14 3HB ARG 14 21.560 -20.921 12.294 126 HG2 ARG 14 2HG ARG 14 24.380 -20.011 12.001 127 HG3 ARG 14 3HG ARG 14 23.313 -19.173 13.129 128 HD2 ARG 14 2HD ARG 14 23.658 -22.161 13.128 129 HD3 ARG 14 3HD ARG 14 24.690 -21.085 14.070 130 HE ARG 14 HE ARG 14 21.952 -21.793 14.621 131 HH11 ARG 14 1HH1 ARG 14 24.502 -19.487 15.169 132 HH12 ARG 14 2HH1 ARG 14 23.829 -18.899 16.653 133 HH21 ARG 14 1HH2 ARG 14 21.056 -21.028 16.574 134 HH22 ARG 14 2HH2 ARG 14 21.869 -19.777 17.452 135 H ASP 15 H ASP 15 20.511 -22.282 11.358 136 HA ASP 15 HA ASP 15 19.356 -23.142 8.932 137 HB2 ASP 15 2HB ASP 15 17.937 -22.548 11.537 138 HB3 ASP 15 3HB ASP 15 17.355 -23.582 10.235 139 H ASP 16 H ASP 16 18.949 -20.212 10.857 140 HA ASP 16 HA ASP 16 16.758 -19.094 9.578 141 HB2 ASP 16 2HB ASP 16 17.910 -16.863 10.205 142 HB3 ASP 16 3HB ASP 16 17.469 -17.970 11.501 143 H GLU 17 H GLU 17 20.046 -19.403 8.499 144 HA GLU 17 HA GLU 17 19.666 -17.546 6.295 145 HB2 GLU 17 2HB GLU 17 22.014 -19.286 7.066 146 HB3 GLU 17 3HB GLU 17 22.008 -18.167 5.711 147 HG2 GLU 17 2HG GLU 17 21.953 -17.568 8.640 148 HG3 GLU 17 3HG GLU 17 23.084 -17.005 7.411 149 H LEU 18 H LEU 18 20.791 -18.537 4.154 150 HA LEU 18 HA LEU 18 19.863 -21.235 3.620 151 HB2 LEU 18 2HB LEU 18 17.884 -19.846 3.227 152 HB3 LEU 18 3HB LEU 18 18.805 -18.861 2.093 153 HG LEU 18 HG LEU 18 19.033 -20.819 0.614 154 HD11 LEU 18 1HD1 LEU 18 17.271 -22.672 1.219 155 HD12 LEU 18 2HD1 LEU 18 17.604 -22.136 2.866 156 HD13 LEU 18 3HD1 LEU 18 18.916 -22.737 1.852 157 HD21 LEU 18 3HD2 LEU 18 17.032 -20.452 -0.388 158 HD22 LEU 18 1HD2 LEU 18 16.962 -19.147 0.797 159 HD23 LEU 18 2HD2 LEU 18 16.118 -20.664 1.106 160 H ASP 19 H ASP 19 21.353 -22.221 2.440 161 HA ASP 19 HA ASP 19 23.452 -20.706 1.170 162 HB2 ASP 19 2HB ASP 19 24.038 -22.740 2.355 163 HB3 ASP 19 3HB ASP 19 22.948 -23.683 1.342 164 H VAL 20 H VAL 20 23.501 -20.078 -0.881 165 HA VAL 20 HA VAL 20 22.012 -21.602 -2.893 166 HB VAL 20 HB VAL 20 20.613 -19.662 -2.127 167 HG11 VAL 20 1HG1 VAL 20 22.658 -18.169 -1.836 168 HG12 VAL 20 2HG1 VAL 20 22.589 -17.931 -3.583 169 HG13 VAL 20 3HG1 VAL 20 21.230 -17.441 -2.572 170 HG21 VAL 20 3HG2 VAL 20 21.490 -19.426 -4.999 171 HG22 VAL 20 1HG2 VAL 20 20.475 -20.735 -4.393 172 HG23 VAL 20 2HG2 VAL 20 19.902 -19.069 -4.321 173 H SER 21 H SER 21 22.729 -21.252 -5.067 174 HA SER 21 HA SER 21 25.494 -20.246 -5.193 175 HB2 SER 21 2HB SER 21 24.121 -22.573 -6.449 176 HB3 SER 21 3HB SER 21 25.379 -21.766 -7.386 177 HG SER 21 HG SER 21 26.645 -22.003 -5.326 178 HA PRO 22 HA PRO 22 24.432 -17.214 -8.179 179 HB2 PRO 22 2HB PRO 22 26.565 -17.287 -9.857 180 HB3 PRO 22 3HB PRO 22 26.652 -16.622 -8.221 181 HG2 PRO 22 2HG PRO 22 27.487 -19.319 -9.216 182 HG3 PRO 22 3HG PRO 22 28.325 -18.232 -8.094 183 HD2 PRO 22 2HD PRO 22 26.884 -20.365 -7.253 184 HD3 PRO 22 3HD PRO 22 27.022 -18.871 -6.303 185 H GLY 23 H GLY 23 22.903 -17.363 -9.690 186 HA2 GLY 23 2HA GLY 23 22.382 -17.773 -12.020 187 HA3 GLY 23 3HA GLY 23 23.317 -19.257 -11.913 188 H GLU 24 H GLU 24 21.705 -19.168 -9.098 189 HA GLU 24 HA GLU 24 19.677 -21.007 -10.083 190 HB2 GLU 24 2HB GLU 24 20.736 -20.321 -7.355 191 HB3 GLU 24 3HB GLU 24 19.248 -21.238 -7.541 192 HG2 GLU 24 2HG GLU 24 21.795 -22.090 -8.867 193 HG3 GLU 24 3HG GLU 24 21.416 -22.534 -7.204 194 H ASN 25 H ASN 25 17.469 -20.766 -9.773 195 HA ASN 25 HA ASN 25 16.567 -18.015 -9.591 196 HB2 ASN 25 2HB ASN 25 15.083 -20.580 -10.198 197 HB3 ASN 25 3HB ASN 25 14.352 -18.978 -10.221 198 HD21 ASN 25 1HD2 ASN 25 14.076 -18.299 -12.208 199 HD22 ASN 25 2HD2 ASN 25 15.172 -18.519 -13.526 200 H LEU 26 H LEU 26 15.222 -17.176 -8.040 201 HA LEU 26 HA LEU 26 14.325 -18.898 -5.861 202 HB2 LEU 26 2HB LEU 26 16.062 -16.465 -5.478 203 HB3 LEU 26 3HB LEU 26 15.202 -17.292 -4.181 204 HG LEU 26 HG LEU 26 16.603 -19.359 -5.131 205 HD11 LEU 26 1HD1 LEU 26 18.739 -18.779 -5.918 206 HD12 LEU 26 2HD1 LEU 26 18.508 -17.073 -5.537 207 HD13 LEU 26 3HD1 LEU 26 17.615 -17.807 -6.868 208 HD21 LEU 26 3HD2 LEU 26 18.420 -17.991 -3.464 209 HD22 LEU 26 1HD2 LEU 26 17.252 -19.234 -3.015 210 HD23 LEU 26 2HD2 LEU 26 16.797 -17.532 -2.946 211 H SER 27 H SER 27 12.637 -18.001 -4.598 212 HA SER 27 HA SER 27 11.242 -15.791 -5.948 213 HB2 SER 27 2HB SER 27 10.109 -18.044 -5.826 214 HB3 SER 27 3HB SER 27 10.035 -17.838 -4.077 215 HG SER 27 HG SER 27 8.141 -17.038 -4.781 216 H ILE 28 H ILE 28 11.026 -13.916 -4.928 217 HA ILE 28 HA ILE 28 11.932 -13.668 -2.185 218 HB ILE 28 HB ILE 28 10.990 -11.564 -4.137 219 HG12 ILE 28 2HG1 ILE 28 13.758 -12.385 -3.231 220 HG13 ILE 28 3HG1 ILE 28 13.072 -12.621 -4.835 221 HG21 ILE 28 1HG2 ILE 28 11.928 -9.944 -2.565 222 HG22 ILE 28 2HG2 ILE 28 10.623 -10.872 -1.829 223 HG23 ILE 28 3HG2 ILE 28 12.301 -11.249 -1.439 224 HD11 ILE 28 3HD1 ILE 28 14.625 -10.754 -4.792 225 HD12 ILE 28 1HD1 ILE 28 12.988 -10.211 -5.159 226 HD13 ILE 28 2HD1 ILE 28 13.658 -9.966 -3.546 227 H CYS 29 H CYS 29 10.709 -12.981 -0.453 228 HA CYS 29 HA CYS 29 7.793 -13.071 -0.853 229 HB2 CYS 29 2HB CYS 29 9.273 -13.647 1.716 230 HB3 CYS 29 3HB CYS 29 7.573 -13.944 1.373 231 HG CYS 29 HG CYS 29 7.843 -16.204 0.058 232 H ALA 30 H ALA 30 10.433 -11.413 0.784 233 HA ALA 30 HA ALA 30 8.987 -8.945 0.792 234 HB1 ALA 30 1HB ALA 30 9.544 -8.991 3.480 235 HB2 ALA 30 2HB ALA 30 7.952 -9.216 2.753 236 HB3 ALA 30 3HB ALA 30 8.934 -10.618 3.178 237 H HIS 31 H HIS 31 10.303 -7.273 2.185 238 HA HIS 31 HA HIS 31 13.174 -7.842 1.852 239 HB2 HIS 31 2HB HIS 31 13.564 -5.697 0.918 240 HB3 HIS 31 3HB HIS 31 12.171 -6.344 0.057 241 HD1 HIS 31 HD1 HIS 31 13.225 -3.272 1.201 242 HD2 HIS 31 HD2 HIS 31 9.700 -5.395 1.775 243 HE1 HIS 31 HE1 HIS 31 11.504 -1.556 1.846 244 H TYR 32 H TYR 32 14.440 -5.897 2.959 245 HA TYR 32 HA TYR 32 13.167 -5.175 5.493 246 HB2 TYR 32 2HB TYR 32 14.473 -7.338 5.742 247 HB3 TYR 32 3HB TYR 32 15.925 -6.401 5.414 248 HD1 TYR 32 HD1 TYR 32 13.109 -6.814 7.779 249 HD2 TYR 32 HD2 TYR 32 16.936 -5.082 7.104 250 HE1 TYR 32 HE1 TYR 32 13.253 -6.218 10.161 251 HE2 TYR 32 HE2 TYR 32 17.091 -4.482 9.484 252 HH TYR 32 HH TYR 32 14.521 -4.417 11.534 253 H ASP 33 H ASP 33 13.186 -3.017 5.134 254 HA ASP 33 HA ASP 33 13.965 -0.895 4.857 255 HB2 ASP 33 2HB ASP 33 16.444 -2.177 6.023 256 HB3 ASP 33 3HB ASP 33 16.231 -0.440 5.820 257 H TYR 34 H TYR 34 14.348 -2.920 2.682 258 HA TYR 34 HA TYR 34 15.180 -2.968 0.566 259 HB2 TYR 34 2HB TYR 34 16.255 -0.201 1.131 260 HB3 TYR 34 3HB TYR 34 15.921 -0.911 -0.444 261 HD1 TYR 34 HD2 TYR 34 14.443 0.604 2.549 262 HD2 TYR 34 HD1 TYR 34 13.653 -1.062 -1.286 263 HE1 TYR 34 HE2 TYR 34 12.170 1.541 2.617 264 HE2 TYR 34 HE1 TYR 34 11.378 -0.129 -1.229 265 HH TYR 34 HH TYR 34 10.298 2.005 0.100 266 H GLU 35 H GLU 35 16.882 -3.447 3.111 267 HA GLU 35 HA GLU 35 19.538 -3.272 1.872 268 HB2 GLU 35 2HB GLU 35 18.992 -4.060 4.724 269 HB3 GLU 35 3HB GLU 35 20.479 -3.432 4.029 270 HG2 GLU 35 2HG GLU 35 17.929 -1.923 4.536 271 HG3 GLU 35 3HG GLU 35 19.474 -1.726 5.362 272 H TRP 36 H TRP 36 17.456 -5.551 3.638 273 HA TRP 36 HA TRP 36 18.973 -7.755 2.402 274 HB2 TRP 36 2HB TRP 36 17.434 -7.698 5.006 275 HB3 TRP 36 3HB TRP 36 18.147 -9.147 4.303 276 HD1 TRP 36 HD1 TRP 36 19.212 -5.751 5.798 277 HE1 TRP 36 HE1 TRP 36 21.609 -5.991 6.705 278 HE3 TRP 36 HE3 TRP 36 20.222 -10.494 4.180 279 HZ2 TRP 36 HZ2 TRP 36 23.657 -7.933 6.730 280 HZ3 TRP 36 HZ3 TRP 36 22.423 -11.470 4.686 281 HH2 TRP 36 HH2 TRP 36 24.104 -10.214 5.935 282 H PHE 37 H PHE 37 17.854 -9.471 1.480 283 HA PHE 37 HA PHE 37 14.974 -9.009 1.060 284 HB2 PHE 37 2HB PHE 37 17.130 -9.365 -0.842 285 HB3 PHE 37 3HB PHE 37 15.888 -10.593 -1.058 286 HD1 PHE 37 HD1 PHE 37 13.406 -9.332 -0.596 287 HD2 PHE 37 HD2 PHE 37 16.902 -7.692 -2.386 288 HE1 PHE 37 HE1 PHE 37 12.016 -7.712 -1.818 289 HE2 PHE 37 HE2 PHE 37 15.518 -6.068 -3.611 290 HZ PHE 37 HZ PHE 37 13.071 -6.076 -3.327 291 H ILE 38 H ILE 38 13.613 -10.822 0.956 292 HA ILE 38 HA ILE 38 14.752 -13.234 2.200 293 HB ILE 38 HB ILE 38 11.827 -12.529 2.145 294 HG12 ILE 38 2HG1 ILE 38 12.974 -10.667 3.216 295 HG13 ILE 38 3HG1 ILE 38 12.127 -11.621 4.429 296 HG21 ILE 38 1HG2 ILE 38 12.179 -13.921 4.389 297 HG22 ILE 38 2HG2 ILE 38 11.885 -14.691 2.831 298 HG23 ILE 38 3HG2 ILE 38 13.529 -14.566 3.456 299 HD11 ILE 38 3HD1 ILE 38 14.365 -10.896 5.145 300 HD12 ILE 38 1HD1 ILE 38 14.187 -12.650 5.119 301 HD13 ILE 38 2HD1 ILE 38 15.066 -11.833 3.826 302 H ALA 39 H ALA 39 15.345 -14.434 0.439 303 HA ALA 39 HA ALA 39 13.281 -15.006 -1.575 304 HB1 ALA 39 1HB ALA 39 15.012 -15.634 -3.071 305 HB2 ALA 39 2HB ALA 39 15.517 -14.122 -2.317 306 HB3 ALA 39 3HB ALA 39 16.213 -15.650 -1.779 307 H LYS 40 H LYS 40 13.172 -17.243 -2.385 308 HA LYS 40 HA LYS 40 13.976 -19.262 -0.414 309 HB2 LYS 40 2HB LYS 40 11.867 -20.073 -0.057 310 HB3 LYS 40 3HB LYS 40 11.475 -18.379 -0.320 311 HG2 LYS 40 2HG LYS 40 11.002 -18.910 -2.696 312 HG3 LYS 40 3HG LYS 40 11.265 -20.615 -2.324 313 HD2 LYS 40 2HD LYS 40 9.387 -19.245 -0.531 314 HD3 LYS 40 3HD LYS 40 8.855 -19.353 -2.211 315 HE2 LYS 40 2HE LYS 40 9.888 -21.726 -0.680 316 HE3 LYS 40 3HE LYS 40 8.188 -21.262 -0.673 317 HZ1 LYS 40 3HZ LYS 40 8.914 -22.984 -2.365 318 HZ2 LYS 40 1HZ LYS 40 9.664 -21.714 -3.194 319 HZ3 LYS 40 2HZ LYS 40 7.992 -21.690 -2.945 320 HA PRO 41 HA PRO 41 15.106 -21.735 -3.858 321 HB2 PRO 41 2HB PRO 41 14.501 -24.233 -2.983 322 HB3 PRO 41 3HB PRO 41 15.864 -23.299 -2.356 323 HG2 PRO 41 2HG PRO 41 13.137 -23.690 -1.185 324 HG3 PRO 41 3HG PRO 41 14.716 -23.719 -0.378 325 HD2 PRO 41 2HD PRO 41 13.079 -21.563 -0.300 326 HD3 PRO 41 3HD PRO 41 14.849 -21.420 -0.280 327 H ILE 42 H ILE 42 14.184 -22.158 -5.764 328 HA ILE 42 HA ILE 42 11.312 -22.359 -5.961 329 HB ILE 42 HB ILE 42 13.348 -22.543 -8.182 330 HG12 ILE 42 2HG1 ILE 42 13.551 -20.443 -6.861 331 HG13 ILE 42 3HG1 ILE 42 13.028 -20.165 -8.519 332 HG21 ILE 42 1HG2 ILE 42 11.124 -23.376 -8.761 333 HG22 ILE 42 2HG2 ILE 42 10.413 -21.855 -8.225 334 HG23 ILE 42 3HG2 ILE 42 11.492 -21.881 -9.619 335 HD11 ILE 42 3HD1 ILE 42 10.721 -19.938 -7.742 336 HD12 ILE 42 1HD1 ILE 42 11.264 -20.187 -6.083 337 HD13 ILE 42 2HD1 ILE 42 11.796 -18.766 -6.981 338 H ASN 43 H ASN 43 14.096 -24.424 -6.729 339 HA ASN 43 HA ASN 43 12.243 -26.689 -7.052 340 HB2 ASN 43 2HB ASN 43 15.119 -26.761 -7.912 341 HB3 ASN 43 3HB ASN 43 13.755 -27.692 -8.524 342 HD21 ASN 43 1HD2 ASN 43 11.968 -26.213 -9.451 343 HD22 ASN 43 2HD2 ASN 43 12.523 -24.988 -10.536 344 H ARG 43 H ARG 43 15.330 -25.724 -5.601 345 HA ARG 43 HA ARG 43 16.016 -28.062 -4.308 346 HB2 ARG 43 2HB ARG 43 16.339 -25.303 -3.122 347 HB3 ARG 43 3HB ARG 43 17.329 -26.721 -2.806 348 HG2 ARG 43 2HG ARG 43 17.334 -26.193 -5.609 349 HG3 ARG 43 3HG ARG 43 17.727 -24.712 -4.734 350 HD2 ARG 43 2HD ARG 43 19.550 -25.749 -3.624 351 HD3 ARG 43 3HD ARG 43 19.052 -27.352 -4.163 352 HE ARG 43 HE ARG 43 19.506 -26.046 -6.483 353 HH11 ARG 43 1HH1 ARG 43 21.387 -26.480 -3.586 354 HH12 ARG 43 2HH1 ARG 43 22.911 -26.409 -4.408 355 HH21 ARG 43 1HH2 ARG 43 21.505 -25.951 -7.577 356 HH22 ARG 43 2HH2 ARG 43 22.977 -26.107 -6.678 357 H LEU 44 H LEU 44 15.970 -28.367 -1.854 358 HA LEU 44 HA LEU 44 13.379 -28.897 -1.021 359 HB2 LEU 44 2HB LEU 44 15.970 -28.602 0.453 360 HB3 LEU 44 3HB LEU 44 14.471 -28.928 1.320 361 HG LEU 44 HG LEU 44 14.206 -31.008 0.012 362 HD11 LEU 44 1HD1 LEU 44 15.369 -30.529 -1.994 363 HD12 LEU 44 2HD1 LEU 44 16.257 -31.826 -1.195 364 HD13 LEU 44 3HD1 LEU 44 16.862 -30.171 -1.126 365 HD21 LEU 44 3HD2 LEU 44 15.627 -32.255 1.342 366 HD22 LEU 44 1HD2 LEU 44 15.512 -30.740 2.239 367 HD23 LEU 44 2HD2 LEU 44 16.931 -31.070 1.243 368 H GLY 45 H GLY 45 11.776 -27.604 -0.425 369 HA2 GLY 45 2HA GLY 45 11.826 -24.873 -0.242 370 HA3 GLY 45 3HA GLY 45 10.645 -25.874 0.590 371 H GLY 46 H GLY 46 12.831 -23.492 1.050 372 HA2 GLY 46 2HA GLY 46 12.661 -23.528 3.846 373 HA3 GLY 46 3HA GLY 46 14.199 -24.249 3.394 374 HA PRO 47 HA PRO 47 14.169 -19.600 1.956 375 HB2 PRO 47 2HB PRO 47 12.405 -18.025 3.289 376 HB3 PRO 47 3HB PRO 47 12.014 -18.826 1.763 377 HG2 PRO 47 2HG PRO 47 11.331 -19.643 4.561 378 HG3 PRO 47 3HG PRO 47 10.313 -19.665 3.110 379 HD2 PRO 47 2HD PRO 47 11.514 -21.889 4.081 380 HD3 PRO 47 3HD PRO 47 11.226 -21.640 2.347 381 H GLY 48 H GLY 48 15.655 -18.256 2.848 382 HA2 GLY 48 2HA GLY 48 15.913 -18.293 5.792 383 HA3 GLY 48 3HA GLY 48 17.308 -18.437 4.733 384 H LEU 49 H LEU 49 18.314 -16.631 4.070 385 HA LEU 49 HA LEU 49 16.985 -14.101 3.880 386 HB2 LEU 49 2HB LEU 49 17.838 -14.750 6.400 387 HB3 LEU 49 3HB LEU 49 19.209 -13.845 5.763 388 HG LEU 49 HG LEU 49 16.449 -12.703 5.585 389 HD11 LEU 49 1HD1 LEU 49 17.337 -11.512 7.799 390 HD12 LEU 49 2HD1 LEU 49 18.073 -13.098 8.025 391 HD13 LEU 49 3HD1 LEU 49 16.326 -12.957 7.831 392 HD21 LEU 49 3HD2 LEU 49 19.211 -11.516 5.832 393 HD22 LEU 49 1HD2 LEU 49 17.709 -10.595 5.735 394 HD23 LEU 49 2HD2 LEU 49 18.224 -11.588 4.371 395 H VAL 50 H VAL 50 17.927 -13.021 2.282 396 HA VAL 50 HA VAL 50 20.815 -13.326 1.850 397 HB VAL 50 HB VAL 50 19.707 -14.850 0.282 398 HG11 VAL 50 1HG1 VAL 50 18.369 -12.408 -0.872 399 HG12 VAL 50 2HG1 VAL 50 18.188 -14.080 -1.406 400 HG13 VAL 50 3HG1 VAL 50 17.565 -13.583 0.168 401 HG21 VAL 50 3HG2 VAL 50 20.678 -13.939 -1.807 402 HG22 VAL 50 1HG2 VAL 50 20.902 -12.391 -0.991 403 HG23 VAL 50 2HG2 VAL 50 21.770 -13.819 -0.427 404 HA PRO 51 HA PRO 51 20.570 -8.915 1.624 405 HB2 PRO 51 2HB PRO 51 23.089 -8.474 0.712 406 HB3 PRO 51 3HB PRO 51 22.737 -8.919 2.387 407 HG2 PRO 51 2HG PRO 51 23.668 -10.644 0.124 408 HG3 PRO 51 3HG PRO 51 24.207 -10.627 1.813 409 HD2 PRO 51 2HD PRO 51 22.465 -12.467 0.858 410 HD3 PRO 51 3HD PRO 51 22.408 -11.876 2.531 411 H VAL 52 H VAL 52 20.153 -7.370 0.099 412 HA VAL 52 HA VAL 52 19.407 -8.132 -2.481 413 HB VAL 52 HB VAL 52 20.162 -5.327 -1.665 414 HG11 VAL 52 1HG1 VAL 52 19.646 -5.016 -3.832 415 HG12 VAL 52 2HG1 VAL 52 18.779 -6.548 -3.953 416 HG13 VAL 52 3HG1 VAL 52 17.982 -5.135 -3.261 417 HG21 VAL 52 3HG2 VAL 52 18.558 -5.409 -0.126 418 HG22 VAL 52 1HG2 VAL 52 17.394 -5.654 -1.429 419 HG23 VAL 52 2HG2 VAL 52 18.107 -7.044 -0.610 420 H SER 53 H SER 53 22.487 -7.270 -1.210 421 HA SER 53 HA SER 53 23.669 -6.511 -3.715 422 HB2 SER 53 2HB SER 53 24.768 -7.100 -0.973 423 HB3 SER 53 3HB SER 53 25.836 -6.827 -2.350 424 HG SER 53 HG SER 53 25.435 -4.888 -1.240 425 H TYR 54 H TYR 54 22.605 -9.403 -2.589 426 HA TYR 54 HA TYR 54 24.575 -10.882 -4.205 427 HB2 TYR 54 2HB TYR 54 23.342 -11.613 -1.559 428 HB3 TYR 54 3HB TYR 54 23.971 -12.848 -2.644 429 HD1 TYR 54 HD1 TYR 54 25.094 -9.543 -1.288 430 HD2 TYR 54 HD2 TYR 54 26.103 -13.577 -2.187 431 HE1 TYR 54 HE1 TYR 54 27.353 -9.171 -0.390 432 HE2 TYR 54 HE2 TYR 54 28.365 -13.217 -1.291 433 HH TYR 54 HH TYR 54 29.510 -10.049 -0.413 434 H VAL 55 H VAL 55 21.868 -9.687 -4.763 435 HA VAL 55 HA VAL 55 20.819 -11.964 -6.198 436 HB VAL 55 HB VAL 55 18.452 -11.410 -5.298 437 HG11 VAL 55 1HG1 VAL 55 20.327 -12.870 -3.448 438 HG12 VAL 55 2HG1 VAL 55 18.606 -13.169 -3.702 439 HG13 VAL 55 3HG1 VAL 55 19.764 -13.528 -4.983 440 HG21 VAL 55 3HG2 VAL 55 19.778 -9.536 -3.846 441 HG22 VAL 55 1HG2 VAL 55 18.203 -10.204 -3.418 442 HG23 VAL 55 2HG2 VAL 55 19.667 -10.856 -2.683 443 H ARG 56 H ARG 56 19.260 -11.379 -7.806 444 HA ARG 56 HA ARG 56 19.189 -8.489 -8.378 445 HB2 ARG 56 2HB ARG 56 20.664 -9.466 -9.972 446 HB3 ARG 56 3HB ARG 56 19.573 -10.816 -10.256 447 HG2 ARG 56 2HG ARG 56 17.952 -9.259 -11.265 448 HG3 ARG 56 3HG ARG 56 19.111 -7.947 -11.041 449 HD2 ARG 56 2HD ARG 56 19.344 -10.361 -12.816 450 HD3 ARG 56 3HD ARG 56 19.357 -8.660 -13.279 451 HE ARG 56 HE ARG 56 21.581 -10.218 -12.351 452 HH11 ARG 56 1HH1 ARG 56 20.259 -7.008 -12.614 453 HH12 ARG 56 2HH1 ARG 56 21.803 -6.225 -12.551 454 HH21 ARG 56 1HH2 ARG 56 23.621 -9.199 -12.268 455 HH22 ARG 56 2HH2 ARG 56 23.715 -7.473 -12.355 456 H ILE 57 H ILE 57 17.236 -7.619 -8.637 457 HA ILE 57 HA ILE 57 14.892 -9.250 -8.358 458 HB ILE 57 HB ILE 57 15.111 -6.291 -8.925 459 HG12 ILE 57 2HG1 ILE 57 16.180 -6.990 -6.802 460 HG13 ILE 57 3HG1 ILE 57 14.758 -5.986 -6.536 461 HG21 ILE 57 1HG2 ILE 57 12.830 -8.123 -8.508 462 HG22 ILE 57 2HG2 ILE 57 12.757 -6.567 -7.682 463 HG23 ILE 57 3HG2 ILE 57 12.931 -6.626 -9.436 464 HD11 ILE 57 3HD1 ILE 57 14.100 -8.802 -6.579 465 HD12 ILE 57 1HD1 ILE 57 15.309 -8.417 -5.354 466 HD13 ILE 57 2HD1 ILE 57 13.758 -7.576 -5.359 467 H ILE 58 H ILE 58 14.152 -10.393 -10.023 468 HA ILE 58 HA ILE 58 13.963 -9.061 -12.644 469 HB ILE 58 HB ILE 58 14.224 -11.308 -13.695 470 HG12 ILE 58 2HG1 ILE 58 15.459 -12.283 -11.150 471 HG13 ILE 58 3HG1 ILE 58 13.714 -12.405 -11.350 472 HG21 ILE 58 1HG2 ILE 58 16.365 -10.790 -14.006 473 HG22 ILE 58 2HG2 ILE 58 16.159 -9.549 -12.770 474 HG23 ILE 58 3HG2 ILE 58 16.766 -11.144 -12.326 475 HD11 ILE 58 3HD1 ILE 58 15.810 -13.613 -13.138 476 HD12 ILE 58 1HD1 ILE 58 14.774 -14.468 -11.995 477 HD13 ILE 58 2HD1 ILE 58 14.070 -13.691 -13.414 478 H ASP 59 H ASP 59 12.438 -10.629 -14.076 479 HA ASP 59 HA ASP 59 10.037 -11.178 -12.461 480 HB2 ASP 59 2HB ASP 59 10.234 -9.738 -15.107 481 HB3 ASP 59 3HB ASP 59 8.721 -10.386 -14.481 482 H LEU 60 H LEU 60 9.293 -13.178 -12.674 483 HA LEU 60 HA LEU 60 10.492 -15.141 -14.226 484 HB2 LEU 60 2HB LEU 60 8.280 -14.942 -12.431 485 HB3 LEU 60 3HB LEU 60 7.797 -15.899 -13.830 486 HG LEU 60 HG LEU 60 8.661 -17.212 -11.880 487 HD11 LEU 60 1HD1 LEU 60 8.657 -17.982 -14.280 488 HD12 LEU 60 2HD1 LEU 60 9.819 -18.780 -13.221 489 HD13 LEU 60 3HD1 LEU 60 10.361 -17.530 -14.341 490 HD21 LEU 60 3HD2 LEU 60 11.449 -16.786 -12.529 491 HD22 LEU 60 1HD2 LEU 60 10.646 -16.811 -10.959 492 HD23 LEU 60 2HD2 LEU 60 10.690 -15.321 -11.903 493 H MET 61 H MET 61 8.018 -12.857 -15.051 494 HA MET 61 HA MET 61 7.306 -14.271 -17.493 495 HB2 MET 61 2HB MET 61 6.240 -11.937 -15.996 496 HB3 MET 61 3HB MET 61 5.988 -11.952 -17.736 497 HG2 MET 61 2HG MET 61 4.080 -12.906 -16.644 498 HG3 MET 61 3HG MET 61 4.930 -14.164 -17.537 499 HE1 MET 61 3HE MET 61 4.946 -13.592 -12.984 500 HE2 MET 61 1HE MET 61 6.276 -12.874 -13.894 501 HE3 MET 61 2HE MET 61 4.616 -12.369 -14.212 502 H ASP 62 H ASP 62 9.343 -11.684 -16.430 503 HA ASP 62 HA ASP 62 10.405 -11.419 -19.127 504 HB2 ASP 62 2HB ASP 62 9.494 -9.005 -17.546 505 HB3 ASP 62 3HB ASP 62 10.291 -8.981 -19.116 506 HA PRO 63 HA PRO 63 13.604 -11.519 -15.772 507 HB2 PRO 63 2HB PRO 63 15.178 -13.350 -17.013 508 HB3 PRO 63 3HB PRO 63 13.826 -13.798 -15.965 509 HG2 PRO 63 2HG PRO 63 13.943 -13.664 -18.954 510 HG3 PRO 63 3HG PRO 63 13.210 -14.902 -17.917 511 HD2 PRO 63 2HD PRO 63 11.754 -12.967 -19.130 512 HD3 PRO 63 3HD PRO 63 11.309 -13.649 -17.552 513 H ALA 64 H ALA 64 13.420 -10.670 -19.045 514 HA ALA 64 HA ALA 64 16.195 -9.726 -19.135 515 HB1 ALA 64 1HB ALA 64 16.138 -10.047 -21.342 516 HB2 ALA 64 2HB ALA 64 14.643 -10.938 -21.052 517 HB3 ALA 64 3HB ALA 64 14.581 -9.235 -21.508 518 H LYS 65 H LYS 65 13.075 -8.635 -18.450 519 HA LYS 65 HA LYS 65 13.414 -5.930 -19.380 520 HB2 LYS 65 2HB LYS 65 11.200 -7.203 -19.079 521 HB3 LYS 65 3HB LYS 65 11.376 -6.851 -17.364 522 HG2 LYS 65 2HG LYS 65 11.567 -4.412 -18.037 523 HG3 LYS 65 3HG LYS 65 11.009 -4.921 -19.633 524 HD2 LYS 65 2HD LYS 65 9.524 -5.495 -17.073 525 HD3 LYS 65 3HD LYS 65 9.206 -4.094 -18.099 526 HE2 LYS 65 2HE LYS 65 9.250 -6.690 -19.484 527 HE3 LYS 65 3HE LYS 65 7.940 -6.479 -18.324 528 HZ1 LYS 65 3HZ LYS 65 7.960 -5.577 -20.891 529 HZ2 LYS 65 1HZ LYS 65 8.310 -4.185 -19.995 530 HZ3 LYS 65 2HZ LYS 65 6.903 -5.067 -19.672 531 H TYR 66 H TYR 66 13.272 -7.491 -16.180 532 HA TYR 66 HA TYR 66 14.372 -5.071 -14.966 533 HB2 TYR 66 2HB TYR 66 13.213 -7.594 -13.774 534 HB3 TYR 66 3HB TYR 66 13.929 -6.305 -12.812 535 HD1 TYR 66 HD2 TYR 66 11.161 -7.112 -15.132 536 HD2 TYR 66 HD1 TYR 66 12.706 -4.344 -12.295 537 HE1 TYR 66 HE2 TYR 66 9.000 -5.939 -15.109 538 HE2 TYR 66 HE1 TYR 66 10.549 -3.163 -12.263 539 HH TYR 66 HH TYR 66 8.587 -2.877 -13.599 540 H ALA 67 H ALA 67 15.901 -7.011 -16.681 541 HA ALA 67 HA ALA 67 17.811 -8.156 -14.806 542 HB1 ALA 67 1HB ALA 67 17.989 -9.678 -16.409 543 HB2 ALA 67 2HB ALA 67 17.010 -8.700 -17.502 544 HB3 ALA 67 3HB ALA 67 18.757 -8.464 -17.433 545 H SER 68 H SER 68 17.344 -5.154 -15.684 546 HA SER 68 HA SER 68 20.201 -4.560 -16.104 547 HB2 SER 68 2HB SER 68 19.578 -2.564 -17.285 548 HB3 SER 68 3HB SER 68 18.643 -3.892 -17.971 549 HG SER 68 HG SER 68 17.807 -1.735 -16.411 550 H VAL 69 H VAL 69 17.403 -4.047 -14.151 551 HA VAL 69 HA VAL 69 18.049 -1.693 -12.815 552 HB VAL 69 HB VAL 69 15.890 -2.887 -12.577 553 HG11 VAL 69 1HG1 VAL 69 16.762 -4.617 -10.409 554 HG12 VAL 69 2HG1 VAL 69 15.707 -4.964 -11.780 555 HG13 VAL 69 3HG1 VAL 69 17.458 -5.071 -11.964 556 HG21 VAL 69 3HG2 VAL 69 16.100 -1.223 -10.994 557 HG22 VAL 69 1HG2 VAL 69 15.839 -2.640 -9.977 558 HG23 VAL 69 2HG2 VAL 69 17.468 -2.003 -10.200 559 H ASP 70 H ASP 70 19.417 -1.157 -11.208 560 HA ASP 70 HA ASP 70 21.414 -3.130 -10.438 561 HB2 ASP 70 2HB ASP 70 21.259 -0.152 -9.922 562 HB3 ASP 70 3HB ASP 70 22.610 -1.186 -9.466 563 H THR 71 H THR 71 20.644 -4.433 -8.864 564 HA THR 71 HA THR 71 18.858 -3.746 -6.837 565 HB THR 71 HB THR 71 20.190 -5.728 -5.619 566 HG1 THR 71 HG1 THR 71 20.681 -6.343 -8.333 567 HG21 THR 71 3HG2 THR 71 18.519 -6.278 -8.066 568 HG22 THR 71 1HG2 THR 71 17.838 -5.681 -6.553 569 HG23 THR 71 2HG2 THR 71 18.648 -7.247 -6.598 570 H TYR 72 H TYR 72 22.319 -3.341 -7.054 571 HA TYR 72 HA TYR 72 22.885 -2.934 -4.331 572 HB2 TYR 72 2HB TYR 72 24.728 -3.295 -5.775 573 HB3 TYR 72 3HB TYR 72 24.234 -1.998 -6.859 574 HD1 TYR 72 HD1 TYR 72 24.522 -1.931 -3.149 575 HD2 TYR 72 HD2 TYR 72 26.072 -0.555 -6.865 576 HE1 TYR 72 HE1 TYR 72 25.999 -0.373 -1.949 577 HE2 TYR 72 HE2 TYR 72 27.555 1.006 -5.675 578 HH TYR 72 HH TYR 72 27.194 1.742 -2.392 579 H ASP 73 H ASP 73 21.993 -0.664 -6.903 580 HA ASP 73 HA ASP 73 22.203 1.685 -5.363 581 HB2 ASP 73 2HB ASP 73 22.066 1.596 -7.861 582 HB3 ASP 73 3HB ASP 73 20.355 1.206 -7.708 583 H ARG 74 H ARG 74 21.158 1.911 -3.487 584 HA ARG 74 HA ARG 74 18.822 0.663 -2.686 585 HB2 ARG 74 2HB ARG 74 18.775 2.156 -0.852 586 HB3 ARG 74 3HB ARG 74 20.474 1.961 -1.260 587 HG2 ARG 74 2HG ARG 74 18.804 4.264 -2.229 588 HG3 ARG 74 3HG ARG 74 19.740 4.300 -0.734 589 HD2 ARG 74 2HD ARG 74 20.769 3.967 -3.545 590 HD3 ARG 74 3HD ARG 74 21.055 5.317 -2.448 591 HE ARG 74 HE ARG 74 22.045 3.129 -1.139 592 HH11 ARG 74 1HH1 ARG 74 22.606 4.635 -4.227 593 HH12 ARG 74 2HH1 ARG 74 24.264 4.141 -4.313 594 HH21 ARG 74 1HH2 ARG 74 24.227 2.474 -1.240 595 HH22 ARG 74 2HH2 ARG 74 25.185 2.911 -2.614 596 H GLU 75 H GLU 75 19.254 3.477 -4.678 597 HA GLU 75 HA GLU 75 16.656 4.564 -4.424 598 HB2 GLU 75 2HB GLU 75 18.814 4.808 -6.502 599 HB3 GLU 75 3HB GLU 75 17.246 5.569 -6.731 600 HG2 GLU 75 2HG GLU 75 17.566 7.064 -5.009 601 HG3 GLU 75 3HG GLU 75 18.769 6.051 -4.213 602 H GLN 76 H GLN 76 18.087 2.533 -6.982 603 HA GLN 76 HA GLN 76 15.744 2.186 -8.471 604 HB2 GLN 76 2HB GLN 76 18.107 0.320 -8.195 605 HB3 GLN 76 3HB GLN 76 16.883 0.226 -9.454 606 HG2 GLN 76 2HG GLN 76 17.631 2.743 -9.832 607 HG3 GLN 76 3HG GLN 76 19.123 2.130 -9.119 608 HE21 GLN 76 1HE2 GLN 76 20.339 2.254 -10.955 609 HE22 GLN 76 2HE2 GLN 76 20.075 1.258 -12.342 610 H VAL 77 H VAL 77 17.243 -0.092 -6.167 611 HA VAL 77 HA VAL 77 15.277 -2.027 -6.156 612 HB VAL 77 HB VAL 77 17.540 -2.034 -4.950 613 HG11 VAL 77 1HG1 VAL 77 17.122 -0.014 -3.606 614 HG12 VAL 77 2HG1 VAL 77 15.849 -0.873 -2.737 615 HG13 VAL 77 3HG1 VAL 77 17.524 -1.410 -2.608 616 HG21 VAL 77 3HG2 VAL 77 16.250 -3.389 -2.970 617 HG22 VAL 77 1HG2 VAL 77 15.012 -3.326 -4.225 618 HG23 VAL 77 2HG2 VAL 77 16.589 -4.034 -4.576 619 H MET 78 H MET 78 15.331 1.072 -4.526 620 HA MET 78 HA MET 78 13.152 0.593 -2.778 621 HB2 MET 78 2HB MET 78 14.728 2.929 -3.660 622 HB3 MET 78 3HB MET 78 13.091 3.285 -3.126 623 HG2 MET 78 2HG MET 78 13.604 2.022 -1.024 624 HG3 MET 78 3HG MET 78 15.281 1.951 -1.561 625 HE1 MET 78 3HE MET 78 16.774 5.231 -0.810 626 HE2 MET 78 1HE MET 78 16.923 3.537 -1.281 627 HE3 MET 78 2HE MET 78 16.368 4.733 -2.453 628 H LYS 79 H LYS 79 13.361 2.267 -5.914 629 HA LYS 79 HA LYS 79 10.675 2.940 -6.178 630 HB2 LYS 79 2HB LYS 79 12.816 2.339 -8.207 631 HB3 LYS 79 3HB LYS 79 11.188 2.792 -8.695 632 HG2 LYS 79 2HG LYS 79 11.417 4.947 -7.966 633 HG3 LYS 79 3HG LYS 79 12.622 4.523 -6.747 634 HD2 LYS 79 2HD LYS 79 14.192 4.016 -8.668 635 HD3 LYS 79 3HD LYS 79 13.002 4.781 -9.723 636 HE2 LYS 79 2HE LYS 79 13.194 6.708 -7.912 637 HE3 LYS 79 3HE LYS 79 14.782 5.981 -7.668 638 HZ1 LYS 79 3HZ LYS 79 15.490 7.050 -9.455 639 HZ2 LYS 79 1HZ LYS 79 13.955 7.713 -9.713 640 HZ3 LYS 79 2HZ LYS 79 14.365 6.231 -10.417 641 H ILE 80 H ILE 80 12.366 -0.023 -7.138 642 HA ILE 80 HA ILE 80 10.172 -1.274 -8.385 643 HB ILE 80 HB ILE 80 12.725 -2.300 -7.197 644 HG12 ILE 80 2HG1 ILE 80 12.603 -3.185 -9.753 645 HG13 ILE 80 3HG1 ILE 80 11.604 -1.742 -9.880 646 HG21 ILE 80 1HG2 ILE 80 12.033 -4.552 -8.167 647 HG22 ILE 80 2HG2 ILE 80 11.295 -4.076 -6.639 648 HG23 ILE 80 3HG2 ILE 80 10.384 -3.927 -8.141 649 HD11 ILE 80 3HD1 ILE 80 14.361 -1.725 -8.691 650 HD12 ILE 80 1HD1 ILE 80 14.040 -1.447 -10.403 651 HD13 ILE 80 2HD1 ILE 80 13.381 -0.347 -9.192 652 H ILE 81 H ILE 81 11.523 -1.758 -5.119 653 HA ILE 81 HA ILE 81 9.589 -3.541 -4.198 654 HB ILE 81 HB ILE 81 11.250 -1.533 -2.679 655 HG12 ILE 81 2HG1 ILE 81 11.516 -4.533 -2.967 656 HG13 ILE 81 3HG1 ILE 81 12.449 -3.354 -3.881 657 HG21 ILE 81 1HG2 ILE 81 9.877 -1.892 -0.957 658 HG22 ILE 81 2HG2 ILE 81 9.058 -3.218 -1.781 659 HG23 ILE 81 3HG2 ILE 81 10.556 -3.518 -0.901 660 HD11 ILE 81 3HD1 ILE 81 12.593 -2.914 -1.016 661 HD12 ILE 81 1HD1 ILE 81 13.175 -4.507 -1.500 662 HD13 ILE 81 2HD1 ILE 81 13.882 -3.056 -2.211 663 H ASP 82 H ASP 82 9.607 -0.022 -4.273 664 HA ASP 82 HA ASP 82 7.254 0.314 -2.703 665 HB2 ASP 82 2HB ASP 82 8.991 2.081 -3.068 666 HB3 ASP 82 3HB ASP 82 8.419 2.235 -4.727 667 H GLU 83 H GLU 83 7.860 0.502 -6.209 668 HA GLU 83 HA GLU 83 5.214 0.959 -6.989 669 HB2 GLU 83 2HB GLU 83 7.527 -0.338 -8.425 670 HB3 GLU 83 3HB GLU 83 5.974 -0.049 -9.197 671 HG2 GLU 83 2HG GLU 83 7.475 2.178 -7.881 672 HG3 GLU 83 3HG GLU 83 7.858 1.664 -9.522 673 H PHE 84 H PHE 84 7.018 -2.101 -6.777 674 HA PHE 84 HA PHE 84 4.825 -3.736 -7.515 675 HB2 PHE 84 2HB PHE 84 7.483 -4.255 -6.218 676 HB3 PHE 84 3HB PHE 84 6.290 -5.544 -6.348 677 HD1 PHE 84 HD1 PHE 84 7.629 -2.865 -8.582 678 HD2 PHE 84 HD2 PHE 84 6.647 -6.977 -8.091 679 HE1 PHE 84 HE1 PHE 84 8.376 -3.314 -10.883 680 HE2 PHE 84 HE2 PHE 84 7.393 -7.433 -10.391 681 HZ PHE 84 HZ PHE 84 8.259 -5.601 -11.790 682 H LYS 85 H LYS 85 5.521 -2.048 -4.679 683 HA LYS 85 HA LYS 85 4.551 -1.962 -2.623 684 HB2 LYS 85 2HB LYS 85 2.430 -3.725 -3.861 685 HB3 LYS 85 3HB LYS 85 2.263 -2.766 -2.396 686 HG2 LYS 85 2HG LYS 85 2.948 -1.446 -4.987 687 HG3 LYS 85 3HG LYS 85 1.279 -1.885 -4.617 688 HD2 LYS 85 2HD LYS 85 1.287 -0.518 -2.651 689 HD3 LYS 85 3HD LYS 85 3.021 -0.221 -2.803 690 HE2 LYS 85 2HE LYS 85 2.653 1.005 -4.865 691 HE3 LYS 85 3HE LYS 85 0.928 0.650 -4.794 692 HZ1 LYS 85 3HZ LYS 85 0.779 2.593 -3.739 693 HZ2 LYS 85 1HZ LYS 85 2.439 2.669 -3.417 694 HZ3 LYS 85 2HZ LYS 85 1.418 1.794 -2.392 695 H ILE 86 H ILE 86 6.589 -3.725 -2.769 696 HA ILE 86 HA ILE 86 5.799 -6.313 -1.765 697 HB ILE 86 HB ILE 86 8.583 -5.154 -1.796 698 HG12 ILE 86 2HG1 ILE 86 7.185 -6.726 -3.971 699 HG13 ILE 86 3HG1 ILE 86 7.554 -5.006 -4.041 700 HG21 ILE 86 1HG2 ILE 86 7.786 -8.034 -2.061 701 HG22 ILE 86 2HG2 ILE 86 9.351 -7.356 -1.616 702 HG23 ILE 86 3HG2 ILE 86 8.001 -7.272 -0.485 703 HD11 ILE 86 3HD1 ILE 86 9.182 -6.195 -5.314 704 HD12 ILE 86 1HD1 ILE 86 9.960 -5.578 -3.856 705 HD13 ILE 86 2HD1 ILE 86 9.516 -7.282 -3.965 706 HA PRO 87 HA PRO 87 5.577 -4.910 2.455 707 HB2 PRO 87 2HB PRO 87 5.090 -7.351 3.537 708 HB3 PRO 87 3HB PRO 87 3.853 -6.409 2.697 709 HG2 PRO 87 2HG PRO 87 5.515 -8.683 1.684 710 HG3 PRO 87 3HG PRO 87 3.785 -8.370 1.449 711 HD2 PRO 87 2HD PRO 87 5.637 -7.807 -0.444 712 HD3 PRO 87 3HD PRO 87 4.162 -6.842 -0.235 713 H THR 88 H THR 88 6.744 -5.224 4.429 714 HA THR 88 HA THR 88 9.491 -5.988 3.987 715 HB THR 88 HB THR 88 8.889 -5.410 6.754 716 HG1 THR 88 HG1 THR 88 7.900 -3.612 4.780 717 HG21 THR 88 3HG2 THR 88 10.603 -4.334 4.567 718 HG22 THR 88 1HG2 THR 88 11.058 -4.952 6.154 719 HG23 THR 88 2HG2 THR 88 10.350 -3.344 6.004 720 H VAL 89 H VAL 89 10.575 -7.175 5.936 721 HA VAL 89 HA VAL 89 9.823 -9.839 5.880 722 HB VAL 89 HB VAL 89 11.329 -8.527 8.144 723 HG11 VAL 89 1HG1 VAL 89 12.309 -11.094 7.392 724 HG12 VAL 89 2HG1 VAL 89 11.607 -10.585 8.928 725 HG13 VAL 89 3HG1 VAL 89 10.567 -11.205 7.645 726 HG21 VAL 89 3HG2 VAL 89 12.416 -7.809 6.168 727 HG22 VAL 89 1HG2 VAL 89 13.354 -9.173 6.775 728 HG23 VAL 89 2HG2 VAL 89 12.254 -9.395 5.415 729 H GLU 90 H GLU 90 9.417 -7.598 8.631 730 HA GLU 90 HA GLU 90 7.975 -9.244 10.302 731 HB2 GLU 90 2HB GLU 90 7.785 -6.259 9.899 732 HB3 GLU 90 3HB GLU 90 6.955 -7.107 11.196 733 HG2 GLU 90 2HG GLU 90 9.043 -7.826 12.137 734 HG3 GLU 90 3HG GLU 90 9.933 -7.152 10.773 735 H GLN 91 H GLN 91 6.711 -7.079 7.784 736 HA GLN 91 HA GLN 91 3.997 -7.530 8.179 737 HB2 GLN 91 2HB GLN 91 5.324 -7.097 5.502 738 HB3 GLN 91 3HB GLN 91 3.664 -6.715 5.937 739 HG2 GLN 91 2HG GLN 91 6.179 -5.355 6.847 740 HG3 GLN 91 3HG GLN 91 4.841 -4.676 5.921 741 HE21 GLN 91 1HE2 GLN 91 6.234 -4.608 8.828 742 HE22 GLN 91 2HE2 GLN 91 4.870 -4.252 9.827 743 H TRP 92 H TRP 92 6.358 -9.384 6.328 744 HA TRP 92 HA TRP 92 4.566 -11.137 5.062 745 HB2 TRP 92 2HB TRP 92 6.919 -10.918 4.392 746 HB3 TRP 92 3HB TRP 92 7.425 -11.638 5.918 747 HD1 TRP 92 HD1 TRP 92 4.699 -12.894 3.457 748 HE1 TRP 92 HE1 TRP 92 5.281 -15.314 2.803 749 HE3 TRP 92 HE3 TRP 92 9.138 -13.363 5.950 750 HZ2 TRP 92 HZ2 TRP 92 7.348 -17.176 3.281 751 HZ3 TRP 92 HZ3 TRP 92 10.355 -15.497 5.800 752 HH2 TRP 92 HH2 TRP 92 9.476 -17.363 4.493 753 H LYS 93 H LYS 93 6.364 -11.471 8.112 754 HA LYS 93 HA LYS 93 5.473 -14.024 8.803 755 HB2 LYS 93 2HB LYS 93 6.484 -11.679 10.367 756 HB3 LYS 93 3HB LYS 93 5.841 -13.075 11.223 757 HG2 LYS 93 2HG LYS 93 7.548 -14.453 10.539 758 HG3 LYS 93 3HG LYS 93 7.906 -13.480 9.111 759 HD2 LYS 93 2HD LYS 93 8.336 -12.379 11.865 760 HD3 LYS 93 3HD LYS 93 9.546 -13.418 11.109 761 HE2 LYS 93 2HE LYS 93 9.971 -11.890 9.406 762 HE3 LYS 93 3HE LYS 93 8.444 -11.045 9.653 763 HZ1 LYS 93 3HZ LYS 93 9.273 -10.132 11.693 764 HZ2 LYS 93 1HZ LYS 93 10.387 -9.800 10.464 765 HZ3 LYS 93 2HZ LYS 93 10.702 -11.031 11.580 766 H ASP 94 H ASP 94 4.144 -10.855 9.737 767 HA ASP 94 HA ASP 94 2.000 -11.795 11.259 768 HB2 ASP 94 2HB ASP 94 2.551 -9.486 11.405 769 HB3 ASP 94 3HB ASP 94 2.370 -9.260 9.667 770 H GLN 95 H GLN 95 2.066 -10.852 7.825 771 HA GLN 95 HA GLN 95 -0.563 -11.329 7.167 772 HB2 GLN 95 2HB GLN 95 1.935 -11.772 5.531 773 HB3 GLN 95 3HB GLN 95 0.311 -11.864 4.861 774 HG2 GLN 95 2HG GLN 95 -0.014 -9.618 4.965 775 HG3 GLN 95 3HG GLN 95 1.040 -9.417 6.364 776 HE21 GLN 95 1HE2 GLN 95 1.671 -10.956 3.246 777 HE22 GLN 95 2HE2 GLN 95 2.970 -9.911 2.793 778 H THR 96 H THR 96 2.123 -13.664 6.993 779 HA THR 96 HA THR 96 0.636 -15.870 6.161 780 HB THR 96 HB THR 96 2.520 -17.121 7.585 781 HG1 THR 96 HG1 THR 96 4.065 -15.829 8.265 782 HG21 THR 96 3HG2 THR 96 4.093 -16.553 5.590 783 HG22 THR 96 1HG2 THR 96 2.694 -15.681 4.966 784 HG23 THR 96 2HG2 THR 96 2.583 -17.412 5.284 785 H ARG 97 H ARG 97 1.259 -14.622 9.404 786 HA ARG 97 HA ARG 97 0.229 -16.760 10.882 787 HB2 ARG 97 2HB ARG 97 0.296 -13.803 11.500 788 HB3 ARG 97 3HB ARG 97 -0.160 -15.037 12.668 789 HG2 ARG 97 2HG ARG 97 2.418 -15.461 11.314 790 HG3 ARG 97 3HG ARG 97 2.333 -14.068 12.393 791 HD2 ARG 97 2HD ARG 97 1.563 -16.886 13.140 792 HD3 ARG 97 3HD ARG 97 3.109 -16.128 13.521 793 HE ARG 97 HE ARG 97 1.163 -14.450 14.525 794 HH11 ARG 97 1HH1 ARG 97 2.179 -17.746 15.001 795 HH12 ARG 97 2HH1 ARG 97 1.681 -17.797 16.660 796 HH21 ARG 97 1HH2 ARG 97 0.503 -14.505 16.708 797 HH22 ARG 97 2HH2 ARG 97 0.726 -15.954 17.629 798 H ARG 98 H ARG 98 -1.383 -13.871 9.596 799 HA ARG 98 HA ARG 98 -3.931 -14.435 10.672 800 HB2 ARG 98 2HB ARG 98 -3.381 -12.895 8.135 801 HB3 ARG 98 3HB ARG 98 -4.760 -12.728 9.214 802 HG2 ARG 98 2HG ARG 98 -1.922 -11.874 9.676 803 HG3 ARG 98 3HG ARG 98 -3.380 -10.880 9.647 804 HD2 ARG 98 2HD ARG 98 -2.629 -12.932 11.725 805 HD3 ARG 98 3HD ARG 98 -2.645 -11.181 11.928 806 HE ARG 98 HE ARG 98 -5.182 -12.315 11.160 807 HH11 ARG 98 1HH1 ARG 98 -3.091 -11.442 13.803 808 HH12 ARG 98 2HH1 ARG 98 -4.381 -11.313 14.952 809 HH21 ARG 98 1HH2 ARG 98 -6.889 -12.147 12.663 810 HH22 ARG 98 2HH2 ARG 98 -6.541 -11.715 14.303 811 H TYR 99 H TYR 99 -2.480 -15.137 7.512 812 HA TYR 99 HA TYR 99 -4.786 -16.358 6.409 813 HB2 TYR 99 2HB TYR 99 -3.067 -15.542 4.936 814 HB3 TYR 99 3HB TYR 99 -1.859 -16.579 5.687 815 HD1 TYR 99 HD2 TYR 99 -5.295 -17.205 4.345 816 HD2 TYR 99 HD1 TYR 99 -1.159 -18.194 4.198 817 HE1 TYR 99 HE2 TYR 99 -5.779 -18.957 2.689 818 HE2 TYR 99 HE1 TYR 99 -1.632 -19.948 2.540 819 HH TYR 99 HH TYR 99 -4.495 -21.249 2.005 820 H LYS 100 H LYS 100 -2.297 -17.468 8.535 821 HA LYS 100 HA LYS 100 -2.907 -20.275 8.098 822 HB2 LYS 100 2HB LYS 100 -0.904 -18.763 9.727 823 HB3 LYS 100 3HB LYS 100 -1.273 -20.427 10.159 824 HG2 LYS 100 2HG LYS 100 -0.408 -21.269 8.181 825 HG3 LYS 100 3HG LYS 100 -0.542 -19.719 7.347 826 HD2 LYS 100 2HD LYS 100 1.685 -19.647 7.745 827 HD3 LYS 100 3HD LYS 100 1.155 -19.028 9.311 828 HE2 LYS 100 2HE LYS 100 1.212 -21.941 9.184 829 HE3 LYS 100 3HE LYS 100 2.788 -21.205 8.898 830 HZ1 LYS 100 3HZ LYS 100 2.747 -21.408 11.172 831 HZ2 LYS 100 1HZ LYS 100 1.092 -21.079 11.298 832 HZ3 LYS 100 2HZ LYS 100 2.183 -19.825 10.983 833 H GLU 101 H GLU 101 -3.754 -17.708 10.264 834 HA GLU 101 HA GLU 101 -4.939 -19.548 12.193 835 HB2 GLU 101 2HB GLU 101 -5.080 -17.765 13.671 836 HB3 GLU 101 3HB GLU 101 -3.628 -17.378 12.759 837 HG2 GLU 101 2HG GLU 101 -5.067 -15.927 11.294 838 HG3 GLU 101 3HG GLU 101 -6.364 -16.175 12.461 839 H SER 102 H SER 102 -7.145 -18.410 13.085 840 HA SER 102 HA SER 102 -9.137 -19.120 11.313 841 HB2 SER 102 2HB SER 102 -9.325 -18.703 13.826 842 HB3 SER 102 3HB SER 102 -9.515 -16.996 13.424 843 HG SER 102 HG SER 102 -11.514 -18.199 13.639 844 H SER 103 H SER 103 -10.763 -17.813 10.232 845 HA SER 103 HA SER 103 -9.527 -15.637 8.765 846 HB2 SER 103 2HB SER 103 -11.957 -15.776 7.656 847 HB3 SER 103 3HB SER 103 -10.671 -16.908 7.237 848 HG SER 103 HG SER 103 -12.261 -18.250 7.751 849 H ILE 104 H ILE 104 -11.198 -13.809 8.157 850 HA ILE 104 HA ILE 104 -12.150 -12.712 10.713 851 HB ILE 104 HB ILE 104 -11.778 -11.056 8.245 852 HG12 ILE 104 2HG1 ILE 104 -9.676 -12.244 8.460 853 HG13 ILE 104 3HG1 ILE 104 -9.455 -10.583 8.999 854 HG21 ILE 104 1HG2 ILE 104 -11.144 -9.383 10.072 855 HG22 ILE 104 2HG2 ILE 104 -12.835 -9.870 9.962 856 HG23 ILE 104 3HG2 ILE 104 -11.796 -10.567 11.205 857 HD11 ILE 104 3HD1 ILE 104 -8.564 -11.390 10.852 858 HD12 ILE 104 1HD1 ILE 104 -10.155 -12.013 11.286 859 HD13 ILE 104 2HD1 ILE 104 -9.014 -13.038 10.414 860 H GLN 105 H GLN 105 -14.076 -11.303 10.610 861 HA GLN 105 HA GLN 105 -16.312 -12.615 9.664 862 HB2 GLN 105 2HB GLN 105 -17.570 -10.694 10.258 863 HB3 GLN 105 3HB GLN 105 -16.218 -10.759 11.381 864 HG2 GLN 105 2HG GLN 105 -15.083 -9.171 9.647 865 HG3 GLN 105 3HG GLN 105 -16.745 -8.852 9.156 866 HE21 GLN 105 1HE2 GLN 105 -15.705 -6.695 9.951 867 HE22 GLN 105 2HE2 GLN 105 -16.078 -6.279 11.585 868 H ILE 106 H ILE 106 -17.962 -11.573 8.120 869 HA ILE 106 HA ILE 106 -16.563 -10.805 5.642 870 HB ILE 106 HB ILE 106 -19.114 -12.402 5.894 871 HG12 ILE 106 2HG1 ILE 106 -17.050 -13.770 4.486 872 HG13 ILE 106 3HG1 ILE 106 -16.373 -13.190 6.003 873 HG21 ILE 106 1HG2 ILE 106 -18.901 -12.683 3.455 874 HG22 ILE 106 2HG2 ILE 106 -19.147 -11.001 3.923 875 HG23 ILE 106 3HG2 ILE 106 -17.539 -11.563 3.464 876 HD11 ILE 106 3HD1 ILE 106 -17.881 -14.426 7.280 877 HD12 ILE 106 1HD1 ILE 106 -18.967 -14.681 5.914 878 HD13 ILE 106 2HD1 ILE 106 -17.413 -15.512 5.972 879 H GLY 107 H GLY 107 -16.815 -8.616 5.675 880 HA2 GLY 107 2HA GLY 107 -19.597 -7.649 5.545 881 HA3 GLY 107 3HA GLY 107 -18.413 -6.815 6.539 882 H ASN 108 H ASN 108 -19.811 -7.042 3.480 883 HA ASN 108 HA ASN 108 -17.632 -5.954 1.964 884 HB2 ASN 108 2HB ASN 108 -19.191 -5.833 0.132 885 HB3 ASN 108 3HB ASN 108 -19.456 -7.356 0.975 886 HD21 ASN 108 1HD2 ASN 108 -21.375 -7.732 1.977 887 HD22 ASN 108 2HD2 ASN 108 -22.732 -6.667 1.875 888 H GLY 109 H GLY 109 -17.135 -3.873 1.578 889 HA2 GLY 109 2HA GLY 109 -18.952 -1.830 2.702 890 HA3 GLY 109 3HA GLY 109 -17.200 -1.698 2.741 891 H HIS 110 H HIS 110 -20.052 -1.123 0.939 892 HA HIS 110 HA HIS 110 -18.489 0.302 -1.068 893 HB2 HIS 110 2HB HIS 110 -19.133 -2.114 -1.820 894 HB3 HIS 110 3HB HIS 110 -20.744 -1.433 -2.022 895 HD1 HIS 110 HD1 HIS 110 -21.063 -1.059 -4.442 896 HD2 HIS 110 HD2 HIS 110 -17.255 0.045 -3.199 897 HE1 HIS 110 HE1 HIS 110 -19.949 -0.081 -6.474 898 H GLY 111 H GLY 111 -19.739 1.869 -2.271 899 HA2 GLY 111 2HA GLY 111 -22.372 2.478 -2.169 900 HA3 GLY 111 3HA GLY 111 -21.788 3.062 -0.618 901 H GLN 112 H GLN 112 -22.371 3.906 -3.769 902 HA GLN 112 HA GLN 112 -21.393 6.523 -3.473 903 HB2 GLN 112 2HB GLN 112 -19.601 6.510 -5.164 904 HB3 GLN 112 3HB GLN 112 -19.196 5.524 -3.766 905 HG2 GLN 112 2HG GLN 112 -20.493 4.131 -6.019 906 HG3 GLN 112 3HG GLN 112 -18.854 4.721 -6.293 907 HE21 GLN 112 1HE2 GLN 112 -17.158 3.758 -5.266 908 HE22 GLN 112 2HE2 GLN 112 -17.308 2.323 -4.317 909 H SER 113 H SER 113 -22.014 7.887 -5.176 910 HA SER 113 HA SER 113 -23.364 6.658 -7.461 911 HB2 SER 113 2HB SER 113 -24.676 8.651 -5.597 912 HB3 SER 113 3HB SER 113 -25.349 8.112 -7.135 913 HG SER 113 HG SER 113 -25.595 6.078 -6.311 914 H GLN 114 H GLN 114 -24.163 8.475 -8.986 915 HA GLN 114 HA GLN 114 -22.556 10.887 -8.898 916 HB2 GLN 114 2HB GLN 114 -21.282 8.891 -10.041 917 HB3 GLN 114 3HB GLN 114 -22.332 9.265 -11.401 918 HG2 GLN 114 2HG GLN 114 -21.358 11.307 -11.773 919 HG3 GLN 114 3HG GLN 114 -20.799 11.464 -10.108 920 HE21 GLN 114 1HE2 GLN 114 -18.979 12.108 -11.825 921 HE22 GLN 114 2HE2 GLN 114 -17.801 10.867 -12.061 922 H GLY 115 H GLY 115 -23.052 12.322 -10.807 923 HA2 GLY 115 2HA GLY 115 -25.706 11.791 -11.952 924 HA3 GLY 115 3HA GLY 115 -25.455 13.274 -11.043 925 H LEU 116 H LEU 116 -25.999 12.533 -13.980 926 HA LEU 116 HA LEU 116 -23.778 14.059 -15.163 927 HB2 LEU 116 2HB LEU 116 -25.769 12.246 -16.518 928 HB3 LEU 116 3HB LEU 116 -24.436 13.089 -17.303 929 HG LEU 116 HG LEU 116 -24.118 10.940 -15.209 930 HD11 LEU 116 1HD1 LEU 116 -23.482 10.641 -18.118 931 HD12 LEU 116 2HD1 LEU 116 -25.101 10.304 -17.506 932 HD13 LEU 116 3HD1 LEU 116 -23.720 9.395 -16.892 933 HD21 LEU 116 3HD2 LEU 116 -22.156 12.108 -15.067 934 HD22 LEU 116 1HD2 LEU 116 -22.239 12.671 -16.736 935 HD23 LEU 116 2HD2 LEU 116 -21.766 11.008 -16.390 936 H GLU 117 H GLU 117 -24.680 15.134 -17.346 937 HA GLU 117 HA GLU 117 -26.491 17.167 -16.447 938 HB2 GLU 117 2HB GLU 117 -25.260 16.691 -19.167 939 HB3 GLU 117 3HB GLU 117 -26.155 18.131 -18.701 940 HG2 GLU 117 2HG GLU 117 -23.735 17.261 -17.172 941 HG3 GLU 117 3HG GLU 117 -23.590 18.200 -18.657 942 H1 GLY -9 H GLY -9 9.650 -9.654 17.214 943 HA2 GLY -9 2HA GLY -9 9.764 -9.908 14.291 944 HA3 GLY -9 3HA GLY -9 11.100 -9.451 15.336 945 H LYS -8 H LYS -8 11.360 -11.377 13.348 946 HA LYS -8 HA LYS -8 11.933 -13.739 14.990 947 HB2 LYS -8 2HB LYS -8 9.834 -13.725 13.239 948 HB3 LYS -8 3HB LYS -8 11.131 -14.341 12.223 949 HG2 LYS -8 2HG LYS -8 11.520 -16.171 13.699 950 HG3 LYS -8 3HG LYS -8 10.428 -15.496 14.910 951 HD2 LYS -8 2HD LYS -8 8.564 -16.178 13.805 952 HD3 LYS -8 3HD LYS -8 9.300 -15.967 12.214 953 HE2 LYS -8 2HE LYS -8 9.174 -18.252 12.310 954 HE3 LYS -8 3HE LYS -8 10.779 -17.997 12.992 955 HZ1 LYS -8 3HZ LYS -8 9.052 -19.526 14.181 956 HZ2 LYS -8 1HZ LYS -8 8.475 -18.063 14.806 957 HZ3 LYS -8 2HZ LYS -8 10.077 -18.529 15.084 958 H PHE -7 H PHE -7 12.384 -12.283 11.770 959 HA PHE -7 HA PHE -7 15.023 -13.517 11.586 960 HB2 PHE -7 2HB PHE -7 13.316 -12.017 9.601 961 HB3 PHE -7 3HB PHE -7 14.978 -12.486 9.260 962 HD1 PHE -7 HD2 PHE -7 11.648 -13.838 10.165 963 HD2 PHE -7 HD1 PHE -7 15.479 -14.629 8.488 964 HE1 PHE -7 HE2 PHE -7 10.866 -16.052 9.430 965 HE2 PHE -7 HE1 PHE -7 14.703 -16.844 7.750 966 HZ PHE -7 HZ PHE -7 12.394 -17.559 8.222 967 H ILE -6 H ILE -6 13.963 -10.322 10.473 968 HA ILE -6 HA ILE -6 15.020 -8.298 10.532 969 HB ILE -6 HB ILE -6 15.359 -9.204 13.389 970 HG12 ILE -6 2HG1 ILE -6 13.517 -7.408 13.643 971 HG13 ILE -6 3HG1 ILE -6 13.325 -7.559 11.900 972 HG21 ILE -6 1HG2 ILE -6 16.813 -7.521 13.602 973 HG22 ILE -6 2HG2 ILE -6 16.406 -6.854 12.022 974 HG23 ILE -6 3HG2 ILE -6 15.416 -6.460 13.427 975 HD11 ILE -6 3HD1 ILE -6 13.266 -10.023 13.559 976 HD12 ILE -6 1HD1 ILE -6 11.860 -8.958 13.558 977 HD13 ILE -6 2HD1 ILE -6 12.439 -9.657 12.045 978 HA PRO -5 HA PRO -5 19.238 -10.001 9.864 979 HB2 PRO -5 2HB PRO -5 19.646 -8.637 7.552 980 HB3 PRO -5 3HB PRO -5 18.803 -10.190 7.616 981 HG2 PRO -5 2HG PRO -5 17.668 -7.424 7.468 982 HG3 PRO -5 3HG PRO -5 17.171 -8.885 6.595 983 HD2 PRO -5 2HD PRO -5 15.849 -7.970 8.773 984 HD3 PRO -5 3HD PRO -5 15.968 -9.698 8.385 985 H SER -4 H SER -4 19.825 -8.725 11.750 986 HA SER -4 HA SER -4 20.297 -5.914 11.518 987 HB2 SER -4 2HB SER -4 19.973 -6.432 13.728 988 HB3 SER -4 3HB SER -4 20.755 -8.006 13.586 989 HG SER -4 HG SER -4 22.121 -6.716 14.750 990 H ARG -3 H ARG -3 21.916 -8.577 10.332 991 HA ARG -3 HA ARG -3 24.612 -7.999 10.722 992 HB2 ARG -3 2HB ARG -3 23.032 -9.659 8.935 993 HB3 ARG -3 3HB ARG -3 24.453 -9.007 8.130 994 HG2 ARG -3 2HG ARG -3 25.843 -10.340 9.256 995 HG3 ARG -3 3HG ARG -3 25.011 -10.067 10.788 996 HD2 ARG -3 2HD ARG -3 23.843 -11.963 10.606 997 HD3 ARG -3 3HD ARG -3 23.437 -11.644 8.920 998 HE ARG -3 HE ARG -3 26.150 -12.476 9.244 999 HH11 ARG -3 1HH1 ARG -3 22.865 -13.610 9.033 1000 HH12 ARG -3 2HH1 ARG -3 23.306 -15.178 8.444 1001 HH21 ARG -3 1HH2 ARG -3 26.743 -14.538 8.470 1002 HH22 ARG -3 2HH2 ARG -3 25.512 -15.705 8.125 1003 HA PRO -2 HA PRO -2 25.560 -4.460 8.311 1004 HB2 PRO -2 2HB PRO -2 27.957 -5.118 7.220 1005 HB3 PRO -2 3HB PRO -2 27.753 -4.739 8.934 1006 HG2 PRO -2 2HG PRO -2 27.932 -7.409 7.593 1007 HG3 PRO -2 3HG PRO -2 28.694 -6.859 9.097 1008 HD2 PRO -2 2HD PRO -2 26.457 -8.386 9.070 1009 HD3 PRO -2 3HD PRO -2 26.776 -7.180 10.334 1010 H ALA -1 H ALA -1 25.627 -3.598 6.206 1011 HA ALA -1 HA ALA -1 24.829 -5.501 4.108 1012 HB1 ALA -1 1HB ALA -1 23.956 -3.336 3.004 1013 HB2 ALA -1 2HB ALA -1 23.058 -4.022 4.359 1014 HB3 ALA -1 3HB ALA -1 24.121 -2.637 4.616 1015 HA PRO 0 HA PRO 0 29.007 -4.197 2.741 1016 HB2 PRO 0 2HB PRO 0 29.546 -6.535 1.471 1017 HB3 PRO 0 3HB PRO 0 29.796 -6.305 3.205 1018 HG2 PRO 0 2HG PRO 0 27.514 -7.615 1.779 1019 HG3 PRO 0 3HG PRO 0 28.368 -8.139 3.242 1020 HD2 PRO 0 2HD PRO 0 25.969 -6.885 3.325 1021 HD3 PRO 0 3HD PRO 0 27.192 -6.693 4.598 1022 H LYS 1 H LYS 1 29.695 -3.532 0.723 1023 HA LYS 1 HA LYS 1 27.637 -3.277 -1.285 1024 HB2 LYS 1 2HB LYS 1 30.389 -2.165 -0.902 1025 HB3 LYS 1 3HB LYS 1 29.649 -2.097 -2.496 1026 HG2 LYS 1 2HG LYS 1 28.938 -0.100 -1.718 1027 HG3 LYS 1 3HG LYS 1 27.632 -1.098 -1.074 1028 HD2 LYS 1 2HD LYS 1 30.032 -0.843 0.627 1029 HD3 LYS 1 3HD LYS 1 29.072 0.624 0.416 1030 HE2 LYS 1 2HE LYS 1 27.076 -1.014 0.934 1031 HE3 LYS 1 3HE LYS 1 28.346 -1.962 1.707 1032 HZ1 LYS 1 3HZ LYS 1 28.198 0.891 2.334 1033 HZ2 LYS 1 1HZ LYS 1 28.659 -0.408 3.315 1034 HZ3 LYS 1 2HZ LYS 1 27.021 -0.122 3.005 1035 HA PRO 2 HA PRO 2 28.827 -6.487 -4.029 1036 HB2 PRO 2 2HB PRO 2 28.524 -5.317 -6.459 1037 HB3 PRO 2 3HB PRO 2 27.157 -5.774 -5.436 1038 HG2 PRO 2 2HG PRO 2 28.434 -3.091 -5.805 1039 HG3 PRO 2 3HG PRO 2 26.713 -3.509 -5.718 1040 HD2 PRO 2 2HD PRO 2 28.070 -2.481 -3.613 1041 HD3 PRO 2 3HD PRO 2 26.727 -3.626 -3.417 1042 HA PRO 3 HA PRO 3 33.023 -6.207 -5.314 1043 HB2 PRO 3 2HB PRO 3 33.069 -7.763 -7.538 1044 HB3 PRO 3 3HB PRO 3 32.897 -8.423 -5.907 1045 HG2 PRO 3 2HG PRO 3 30.790 -7.888 -7.966 1046 HG3 PRO 3 3HG PRO 3 30.982 -9.292 -6.900 1047 HD2 PRO 3 2HD PRO 3 29.221 -7.300 -6.384 1048 HD3 PRO 3 3HD PRO 3 30.038 -8.210 -5.097 1049 H SER 4 H SER 4 30.657 -5.657 -7.893 1050 HA SER 4 HA SER 4 32.586 -3.891 -9.238 1051 HB2 SER 4 2HB SER 4 31.598 -5.771 -10.571 1052 HB3 SER 4 3HB SER 4 30.014 -5.024 -10.363 1053 HG SER 4 HG SER 4 32.081 -4.330 -12.029 1054 H SER 5 H SER 5 32.329 -1.781 -9.002 1055 HA SER 5 HA SER 5 29.631 -0.745 -8.418 1056 HB2 SER 5 2HB SER 5 32.275 0.286 -7.360 1057 HB3 SER 5 3HB SER 5 30.700 1.020 -7.060 1058 HG SER 5 HG SER 5 31.184 -1.682 -6.421 1059 H ALA 6 H ALA 6 29.062 -0.062 -10.429 1060 HA ALA 6 HA ALA 6 30.877 1.361 -12.141 1061 HB1 ALA 6 1HB ALA 6 28.681 -0.112 -12.633 1062 HB2 ALA 6 2HB ALA 6 27.986 1.508 -12.699 1063 HB3 ALA 6 3HB ALA 6 29.330 1.081 -13.759 Start of MODEL 15 1 H1 MET -2 H MET -2 1.438 1.556 0.588 2 HA MET -2 HA MET -2 3.647 2.590 -1.038 3 HB2 MET -2 2HB MET -2 4.493 0.304 -1.053 4 HB3 MET -2 3HB MET -2 4.191 0.835 0.597 5 HG2 MET -2 2HG MET -2 2.233 -0.478 0.761 6 HG3 MET -2 3HG MET -2 2.222 -0.799 -0.971 7 HE1 MET -2 3HE MET -2 4.083 -1.916 -2.186 8 HE2 MET -2 1HE MET -2 5.601 -1.660 -1.326 9 HE3 MET -2 2HE MET -2 4.986 -3.296 -1.561 10 H ALA -1 H ALA -1 4.041 0.923 -2.994 11 HA ALA -1 HA ALA -1 1.480 0.576 -4.403 12 HB1 ALA -1 1HB ALA -1 3.676 2.338 -5.098 13 HB2 ALA -1 2HB ALA -1 3.289 1.209 -6.397 14 HB3 ALA -1 3HB ALA -1 2.037 2.265 -5.744 15 HA PRO 1 HA PRO 1 2.887 -3.404 -5.600 16 HB2 PRO 1 2HB PRO 1 1.928 -3.625 -8.130 17 HB3 PRO 1 3HB PRO 1 0.889 -3.674 -6.701 18 HG2 PRO 1 2HG PRO 1 1.452 -1.393 -8.556 19 HG3 PRO 1 3HG PRO 1 -0.093 -1.910 -7.855 20 HD2 PRO 1 2HD PRO 1 1.332 0.170 -6.867 21 HD3 PRO 1 3HD PRO 1 0.332 -0.877 -5.839 22 H LEU 2 H LEU 2 5.162 -2.854 -5.579 23 HA LEU 2 HA LEU 2 6.352 -2.176 -8.160 24 HB2 LEU 2 2HB LEU 2 8.322 -1.667 -7.012 25 HB3 LEU 2 3HB LEU 2 7.026 -1.080 -5.972 26 HG LEU 2 HG LEU 2 7.509 -3.642 -5.040 27 HD11 LEU 2 1HD1 LEU 2 10.058 -2.341 -5.940 28 HD12 LEU 2 2HD1 LEU 2 9.515 -3.999 -6.191 29 HD13 LEU 2 3HD1 LEU 2 10.012 -3.469 -4.584 30 HD21 LEU 2 3HD2 LEU 2 7.033 -1.565 -3.763 31 HD22 LEU 2 1HD2 LEU 2 8.708 -1.075 -4.012 32 HD23 LEU 2 2HD2 LEU 2 8.345 -2.529 -3.083 33 H PHE 3 H PHE 3 7.946 -3.462 -9.150 34 HA PHE 3 HA PHE 3 8.085 -6.246 -8.203 35 HB2 PHE 3 2HB PHE 3 7.546 -5.232 -10.989 36 HB3 PHE 3 3HB PHE 3 8.173 -6.852 -10.697 37 HD1 PHE 3 HD1 PHE 3 5.442 -4.639 -9.436 38 HD2 PHE 3 HD2 PHE 3 6.642 -8.550 -10.611 39 HE1 PHE 3 HE1 PHE 3 3.149 -5.452 -9.062 40 HE2 PHE 3 HE2 PHE 3 4.351 -9.369 -10.240 41 HZ PHE 3 HZ PHE 3 2.601 -7.819 -9.465 42 H ALA 4 H ALA 4 9.944 -7.454 -9.121 43 HA ALA 4 HA ALA 4 12.208 -5.719 -9.829 44 HB1 ALA 4 1HB ALA 4 11.945 -7.480 -7.466 45 HB2 ALA 4 2HB ALA 4 13.498 -7.491 -8.302 46 HB3 ALA 4 3HB ALA 4 12.847 -5.978 -7.670 47 H VAL 5 H VAL 5 14.139 -7.097 -10.527 48 HA VAL 5 HA VAL 5 13.254 -9.532 -11.917 49 HB VAL 5 HB VAL 5 13.234 -7.717 -13.555 50 HG11 VAL 5 1HG1 VAL 5 15.025 -6.316 -14.009 51 HG12 VAL 5 2HG1 VAL 5 15.075 -6.446 -12.250 52 HG13 VAL 5 3HG1 VAL 5 16.192 -7.390 -13.237 53 HG21 VAL 5 3HG2 VAL 5 13.836 -9.314 -14.978 54 HG22 VAL 5 1HG2 VAL 5 15.522 -8.861 -14.729 55 HG23 VAL 5 2HG2 VAL 5 14.789 -10.114 -13.728 56 H THR 6 H THR 6 14.615 -11.202 -11.739 57 HA THR 6 HA THR 6 16.954 -10.956 -10.107 58 HB THR 6 HB THR 6 17.024 -13.482 -11.319 59 HG1 THR 6 HG1 THR 6 14.678 -13.995 -10.729 60 HG21 THR 6 3HG2 THR 6 16.588 -12.303 -8.726 61 HG22 THR 6 1HG2 THR 6 17.315 -13.855 -9.139 62 HG23 THR 6 2HG2 THR 6 15.568 -13.725 -8.939 63 H LEU 7 H LEU 7 19.051 -10.871 -10.685 64 HA LEU 7 HA LEU 7 19.649 -10.852 -13.566 65 HB2 LEU 7 2HB LEU 7 21.285 -9.625 -11.358 66 HB3 LEU 7 3HB LEU 7 21.486 -9.396 -13.094 67 HG LEU 7 HG LEU 7 19.020 -8.493 -11.627 68 HD11 LEU 7 1HD1 LEU 7 20.558 -7.202 -10.517 69 HD12 LEU 7 2HD1 LEU 7 20.233 -6.196 -11.928 70 HD13 LEU 7 3HD1 LEU 7 21.689 -7.189 -11.870 71 HD21 LEU 7 3HD2 LEU 7 18.367 -7.620 -13.584 72 HD22 LEU 7 1HD2 LEU 7 19.533 -8.736 -14.296 73 HD23 LEU 7 2HD2 LEU 7 19.991 -7.061 -13.987 74 H TYR 8 H TYR 8 20.109 -12.586 -10.711 75 HA TYR 8 HA TYR 8 22.189 -14.201 -12.002 76 HB2 TYR 8 2HB TYR 8 22.247 -13.357 -9.097 77 HB3 TYR 8 3HB TYR 8 23.391 -14.443 -9.878 78 HD1 TYR 8 HD1 TYR 8 22.130 -10.951 -9.903 79 HD2 TYR 8 HD2 TYR 8 25.278 -13.597 -10.993 80 HE1 TYR 8 HE1 TYR 8 23.530 -9.024 -10.517 81 HE2 TYR 8 HE2 TYR 8 26.687 -11.678 -11.609 82 HH TYR 8 HH TYR 8 25.488 -8.346 -11.302 83 H GLU 9 H GLU 9 22.297 -16.398 -11.234 84 HA GLU 9 HA GLU 9 19.677 -17.423 -10.570 85 HB2 GLU 9 2HB GLU 9 20.855 -18.606 -12.275 86 HB3 GLU 9 3HB GLU 9 22.293 -18.749 -11.272 87 HG2 GLU 9 2HG GLU 9 21.454 -20.482 -10.064 88 HG3 GLU 9 3HG GLU 9 19.783 -19.959 -10.263 89 H PHE 10 H PHE 10 19.117 -17.274 -8.484 90 HA PHE 10 HA PHE 10 21.089 -18.065 -6.449 91 HB2 PHE 10 2HB PHE 10 20.234 -15.794 -6.162 92 HB3 PHE 10 3HB PHE 10 18.580 -16.398 -6.168 93 HD1 PHE 10 HD2 PHE 10 21.673 -16.111 -4.243 94 HD2 PHE 10 HD1 PHE 10 17.662 -17.534 -4.249 95 HE1 PHE 10 HE2 PHE 10 21.775 -16.397 -1.802 96 HE2 PHE 10 HE1 PHE 10 17.757 -17.822 -1.807 97 HZ PHE 10 HZ PHE 10 19.816 -17.255 -0.580 98 H LYS 11 H LYS 11 20.858 -20.208 -6.158 99 HA LYS 11 HA LYS 11 18.287 -21.497 -6.225 100 HB2 LYS 11 2HB LYS 11 21.010 -22.548 -5.435 101 HB3 LYS 11 3HB LYS 11 19.567 -23.535 -5.631 102 HG2 LYS 11 2HG LYS 11 20.953 -21.949 -7.783 103 HG3 LYS 11 3HG LYS 11 20.972 -23.703 -7.587 104 HD2 LYS 11 2HD LYS 11 18.392 -23.498 -7.735 105 HD3 LYS 11 3HD LYS 11 18.725 -21.917 -8.445 106 HE2 LYS 11 2HE LYS 11 18.596 -23.295 -10.305 107 HE3 LYS 11 3HE LYS 11 20.331 -23.221 -9.999 108 HZ1 LYS 11 3HZ LYS 11 18.495 -25.421 -9.217 109 HZ2 LYS 11 1HZ LYS 11 20.133 -25.341 -8.800 110 HZ3 LYS 11 2HZ LYS 11 19.679 -25.478 -10.424 111 H ALA 12 H ALA 12 16.928 -21.729 -4.581 112 HA ALA 12 HA ALA 12 17.453 -20.675 -2.014 113 HB1 ALA 12 1HB ALA 12 15.230 -22.310 -3.175 114 HB2 ALA 12 2HB ALA 12 15.281 -21.956 -1.448 115 HB3 ALA 12 3HB ALA 12 15.212 -20.637 -2.617 116 H GLU 13 H GLU 13 17.811 -21.676 -0.041 117 HA GLU 13 HA GLU 13 19.027 -24.330 -0.228 118 HB2 GLU 13 2HB GLU 13 19.902 -23.787 2.062 119 HB3 GLU 13 3HB GLU 13 20.452 -22.707 0.789 120 HG2 GLU 13 2HG GLU 13 18.879 -21.019 1.476 121 HG3 GLU 13 3HG GLU 13 18.187 -22.109 2.677 122 H ARG 14 H ARG 14 16.389 -22.619 1.294 123 HA ARG 14 HA ARG 14 15.309 -25.183 2.205 124 HB2 ARG 14 2HB ARG 14 15.515 -22.704 3.924 125 HB3 ARG 14 3HB ARG 14 14.600 -24.145 4.347 126 HG2 ARG 14 2HG ARG 14 17.515 -24.343 3.723 127 HG3 ARG 14 3HG ARG 14 16.972 -23.811 5.316 128 HD2 ARG 14 2HD ARG 14 16.229 -26.401 3.960 129 HD3 ARG 14 3HD ARG 14 17.391 -26.218 5.274 130 HE ARG 14 HE ARG 14 14.950 -25.146 6.110 131 HH11 ARG 14 1HH1 ARG 14 16.336 -28.227 5.271 132 HH12 ARG 14 2HH1 ARG 14 15.287 -29.130 6.313 133 HH21 ARG 14 1HH2 ARG 14 13.563 -26.323 7.486 134 HH22 ARG 14 2HH2 ARG 14 13.709 -28.046 7.571 135 H ASP 15 H ASP 15 12.974 -24.655 3.170 136 HA ASP 15 HA ASP 15 11.400 -23.836 1.004 137 HB2 ASP 15 2HB ASP 15 9.542 -23.763 2.779 138 HB3 ASP 15 3HB ASP 15 10.369 -25.298 2.531 139 H ASP 16 H ASP 16 12.727 -22.060 3.690 140 HA ASP 16 HA ASP 16 11.068 -19.780 3.540 141 HB2 ASP 16 2HB ASP 16 13.927 -20.021 4.503 142 HB3 ASP 16 3HB ASP 16 12.867 -18.645 4.799 143 H GLU 17 H GLU 17 13.722 -20.875 1.620 144 HA GLU 17 HA GLU 17 13.920 -18.257 0.301 145 HB2 GLU 17 2HB GLU 17 15.754 -20.636 -0.015 146 HB3 GLU 17 3HB GLU 17 16.026 -19.005 -0.611 147 HG2 GLU 17 2HG GLU 17 15.776 -19.681 2.306 148 HG3 GLU 17 3HG GLU 17 17.311 -19.631 1.441 149 H LEU 18 H LEU 18 13.718 -18.069 -1.942 150 HA LEU 18 HA LEU 18 12.410 -20.358 -3.260 151 HB2 LEU 18 2HB LEU 18 11.043 -18.247 -2.712 152 HB3 LEU 18 3HB LEU 18 11.951 -17.494 -4.022 153 HG LEU 18 HG LEU 18 11.067 -19.574 -5.380 154 HD11 LEU 18 1HD1 LEU 18 8.529 -19.556 -4.283 155 HD12 LEU 18 2HD1 LEU 18 9.595 -19.710 -2.887 156 HD13 LEU 18 3HD1 LEU 18 9.697 -20.875 -4.206 157 HD21 LEU 18 3HD2 LEU 18 8.881 -18.120 -5.686 158 HD22 LEU 18 1HD2 LEU 18 10.452 -17.562 -6.262 159 HD23 LEU 18 2HD2 LEU 18 9.809 -16.960 -4.734 160 H ASP 19 H ASP 19 13.561 -21.198 -4.855 161 HA ASP 19 HA ASP 19 15.953 -20.153 -5.833 162 HB2 ASP 19 2HB ASP 19 14.195 -22.019 -7.418 163 HB3 ASP 19 3HB ASP 19 15.954 -21.935 -7.392 164 H VAL 20 H VAL 20 16.519 -18.977 -7.619 165 HA VAL 20 HA VAL 20 14.434 -18.080 -9.455 166 HB VAL 20 HB VAL 20 15.475 -15.700 -9.203 167 HG11 VAL 20 1HG1 VAL 20 13.472 -15.202 -8.368 168 HG12 VAL 20 2HG1 VAL 20 13.182 -16.938 -8.244 169 HG13 VAL 20 3HG1 VAL 20 13.815 -16.047 -6.859 170 HG21 VAL 20 3HG2 VAL 20 17.050 -16.892 -7.374 171 HG22 VAL 20 1HG2 VAL 20 16.637 -15.178 -7.337 172 HG23 VAL 20 2HG2 VAL 20 15.748 -16.321 -6.331 173 H SER 21 H SER 21 15.293 -17.020 -11.369 174 HA SER 21 HA SER 21 18.134 -17.614 -11.861 175 HB2 SER 21 2HB SER 21 15.732 -18.471 -13.408 176 HB3 SER 21 3HB SER 21 17.185 -18.046 -14.312 177 HG SER 21 HG SER 21 18.275 -19.673 -13.351 178 HA PRO 22 HA PRO 22 18.522 -13.590 -13.563 179 HB2 PRO 22 2HB PRO 22 20.212 -13.997 -15.648 180 HB3 PRO 22 3HB PRO 22 20.732 -14.075 -13.961 181 HG2 PRO 22 2HG PRO 22 20.042 -16.305 -15.835 182 HG3 PRO 22 3HG PRO 22 21.386 -16.186 -14.685 183 HD2 PRO 22 2HD PRO 22 19.137 -17.599 -14.157 184 HD3 PRO 22 3HD PRO 22 20.066 -16.774 -12.889 185 H GLY 23 H GLY 23 16.934 -12.558 -14.598 186 HA2 GLY 23 2HA GLY 23 16.113 -11.794 -16.751 187 HA3 GLY 23 3HA GLY 23 16.248 -13.450 -17.326 188 H GLU 24 H GLU 24 15.084 -13.691 -14.277 189 HA GLU 24 HA GLU 24 12.381 -14.124 -15.249 190 HB2 GLU 24 2HB GLU 24 13.891 -14.863 -12.775 191 HB3 GLU 24 3HB GLU 24 12.133 -14.860 -12.734 192 HG2 GLU 24 2HG GLU 24 13.170 -17.070 -13.229 193 HG3 GLU 24 3HG GLU 24 12.003 -16.515 -14.427 194 H ASN 25 H ASN 25 10.539 -13.430 -13.824 195 HA ASN 25 HA ASN 25 11.018 -10.699 -12.824 196 HB2 ASN 25 2HB ASN 25 8.456 -11.753 -14.038 197 HB3 ASN 25 3HB ASN 25 8.801 -10.089 -13.575 198 HD21 ASN 25 1HD2 ASN 25 9.297 -8.807 -15.186 199 HD22 ASN 25 2HD2 ASN 25 10.041 -9.273 -16.674 200 H LEU 26 H LEU 26 10.542 -10.327 -10.760 201 HA LEU 26 HA LEU 26 8.690 -12.159 -9.389 202 HB2 LEU 26 2HB LEU 26 11.292 -11.049 -8.352 203 HB3 LEU 26 3HB LEU 26 10.108 -11.901 -7.362 204 HG LEU 26 HG LEU 26 10.630 -13.647 -9.458 205 HD11 LEU 26 1HD1 LEU 26 12.960 -13.808 -9.718 206 HD12 LEU 26 2HD1 LEU 26 13.268 -12.648 -8.427 207 HD13 LEU 26 3HD1 LEU 26 12.581 -12.102 -9.957 208 HD21 LEU 26 3HD2 LEU 26 11.175 -15.078 -7.778 209 HD22 LEU 26 1HD2 LEU 26 10.430 -13.805 -6.812 210 HD23 LEU 26 2HD2 LEU 26 12.187 -13.896 -6.946 211 H SER 27 H SER 27 7.675 -11.255 -7.465 212 HA SER 27 HA SER 27 7.323 -8.341 -7.709 213 HB2 SER 27 2HB SER 27 5.353 -9.973 -8.134 214 HB3 SER 27 3HB SER 27 5.338 -10.171 -6.381 215 HG SER 27 HG SER 27 4.507 -8.246 -6.175 216 H ILE 28 H ILE 28 8.296 -7.232 -6.158 217 HA ILE 28 HA ILE 28 9.066 -8.462 -3.671 218 HB ILE 28 HB ILE 28 9.325 -5.596 -4.588 219 HG12 ILE 28 2HG1 ILE 28 11.315 -7.874 -4.538 220 HG13 ILE 28 3HG1 ILE 28 10.603 -7.149 -5.975 221 HG21 ILE 28 1HG2 ILE 28 10.583 -7.005 -2.237 222 HG22 ILE 28 2HG2 ILE 28 10.936 -5.359 -2.761 223 HG23 ILE 28 3HG2 ILE 28 9.330 -5.767 -2.158 224 HD11 ILE 28 3HD1 ILE 28 12.874 -6.369 -5.613 225 HD12 ILE 28 1HD1 ILE 28 11.719 -5.045 -5.470 226 HD13 ILE 28 2HD1 ILE 28 12.422 -5.762 -4.020 227 H CYS 29 H CYS 29 8.321 -7.985 -1.621 228 HA CYS 29 HA CYS 29 5.793 -6.476 -1.504 229 HB2 CYS 29 2HB CYS 29 6.572 -8.779 0.290 230 HB3 CYS 29 3HB CYS 29 5.006 -7.982 0.199 231 HG CYS 29 HG CYS 29 5.050 -8.858 -2.715 232 H ALA 30 H ALA 30 8.738 -7.363 0.240 233 HA ALA 30 HA ALA 30 8.784 -4.772 1.518 234 HB1 ALA 30 1HB ALA 30 8.003 -7.213 2.971 235 HB2 ALA 30 2HB ALA 30 9.207 -6.197 3.765 236 HB3 ALA 30 3HB ALA 30 7.643 -5.520 3.312 237 H HIS 31 H HIS 31 10.761 -4.712 3.087 238 HA HIS 31 HA HIS 31 12.952 -6.297 1.921 239 HB2 HIS 31 2HB HIS 31 14.371 -4.403 1.817 240 HB3 HIS 31 3HB HIS 31 12.839 -3.881 1.122 241 HD1 HIS 31 HD1 HIS 31 15.311 -2.484 3.049 242 HD2 HIS 31 HD2 HIS 31 11.211 -2.829 3.629 243 HE1 HIS 31 HE1 HIS 31 14.710 -0.679 4.694 244 H TYR 32 H TYR 32 15.024 -5.881 3.374 245 HA TYR 32 HA TYR 32 14.285 -5.883 6.207 246 HB2 TYR 32 2HB TYR 32 14.344 -8.250 5.285 247 HB3 TYR 32 3HB TYR 32 16.071 -8.019 5.042 248 HD1 TYR 32 HD2 TYR 32 13.473 -7.768 7.712 249 HD2 TYR 32 HD1 TYR 32 17.531 -8.604 6.744 250 HE1 TYR 32 HE2 TYR 32 13.883 -8.443 10.041 251 HE2 TYR 32 HE1 TYR 32 17.952 -9.283 9.070 252 HH TYR 32 HH TYR 32 15.441 -9.000 11.549 253 H ASP 33 H ASP 33 15.374 -4.056 6.722 254 HA ASP 33 HA ASP 33 17.106 -2.635 7.130 255 HB2 ASP 33 2HB ASP 33 18.333 -5.350 7.330 256 HB3 ASP 33 3HB ASP 33 19.396 -3.946 7.367 257 H TYR 34 H TYR 34 16.417 -3.352 4.318 258 HA TYR 34 HA TYR 34 17.109 -2.796 2.224 259 HB2 TYR 34 2HB TYR 34 19.449 -1.435 3.567 260 HB3 TYR 34 3HB TYR 34 18.799 -1.101 1.966 261 HD1 TYR 34 HD2 TYR 34 18.265 -0.683 5.575 262 HD2 TYR 34 HD1 TYR 34 16.813 0.239 1.683 263 HE1 TYR 34 HE2 TYR 34 16.792 1.035 6.538 264 HE2 TYR 34 HE1 TYR 34 15.337 1.961 2.636 265 HH TYR 34 HH TYR 34 15.675 3.328 5.435 266 H GLU 35 H GLU 35 18.302 -5.117 3.875 267 HA GLU 35 HA GLU 35 20.687 -5.619 2.237 268 HB2 GLU 35 2HB GLU 35 19.823 -7.355 4.525 269 HB3 GLU 35 3HB GLU 35 21.436 -7.106 3.873 270 HG2 GLU 35 2HG GLU 35 19.838 -5.124 5.477 271 HG3 GLU 35 3HG GLU 35 21.217 -6.064 6.044 272 H TRP 36 H TRP 36 17.736 -7.245 3.380 273 HA TRP 36 HA TRP 36 17.919 -9.028 1.041 274 HB2 TRP 36 2HB TRP 36 16.488 -9.507 3.664 275 HB3 TRP 36 3HB TRP 36 16.572 -10.635 2.314 276 HD1 TRP 36 HD1 TRP 36 18.630 -9.279 5.218 277 HE1 TRP 36 HE1 TRP 36 20.742 -10.726 5.489 278 HE3 TRP 36 HE3 TRP 36 18.226 -12.108 0.979 279 HZ2 TRP 36 HZ2 TRP 36 22.062 -12.793 4.091 280 HZ3 TRP 36 HZ3 TRP 36 19.955 -13.798 0.519 281 HH2 TRP 36 HH2 TRP 36 21.832 -14.131 2.044 282 H PHE 37 H PHE 37 15.963 -9.567 -0.063 283 HA PHE 37 HA PHE 37 13.775 -7.639 0.349 284 HB2 PHE 37 2HB PHE 37 15.438 -8.062 -1.999 285 HB3 PHE 37 3HB PHE 37 13.728 -8.274 -2.362 286 HD1 PHE 37 HD2 PHE 37 12.272 -6.358 -0.986 287 HD2 PHE 37 HD1 PHE 37 16.222 -5.984 -2.525 288 HE1 PHE 37 HE2 PHE 37 11.993 -3.916 -1.098 289 HE2 PHE 37 HE1 PHE 37 15.950 -3.542 -2.640 290 HZ PHE 37 HZ PHE 37 13.833 -2.505 -1.927 291 H ILE 38 H ILE 38 11.702 -8.391 0.082 292 HA ILE 38 HA ILE 38 11.436 -11.306 -0.039 293 HB ILE 38 HB ILE 38 9.292 -9.340 0.747 294 HG12 ILE 38 2HG1 ILE 38 11.209 -8.999 2.221 295 HG13 ILE 38 3HG1 ILE 38 9.913 -9.812 3.091 296 HG21 ILE 38 1HG2 ILE 38 8.051 -11.186 0.740 297 HG22 ILE 38 2HG2 ILE 38 9.462 -12.213 0.491 298 HG23 ILE 38 3HG2 ILE 38 8.996 -11.736 2.123 299 HD11 ILE 38 3HD1 ILE 38 11.049 -11.915 2.925 300 HD12 ILE 38 1HD1 ILE 38 12.289 -11.209 1.889 301 HD13 ILE 38 2HD1 ILE 38 12.160 -10.710 3.576 302 H ALA 39 H ALA 39 11.411 -11.771 -2.205 303 HA ALA 39 HA ALA 39 9.348 -10.453 -3.839 304 HB1 ALA 39 1HB ALA 39 11.511 -12.162 -4.996 305 HB2 ALA 39 2HB ALA 39 10.623 -10.826 -5.731 306 HB3 ALA 39 3HB ALA 39 11.855 -10.502 -4.511 307 H LYS 40 H LYS 40 8.018 -11.733 -5.208 308 HA LYS 40 HA LYS 40 7.819 -14.563 -4.412 309 HB2 LYS 40 2HB LYS 40 5.701 -12.460 -4.600 310 HB3 LYS 40 3HB LYS 40 5.279 -14.129 -4.960 311 HG2 LYS 40 2HG LYS 40 5.685 -14.836 -2.793 312 HG3 LYS 40 3HG LYS 40 6.705 -13.443 -2.424 313 HD2 LYS 40 2HD LYS 40 4.816 -12.805 -1.321 314 HD3 LYS 40 3HD LYS 40 4.442 -12.141 -2.913 315 HE2 LYS 40 2HE LYS 40 3.197 -14.214 -3.437 316 HE3 LYS 40 3HE LYS 40 3.508 -14.785 -1.798 317 HZ1 LYS 40 3HZ LYS 40 1.385 -13.259 -2.621 318 HZ2 LYS 40 1HZ LYS 40 2.383 -12.170 -1.798 319 HZ3 LYS 40 2HZ LYS 40 1.840 -13.570 -1.022 320 HA PRO 41 HA PRO 41 7.784 -15.651 -8.662 321 HB2 PRO 41 2HB PRO 41 6.007 -17.702 -8.718 322 HB3 PRO 41 3HB PRO 41 7.616 -17.844 -7.999 323 HG2 PRO 41 2HG PRO 41 4.978 -17.374 -6.663 324 HG3 PRO 41 3HG PRO 41 6.303 -18.449 -6.178 325 HD2 PRO 41 2HD PRO 41 5.902 -16.024 -5.040 326 HD3 PRO 41 3HD PRO 41 7.519 -16.732 -5.237 327 H ILE 42 H ILE 42 6.807 -15.037 -10.517 328 HA ILE 42 HA ILE 42 4.112 -13.897 -10.299 329 HB ILE 42 HB ILE 42 6.128 -13.507 -12.513 330 HG12 ILE 42 2HG1 ILE 42 5.461 -11.721 -10.163 331 HG13 ILE 42 3HG1 ILE 42 6.964 -12.610 -10.385 332 HG21 ILE 42 1HG2 ILE 42 4.467 -12.538 -13.616 333 HG22 ILE 42 2HG2 ILE 42 3.361 -12.885 -12.288 334 HG23 ILE 42 3HG2 ILE 42 4.278 -11.379 -12.300 335 HD11 ILE 42 3HD1 ILE 42 6.005 -10.136 -11.694 336 HD12 ILE 42 1HD1 ILE 42 7.619 -10.575 -11.134 337 HD13 ILE 42 2HD1 ILE 42 7.000 -11.237 -12.647 338 H ASN 43 H ASN 43 5.910 -16.438 -11.789 339 HA ASN 43 HA ASN 43 3.804 -17.002 -13.726 340 HB2 ASN 43 2HB ASN 43 6.368 -17.186 -14.147 341 HB3 ASN 43 3HB ASN 43 6.226 -18.725 -13.302 342 HD21 ASN 43 1HD2 ASN 43 7.098 -18.798 -15.813 343 HD22 ASN 43 2HD2 ASN 43 5.887 -19.416 -16.880 344 H ARG 43 H ARG 43 5.126 -18.224 -10.728 345 HA ARG 43 HA ARG 43 3.720 -20.709 -10.771 346 HB2 ARG 43 2HB ARG 43 4.813 -19.263 -8.356 347 HB3 ARG 43 3HB ARG 43 4.472 -20.981 -8.503 348 HG2 ARG 43 2HG ARG 43 6.524 -19.569 -10.184 349 HG3 ARG 43 3HG ARG 43 6.893 -20.323 -8.631 350 HD2 ARG 43 2HD ARG 43 7.421 -21.989 -10.158 351 HD3 ARG 43 3HD ARG 43 5.790 -22.422 -9.647 352 HE ARG 43 HE ARG 43 5.032 -21.973 -11.769 353 HH11 ARG 43 1HH1 ARG 43 8.271 -20.749 -11.400 354 HH12 ARG 43 2HH1 ARG 43 8.469 -20.397 -13.085 355 HH21 ARG 43 1HH2 ARG 43 5.282 -21.514 -13.990 356 HH22 ARG 43 2HH2 ARG 43 6.769 -20.831 -14.557 357 H LEU 44 H LEU 44 2.520 -20.937 -8.333 358 HA LEU 44 HA LEU 44 0.173 -19.204 -8.663 359 HB2 LEU 44 2HB LEU 44 -0.833 -21.023 -7.099 360 HB3 LEU 44 3HB LEU 44 -0.611 -21.351 -8.816 361 HG LEU 44 HG LEU 44 1.341 -22.683 -8.364 362 HD11 LEU 44 1HD1 LEU 44 2.190 -21.329 -6.480 363 HD12 LEU 44 2HD1 LEU 44 2.193 -23.060 -6.143 364 HD13 LEU 44 3HD1 LEU 44 0.942 -22.030 -5.448 365 HD21 LEU 44 3HD2 LEU 44 -1.251 -23.327 -7.565 366 HD22 LEU 44 1HD2 LEU 44 -0.212 -23.892 -6.256 367 HD23 LEU 44 2HD2 LEU 44 0.068 -24.448 -7.906 368 H GLY 45 H GLY 45 2.836 -18.926 -7.028 369 HA2 GLY 45 2HA GLY 45 2.759 -17.167 -5.281 370 HA3 GLY 45 3HA GLY 45 1.494 -18.121 -4.520 371 H GLY 46 H GLY 46 4.588 -17.278 -4.168 372 HA2 GLY 46 2HA GLY 46 5.143 -19.363 -2.308 373 HA3 GLY 46 3HA GLY 46 6.087 -19.567 -3.776 374 HA PRO 47 HA PRO 47 7.449 -15.386 -1.713 375 HB2 PRO 47 2HB PRO 47 6.735 -15.091 0.889 376 HB3 PRO 47 3HB PRO 47 5.743 -14.504 -0.451 377 HG2 PRO 47 2HG PRO 47 5.460 -17.013 1.158 378 HG3 PRO 47 3HG PRO 47 4.205 -15.883 0.618 379 HD2 PRO 47 2HD PRO 47 4.695 -18.228 -0.644 380 HD3 PRO 47 3HD PRO 47 4.134 -16.780 -1.504 381 H GLY 48 H GLY 48 9.558 -15.821 -1.510 382 HA2 GLY 48 2HA GLY 48 10.398 -17.619 0.680 383 HA3 GLY 48 3HA GLY 48 11.242 -17.496 -0.856 384 H LEU 49 H LEU 49 12.970 -16.221 -0.922 385 HA LEU 49 HA LEU 49 13.158 -13.715 0.370 386 HB2 LEU 49 2HB LEU 49 13.499 -15.678 2.166 387 HB3 LEU 49 3HB LEU 49 15.152 -15.539 1.570 388 HG LEU 49 HG LEU 49 13.847 -13.007 2.344 389 HD11 LEU 49 1HD1 LEU 49 14.778 -14.916 4.474 390 HD12 LEU 49 2HD1 LEU 49 13.081 -14.673 4.063 391 HD13 LEU 49 3HD1 LEU 49 14.038 -13.329 4.684 392 HD21 LEU 49 3HD2 LEU 49 16.547 -14.281 2.507 393 HD22 LEU 49 1HD2 LEU 49 16.164 -12.880 3.507 394 HD23 LEU 49 2HD2 LEU 49 16.067 -12.761 1.750 395 H VAL 50 H VAL 50 14.486 -12.553 -0.849 396 HA VAL 50 HA VAL 50 16.863 -13.820 -2.006 397 HB VAL 50 HB VAL 50 15.183 -13.918 -3.768 398 HG11 VAL 50 1HG1 VAL 50 13.780 -12.057 -2.943 399 HG12 VAL 50 2HG1 VAL 50 14.998 -10.917 -3.521 400 HG13 VAL 50 3HG1 VAL 50 14.131 -11.940 -4.667 401 HG21 VAL 50 3HG2 VAL 50 16.385 -12.595 -5.496 402 HG22 VAL 50 1HG2 VAL 50 17.303 -11.819 -4.206 403 HG23 VAL 50 2HG2 VAL 50 17.453 -13.555 -4.473 404 HA PRO 51 HA PRO 51 18.702 -10.088 -0.503 405 HB2 PRO 51 2HB PRO 51 21.121 -10.389 -1.699 406 HB3 PRO 51 3HB PRO 51 20.628 -11.321 -0.280 407 HG2 PRO 51 2HG PRO 51 20.611 -12.113 -3.167 408 HG3 PRO 51 3HG PRO 51 21.121 -13.052 -1.752 409 HD2 PRO 51 2HD PRO 51 18.707 -13.390 -2.931 410 HD3 PRO 51 3HD PRO 51 18.958 -13.614 -1.188 411 H VAL 52 H VAL 52 19.565 -8.080 -1.296 412 HA VAL 52 HA VAL 52 18.326 -7.213 -3.714 413 HB VAL 52 HB VAL 52 20.405 -5.674 -2.171 414 HG11 VAL 52 1HG1 VAL 52 19.819 -3.933 -3.433 415 HG12 VAL 52 2HG1 VAL 52 18.980 -5.087 -4.470 416 HG13 VAL 52 3HG1 VAL 52 18.100 -4.244 -3.195 417 HG21 VAL 52 3HG2 VAL 52 19.081 -5.838 -0.379 418 HG22 VAL 52 1HG2 VAL 52 17.953 -4.808 -1.260 419 HG23 VAL 52 2HG2 VAL 52 17.771 -6.561 -1.311 420 H SER 53 H SER 53 21.411 -8.502 -2.933 421 HA SER 53 HA SER 53 22.805 -7.364 -5.178 422 HB2 SER 53 2HB SER 53 23.644 -9.746 -3.517 423 HB3 SER 53 3HB SER 53 24.677 -8.691 -4.481 424 HG SER 53 HG SER 53 23.999 -8.420 -1.941 425 H TYR 54 H TYR 54 20.418 -9.575 -5.021 426 HA TYR 54 HA TYR 54 21.391 -10.978 -7.421 427 HB2 TYR 54 2HB TYR 54 19.976 -12.092 -5.015 428 HB3 TYR 54 3HB TYR 54 19.844 -12.885 -6.581 429 HD1 TYR 54 HD2 TYR 54 22.336 -11.706 -4.082 430 HD2 TYR 54 HD1 TYR 54 21.502 -14.371 -7.291 431 HE1 TYR 54 HE2 TYR 54 24.468 -12.862 -3.668 432 HE2 TYR 54 HE1 TYR 54 23.630 -15.536 -6.886 433 HH TYR 54 HH TYR 54 25.474 -15.068 -4.080 434 H VAL 55 H VAL 55 19.563 -8.594 -6.763 435 HA VAL 55 HA VAL 55 17.551 -9.270 -8.742 436 HB VAL 55 HB VAL 55 15.699 -8.351 -7.330 437 HG11 VAL 55 1HG1 VAL 55 15.356 -10.424 -6.052 438 HG12 VAL 55 2HG1 VAL 55 15.915 -10.742 -7.695 439 HG13 VAL 55 3HG1 VAL 55 17.038 -10.867 -6.341 440 HG21 VAL 55 3HG2 VAL 55 17.862 -7.858 -5.539 441 HG22 VAL 55 1HG2 VAL 55 16.165 -7.406 -5.376 442 HG23 VAL 55 2HG2 VAL 55 16.726 -8.963 -4.766 443 H ARG 56 H ARG 56 16.336 -7.362 -9.470 444 HA ARG 56 HA ARG 56 17.739 -4.835 -8.914 445 HB2 ARG 56 2HB ARG 56 18.583 -5.524 -11.027 446 HB3 ARG 56 3HB ARG 56 16.987 -6.005 -11.587 447 HG2 ARG 56 2HG ARG 56 16.295 -3.636 -11.546 448 HG3 ARG 56 3HG ARG 56 17.941 -3.195 -11.088 449 HD2 ARG 56 2HD ARG 56 17.043 -4.518 -13.642 450 HD3 ARG 56 3HD ARG 56 17.700 -2.892 -13.454 451 HE ARG 56 HE ARG 56 19.178 -5.307 -13.713 452 HH11 ARG 56 1HH1 ARG 56 19.204 -2.183 -12.175 453 HH12 ARG 56 2HH1 ARG 56 20.931 -2.108 -12.063 454 HH21 ARG 56 1HH2 ARG 56 21.453 -5.219 -13.570 455 HH22 ARG 56 2HH2 ARG 56 22.209 -3.835 -12.857 456 H ILE 57 H ILE 57 16.458 -3.138 -8.504 457 HA ILE 57 HA ILE 57 13.607 -3.547 -8.392 458 HB ILE 57 HB ILE 57 15.133 -1.011 -7.803 459 HG12 ILE 57 2HG1 ILE 57 15.992 -2.898 -6.465 460 HG13 ILE 57 3HG1 ILE 57 15.147 -1.721 -5.466 461 HG21 ILE 57 1HG2 ILE 57 13.147 -0.124 -7.370 462 HG22 ILE 57 2HG2 ILE 57 12.371 -1.622 -7.880 463 HG23 ILE 57 3HG2 ILE 57 12.822 -1.394 -6.190 464 HD11 ILE 57 3HD1 ILE 57 13.929 -3.371 -4.651 465 HD12 ILE 57 1HD1 ILE 57 13.225 -3.603 -6.250 466 HD13 ILE 57 2HD1 ILE 57 14.658 -4.516 -5.776 467 H ILE 58 H ILE 58 12.466 -3.395 -10.212 468 HA ILE 58 HA ILE 58 12.955 -1.073 -11.958 469 HB ILE 58 HB ILE 58 12.154 -2.498 -13.866 470 HG12 ILE 58 2HG1 ILE 58 12.922 -4.915 -12.296 471 HG13 ILE 58 3HG1 ILE 58 11.308 -4.255 -12.056 472 HG21 ILE 58 1HG2 ILE 58 14.669 -2.169 -12.814 473 HG22 ILE 58 2HG2 ILE 58 14.565 -3.913 -13.045 474 HG23 ILE 58 3HG2 ILE 58 14.297 -2.826 -14.408 475 HD11 ILE 58 3HD1 ILE 58 12.370 -5.813 -14.248 476 HD12 ILE 58 1HD1 ILE 58 10.698 -5.484 -13.796 477 HD13 ILE 58 2HD1 ILE 58 11.582 -4.335 -14.800 478 H ASP 59 H ASP 59 11.188 0.034 -12.670 479 HA ASP 59 HA ASP 59 8.731 -0.373 -11.247 480 HB2 ASP 59 2HB ASP 59 9.767 1.656 -13.183 481 HB3 ASP 59 3HB ASP 59 8.030 1.561 -12.905 482 H LEU 60 H LEU 60 6.970 -1.437 -11.887 483 HA LEU 60 HA LEU 60 6.956 -3.082 -14.153 484 HB2 LEU 60 2HB LEU 60 5.336 -2.664 -11.901 485 HB3 LEU 60 3HB LEU 60 4.284 -2.452 -13.299 486 HG LEU 60 HG LEU 60 5.883 -4.901 -12.569 487 HD11 LEU 60 1HD1 LEU 60 3.823 -5.947 -12.184 488 HD12 LEU 60 2HD1 LEU 60 2.920 -4.660 -12.981 489 HD13 LEU 60 3HD1 LEU 60 3.674 -4.367 -11.414 490 HD21 LEU 60 3HD2 LEU 60 6.028 -4.729 -14.931 491 HD22 LEU 60 1HD2 LEU 60 4.338 -4.243 -15.067 492 HD23 LEU 60 2HD2 LEU 60 4.745 -5.890 -14.584 493 H MET 61 H MET 61 5.709 0.157 -13.622 494 HA MET 61 HA MET 61 4.382 0.244 -16.191 495 HB2 MET 61 2HB MET 61 4.922 2.506 -14.261 496 HB3 MET 61 3HB MET 61 3.778 2.514 -15.597 497 HG2 MET 61 2HG MET 61 3.599 0.698 -13.206 498 HG3 MET 61 3HG MET 61 2.728 2.219 -13.381 499 HE1 MET 61 3HE MET 61 2.683 -1.101 -13.278 500 HE2 MET 61 1HE MET 61 0.927 -1.194 -13.426 501 HE3 MET 61 2HE MET 61 1.955 -1.850 -14.700 502 H ASP 62 H ASP 62 7.525 0.370 -15.288 503 HA ASP 62 HA ASP 62 8.479 1.238 -17.768 504 HB2 ASP 62 2HB ASP 62 7.666 3.419 -16.372 505 HB3 ASP 62 3HB ASP 62 9.341 3.304 -15.840 506 HA PRO 63 HA PRO 63 11.413 -1.138 -15.137 507 HB2 PRO 63 2HB PRO 63 12.159 -2.827 -17.127 508 HB3 PRO 63 3HB PRO 63 10.727 -3.095 -16.126 509 HG2 PRO 63 2HG PRO 63 10.923 -1.928 -18.875 510 HG3 PRO 63 3HG PRO 63 9.751 -3.095 -18.236 511 HD2 PRO 63 2HD PRO 63 9.184 -0.461 -18.509 512 HD3 PRO 63 3HD PRO 63 8.489 -1.459 -17.215 513 H ALA 64 H ALA 64 11.615 0.867 -17.854 514 HA ALA 64 HA ALA 64 14.509 0.626 -18.120 515 HB1 ALA 64 1HB ALA 64 14.274 1.489 -20.174 516 HB2 ALA 64 2HB ALA 64 12.559 1.139 -19.953 517 HB3 ALA 64 3HB ALA 64 13.178 2.757 -19.622 518 H LYS 65 H LYS 65 12.335 2.310 -16.227 519 HA LYS 65 HA LYS 65 13.796 4.796 -16.072 520 HB2 LYS 65 2HB LYS 65 11.363 3.658 -14.769 521 HB3 LYS 65 3HB LYS 65 12.189 4.991 -13.973 522 HG2 LYS 65 2HG LYS 65 11.986 5.814 -16.606 523 HG3 LYS 65 3HG LYS 65 10.452 5.001 -16.287 524 HD2 LYS 65 2HD LYS 65 10.156 7.285 -15.702 525 HD3 LYS 65 3HD LYS 65 10.282 6.384 -14.189 526 HE2 LYS 65 2HE LYS 65 12.262 7.333 -13.634 527 HE3 LYS 65 3HE LYS 65 12.809 7.426 -15.307 528 HZ1 LYS 65 3HZ LYS 65 12.056 9.542 -13.881 529 HZ2 LYS 65 1HZ LYS 65 10.583 9.153 -14.615 530 HZ3 LYS 65 2HZ LYS 65 11.944 9.470 -15.567 531 H TYR 66 H TYR 66 13.278 1.981 -13.967 532 HA TYR 66 HA TYR 66 15.459 2.926 -12.242 533 HB2 TYR 66 2HB TYR 66 13.279 0.886 -11.778 534 HB3 TYR 66 3HB TYR 66 14.607 1.163 -10.656 535 HD1 TYR 66 HD1 TYR 66 11.971 3.102 -12.466 536 HD2 TYR 66 HD2 TYR 66 14.246 2.619 -8.904 537 HE1 TYR 66 HE1 TYR 66 10.690 4.916 -11.410 538 HE2 TYR 66 HE2 TYR 66 12.971 4.432 -7.837 539 HH TYR 66 HH TYR 66 10.146 5.811 -9.318 540 H ALA 67 H ALA 67 15.690 1.557 -14.906 541 HA ALA 67 HA ALA 67 16.807 -1.037 -14.275 542 HB1 ALA 67 1HB ALA 67 16.322 -1.442 -16.399 543 HB2 ALA 67 2HB ALA 67 15.811 0.234 -16.602 544 HB3 ALA 67 3HB ALA 67 17.487 -0.220 -16.911 545 H SER 68 H SER 68 17.899 2.186 -14.405 546 HA SER 68 HA SER 68 20.681 1.429 -14.871 547 HB2 SER 68 2HB SER 68 21.084 3.906 -14.752 548 HB3 SER 68 3HB SER 68 19.967 3.420 -16.026 549 HG SER 68 HG SER 68 19.237 4.419 -13.470 550 H VAL 69 H VAL 69 18.513 2.211 -12.305 551 HA VAL 69 HA VAL 69 20.161 3.205 -10.332 552 HB VAL 69 HB VAL 69 17.674 2.823 -10.168 553 HG11 VAL 69 1HG1 VAL 69 18.131 0.281 -10.759 554 HG12 VAL 69 2HG1 VAL 69 18.210 0.146 -9.001 555 HG13 VAL 69 3HG1 VAL 69 16.755 0.775 -9.773 556 HG21 VAL 69 3HG2 VAL 69 19.544 3.128 -8.228 557 HG22 VAL 69 1HG2 VAL 69 17.803 3.139 -7.945 558 HG23 VAL 69 2HG2 VAL 69 18.730 1.661 -7.684 559 H ASP 70 H ASP 70 21.216 2.188 -8.527 560 HA ASP 70 HA ASP 70 22.344 -0.445 -9.218 561 HB2 ASP 70 2HB ASP 70 23.696 1.923 -8.841 562 HB3 ASP 70 3HB ASP 70 23.839 1.149 -7.265 563 H THR 71 H THR 71 21.309 -1.943 -8.059 564 HA THR 71 HA THR 71 20.128 -1.450 -5.519 565 HB THR 71 HB THR 71 20.351 -4.187 -5.655 566 HG1 THR 71 HG1 THR 71 20.938 -4.640 -7.634 567 HG21 THR 71 3HG2 THR 71 18.330 -2.655 -5.362 568 HG22 THR 71 1HG2 THR 71 18.064 -4.172 -6.221 569 HG23 THR 71 2HG2 THR 71 18.212 -2.663 -7.122 570 H TYR 72 H TYR 72 23.285 -2.339 -6.533 571 HA TYR 72 HA TYR 72 24.169 -3.766 -4.278 572 HB2 TYR 72 2HB TYR 72 25.528 -3.839 -6.222 573 HB3 TYR 72 3HB TYR 72 25.619 -2.084 -6.318 574 HD1 TYR 72 HD2 TYR 72 26.475 -4.820 -3.913 575 HD2 TYR 72 HD1 TYR 72 27.586 -1.094 -5.642 576 HE1 TYR 72 HE2 TYR 72 28.581 -4.865 -2.643 577 HE2 TYR 72 HE1 TYR 72 29.695 -1.129 -4.377 578 HH TYR 72 HH TYR 72 30.608 -2.155 -2.348 579 H ASP 73 H ASP 73 24.578 -0.317 -5.086 580 HA ASP 73 HA ASP 73 25.740 0.406 -2.624 581 HB2 ASP 73 2HB ASP 73 25.761 1.731 -4.796 582 HB3 ASP 73 3HB ASP 73 24.126 2.245 -4.389 583 H ARG 74 H ARG 74 24.834 0.366 -0.685 584 HA ARG 74 HA ARG 74 22.129 -0.057 -0.172 585 HB2 ARG 74 2HB ARG 74 22.634 0.378 2.140 586 HB3 ARG 74 3HB ARG 74 23.991 -0.483 1.427 587 HG2 ARG 74 2HG ARG 74 24.052 2.493 1.513 588 HG3 ARG 74 3HG ARG 74 24.379 1.577 2.986 589 HD2 ARG 74 2HD ARG 74 25.865 0.318 0.984 590 HD3 ARG 74 3HD ARG 74 26.069 2.046 0.696 591 HE ARG 74 HE ARG 74 27.106 0.522 2.898 592 HH11 ARG 74 1HH1 ARG 74 26.129 3.685 1.821 593 HH12 ARG 74 2HH1 ARG 74 27.124 4.524 2.965 594 HH21 ARG 74 1HH2 ARG 74 28.419 1.615 4.409 595 HH22 ARG 74 2HH2 ARG 74 28.426 3.346 4.436 596 H GLU 75 H GLU 75 23.822 2.842 -0.918 597 HA GLU 75 HA GLU 75 22.075 4.711 0.292 598 HB2 GLU 75 2HB GLU 75 24.084 4.864 -1.934 599 HB3 GLU 75 3HB GLU 75 23.051 6.239 -1.572 600 HG2 GLU 75 2HG GLU 75 23.953 6.475 0.593 601 HG3 GLU 75 3HG GLU 75 24.751 4.905 0.511 602 H GLN 76 H GLN 76 22.336 3.649 -3.104 603 HA GLN 76 HA GLN 76 20.091 5.013 -4.050 604 HB2 GLN 76 2HB GLN 76 21.154 2.376 -5.072 605 HB3 GLN 76 3HB GLN 76 20.181 3.534 -5.968 606 HG2 GLN 76 2HG GLN 76 22.556 4.781 -4.920 607 HG3 GLN 76 3HG GLN 76 22.956 3.362 -5.886 608 HE21 GLN 76 1HE2 GLN 76 22.843 3.486 -8.044 609 HE22 GLN 76 2HE2 GLN 76 22.283 4.862 -8.925 610 H VAL 77 H VAL 77 20.348 1.564 -3.170 611 HA VAL 77 HA VAL 77 17.691 0.867 -3.469 612 HB VAL 77 HB VAL 77 19.719 -0.618 -2.878 613 HG11 VAL 77 1HG1 VAL 77 19.989 -1.183 -0.549 614 HG12 VAL 77 2HG1 VAL 77 20.225 0.554 -0.755 615 HG13 VAL 77 3HG1 VAL 77 18.710 -0.060 -0.092 616 HG21 VAL 77 3HG2 VAL 77 16.870 -0.932 -2.239 617 HG22 VAL 77 1HG2 VAL 77 17.941 -1.956 -3.195 618 HG23 VAL 77 2HG2 VAL 77 17.942 -2.078 -1.436 619 H MET 78 H MET 78 19.250 2.583 -0.849 620 HA MET 78 HA MET 78 17.155 2.344 1.043 621 HB2 MET 78 2HB MET 78 19.625 3.929 0.758 622 HB3 MET 78 3HB MET 78 18.367 4.681 1.730 623 HG2 MET 78 2HG MET 78 18.262 2.612 3.094 624 HG3 MET 78 3HG MET 78 19.631 1.989 2.176 625 HE1 MET 78 3HE MET 78 21.787 2.040 2.929 626 HE2 MET 78 1HE MET 78 22.120 3.589 2.154 627 HE3 MET 78 2HE MET 78 22.619 3.313 3.823 628 H LYS 79 H LYS 79 18.075 5.051 -1.091 629 HA LYS 79 HA LYS 79 15.959 6.745 -0.487 630 HB2 LYS 79 2HB LYS 79 17.385 6.419 -3.134 631 HB3 LYS 79 3HB LYS 79 16.396 7.799 -2.675 632 HG2 LYS 79 2HG LYS 79 17.968 8.627 -1.235 633 HG3 LYS 79 3HG LYS 79 18.684 7.042 -0.932 634 HD2 LYS 79 2HD LYS 79 19.808 7.051 -3.017 635 HD3 LYS 79 3HD LYS 79 18.874 8.433 -3.595 636 HE2 LYS 79 2HE LYS 79 19.920 9.777 -1.746 637 HE3 LYS 79 3HE LYS 79 20.982 8.402 -1.443 638 HZ1 LYS 79 3HZ LYS 79 20.853 10.122 -3.844 639 HZ2 LYS 79 1HZ LYS 79 21.589 8.599 -3.883 640 HZ3 LYS 79 2HZ LYS 79 22.184 9.799 -2.850 641 H ILE 80 H ILE 80 16.136 4.087 -2.797 642 HA ILE 80 HA ILE 80 13.659 4.557 -4.066 643 HB ILE 80 HB ILE 80 15.154 1.955 -3.719 644 HG12 ILE 80 2HG1 ILE 80 15.084 3.488 -6.274 645 HG13 ILE 80 3HG1 ILE 80 16.117 4.094 -4.984 646 HG21 ILE 80 1HG2 ILE 80 13.330 1.006 -4.570 647 HG22 ILE 80 2HG2 ILE 80 12.584 2.569 -4.896 648 HG23 ILE 80 3HG2 ILE 80 13.690 1.858 -6.071 649 HD11 ILE 80 3HD1 ILE 80 16.569 1.948 -6.814 650 HD12 ILE 80 1HD1 ILE 80 17.672 2.673 -5.645 651 HD13 ILE 80 2HD1 ILE 80 16.620 1.344 -5.158 652 H ILE 81 H ILE 81 14.542 2.266 -1.481 653 HA ILE 81 HA ILE 81 11.946 1.295 -1.031 654 HB ILE 81 HB ILE 81 14.300 1.450 0.853 655 HG12 ILE 81 2HG1 ILE 81 13.209 -0.917 -0.675 656 HG13 ILE 81 3HG1 ILE 81 14.526 0.092 -1.264 657 HG21 ILE 81 1HG2 ILE 81 12.653 -0.652 1.628 658 HG22 ILE 81 2HG2 ILE 81 12.889 0.877 2.473 659 HG23 ILE 81 3HG2 ILE 81 11.555 0.696 1.333 660 HD11 ILE 81 3HD1 ILE 81 14.772 -2.166 0.273 661 HD12 ILE 81 1HD1 ILE 81 16.013 -0.940 0.022 662 HD13 ILE 81 2HD1 ILE 81 14.969 -0.861 1.441 663 H ASP 82 H ASP 82 13.670 4.070 0.267 664 HA ASP 82 HA ASP 82 11.759 4.690 2.286 665 HB2 ASP 82 2HB ASP 82 14.169 5.960 1.140 666 HB3 ASP 82 3HB ASP 82 12.983 7.068 1.825 667 H GLU 83 H GLU 83 12.326 5.885 -1.005 668 HA GLU 83 HA GLU 83 10.244 7.808 -0.965 669 HB2 GLU 83 2HB GLU 83 11.816 6.481 -3.156 670 HB3 GLU 83 3HB GLU 83 10.475 7.554 -3.533 671 HG2 GLU 83 2HG GLU 83 12.865 8.318 -1.873 672 HG3 GLU 83 3HG GLU 83 12.675 8.666 -3.590 673 H PHE 84 H PHE 84 10.431 4.505 -2.263 674 HA PHE 84 HA PHE 84 7.748 4.452 -3.192 675 HB2 PHE 84 2HB PHE 84 9.870 2.388 -2.735 676 HB3 PHE 84 3HB PHE 84 8.218 1.873 -3.055 677 HD1 PHE 84 HD2 PHE 84 10.761 4.235 -4.423 678 HD2 PHE 84 HD1 PHE 84 7.628 1.470 -5.232 679 HE1 PHE 84 HE2 PHE 84 11.149 4.507 -6.837 680 HE2 PHE 84 HE1 PHE 84 8.011 1.737 -7.648 681 HZ PHE 84 HZ PHE 84 9.773 3.258 -8.453 682 H LYS 85 H LYS 85 9.050 4.353 -0.098 683 HA LYS 85 HA LYS 85 8.201 3.920 1.967 684 HB2 LYS 85 2HB LYS 85 5.671 4.254 0.368 685 HB3 LYS 85 3HB LYS 85 5.636 3.929 2.096 686 HG2 LYS 85 2HG LYS 85 7.181 6.229 0.950 687 HG3 LYS 85 3HG LYS 85 5.467 6.355 1.353 688 HD2 LYS 85 2HD LYS 85 5.869 5.979 3.639 689 HD3 LYS 85 3HD LYS 85 7.499 5.372 3.338 690 HE2 LYS 85 2HE LYS 85 8.316 7.528 2.844 691 HE3 LYS 85 3HE LYS 85 6.691 8.195 2.693 692 HZ1 LYS 85 3HZ LYS 85 6.455 7.580 5.138 693 HZ2 LYS 85 1HZ LYS 85 7.431 8.911 4.764 694 HZ3 LYS 85 2HZ LYS 85 8.139 7.424 5.150 695 H ILE 86 H ILE 86 9.216 1.712 0.961 696 HA ILE 86 HA ILE 86 7.250 -0.427 0.958 697 HB ILE 86 HB ILE 86 10.249 -0.712 0.821 698 HG12 ILE 86 2HG1 ILE 86 8.291 -0.421 -1.468 699 HG13 ILE 86 3HG1 ILE 86 9.439 0.809 -0.954 700 HG21 ILE 86 1HG2 ILE 86 8.346 -2.617 1.165 701 HG22 ILE 86 2HG2 ILE 86 8.488 -2.585 -0.592 702 HG23 ILE 86 3HG2 ILE 86 9.912 -2.893 0.402 703 HD11 ILE 86 3HD1 ILE 86 10.362 -0.260 -2.845 704 HD12 ILE 86 1HD1 ILE 86 11.263 -0.841 -1.444 705 HD13 ILE 86 2HD1 ILE 86 10.031 -1.862 -2.187 706 HA PRO 87 HA PRO 87 7.677 -1.042 5.341 707 HB2 PRO 87 2HB PRO 87 6.140 -3.276 5.472 708 HB3 PRO 87 3HB PRO 87 5.462 -1.652 5.309 709 HG2 PRO 87 2HG PRO 87 5.929 -3.730 3.205 710 HG3 PRO 87 3HG PRO 87 4.525 -2.672 3.441 711 HD2 PRO 87 2HD PRO 87 6.441 -2.162 1.597 712 HD3 PRO 87 3HD PRO 87 5.556 -0.872 2.435 713 H THR 88 H THR 88 8.453 -2.727 6.796 714 HA THR 88 HA THR 88 10.576 -4.277 5.555 715 HB THR 88 HB THR 88 10.355 -4.634 8.422 716 HG1 THR 88 HG1 THR 88 9.404 -2.613 8.492 717 HG21 THR 88 3HG2 THR 88 12.423 -3.313 6.662 718 HG22 THR 88 1HG2 THR 88 12.399 -5.007 7.148 719 HG23 THR 88 2HG2 THR 88 12.650 -3.746 8.356 720 H VAL 89 H VAL 89 10.999 -6.507 6.457 721 HA VAL 89 HA VAL 89 9.006 -8.273 5.760 722 HB VAL 89 HB VAL 89 11.255 -8.734 7.723 723 HG11 VAL 89 1HG1 VAL 89 10.598 -11.109 6.381 724 HG12 VAL 89 2HG1 VAL 89 10.372 -10.739 8.092 725 HG13 VAL 89 3HG1 VAL 89 9.072 -10.424 6.941 726 HG21 VAL 89 3HG2 VAL 89 11.032 -8.872 4.746 727 HG22 VAL 89 1HG2 VAL 89 12.307 -8.174 5.745 728 HG23 VAL 89 2HG2 VAL 89 12.165 -9.925 5.593 729 H GLU 90 H GLU 90 9.997 -7.502 9.103 730 HA GLU 90 HA GLU 90 8.128 -8.917 10.499 731 HB2 GLU 90 2HB GLU 90 9.362 -6.229 11.042 732 HB3 GLU 90 3HB GLU 90 8.231 -6.955 12.175 733 HG2 GLU 90 2HG GLU 90 9.666 -8.791 12.577 734 HG3 GLU 90 3HG GLU 90 10.708 -8.360 11.222 735 H GLN 91 H GLN 91 7.719 -5.572 9.339 736 HA GLN 91 HA GLN 91 5.101 -5.194 10.197 737 HB2 GLN 91 2HB GLN 91 6.258 -4.055 7.653 738 HB3 GLN 91 3HB GLN 91 4.988 -3.364 8.654 739 HG2 GLN 91 2HG GLN 91 7.904 -3.630 9.333 740 HG3 GLN 91 3HG GLN 91 7.002 -2.146 9.031 741 HE21 GLN 91 1HE2 GLN 91 8.491 -3.525 11.389 742 HE22 GLN 91 2HE2 GLN 91 7.433 -3.234 12.723 743 H TRP 92 H TRP 92 6.342 -6.804 7.341 744 HA TRP 92 HA TRP 92 3.839 -7.021 6.000 745 HB2 TRP 92 2HB TRP 92 5.995 -7.189 4.816 746 HB3 TRP 92 3HB TRP 92 6.347 -8.685 5.678 747 HD1 TRP 92 HD1 TRP 92 3.300 -7.486 3.568 748 HE1 TRP 92 HE1 TRP 92 2.683 -9.382 1.939 749 HE3 TRP 92 HE3 TRP 92 6.891 -10.881 4.877 750 HZ2 TRP 92 HZ2 TRP 92 3.598 -11.973 1.296 751 HZ3 TRP 92 HZ3 TRP 92 6.951 -13.044 3.707 752 HH2 TRP 92 HH2 TRP 92 5.338 -13.578 1.954 753 H LYS 93 H LYS 93 5.600 -9.035 8.280 754 HA LYS 93 HA LYS 93 3.951 -11.331 8.030 755 HB2 LYS 93 2HB LYS 93 5.443 -10.611 10.537 756 HB3 LYS 93 3HB LYS 93 5.126 -12.206 9.866 757 HG2 LYS 93 2HG LYS 93 7.118 -10.159 8.955 758 HG3 LYS 93 3HG LYS 93 7.403 -11.816 9.491 759 HD2 LYS 93 2HD LYS 93 6.128 -10.903 6.919 760 HD3 LYS 93 3HD LYS 93 7.644 -11.784 7.120 761 HE2 LYS 93 2HE LYS 93 5.834 -13.410 8.384 762 HE3 LYS 93 3HE LYS 93 4.892 -12.764 7.041 763 HZ1 LYS 93 3HZ LYS 93 5.892 -14.652 6.173 764 HZ2 LYS 93 1HZ LYS 93 7.367 -14.370 6.951 765 HZ3 LYS 93 2HZ LYS 93 6.908 -13.411 5.635 766 H ASP 94 H ASP 94 3.856 -8.478 10.090 767 HA ASP 94 HA ASP 94 1.757 -9.414 11.774 768 HB2 ASP 94 2HB ASP 94 3.423 -7.556 12.291 769 HB3 ASP 94 3HB ASP 94 2.446 -6.524 11.250 770 H GLN 95 H GLN 95 1.835 -7.125 9.048 771 HA GLN 95 HA GLN 95 -0.899 -6.558 8.980 772 HB2 GLN 95 2HB GLN 95 -0.530 -5.747 6.731 773 HB3 GLN 95 3HB GLN 95 0.834 -5.291 7.744 774 HG2 GLN 95 2HG GLN 95 2.112 -7.186 6.834 775 HG3 GLN 95 3HG GLN 95 0.754 -7.565 5.775 776 HE21 GLN 95 1HE2 GLN 95 2.670 -4.718 6.692 777 HE22 GLN 95 2HE2 GLN 95 2.881 -4.131 5.081 778 H THR 96 H THR 96 0.951 -9.166 7.495 779 HA THR 96 HA THR 96 -1.200 -10.205 5.950 780 HB THR 96 HB THR 96 0.231 -12.283 5.833 781 HG1 THR 96 HG1 THR 96 2.262 -12.196 6.772 782 HG21 THR 96 3HG2 THR 96 2.118 -11.081 4.607 783 HG22 THR 96 1HG2 THR 96 1.321 -9.581 5.080 784 HG23 THR 96 2HG2 THR 96 0.475 -10.746 4.061 785 H ARG 97 H ARG 97 0.223 -11.142 9.071 786 HA ARG 97 HA ARG 97 -1.366 -13.362 9.596 787 HB2 ARG 97 2HB ARG 97 0.004 -11.371 11.385 788 HB3 ARG 97 3HB ARG 97 -0.952 -12.685 12.057 789 HG2 ARG 97 2HG ARG 97 1.017 -13.493 10.036 790 HG3 ARG 97 3HG ARG 97 1.692 -12.829 11.525 791 HD2 ARG 97 2HD ARG 97 -0.352 -15.042 11.422 792 HD3 ARG 97 3HD ARG 97 1.387 -15.303 11.552 793 HE ARG 97 HE ARG 97 0.872 -13.658 13.626 794 HH11 ARG 97 1HH1 ARG 97 -0.564 -16.642 12.552 795 HH12 ARG 97 2HH1 ARG 97 -1.014 -17.151 14.145 796 HH21 ARG 97 1HH2 ARG 97 0.284 -14.317 15.730 797 HH22 ARG 97 2HH2 ARG 97 -0.532 -15.828 15.952 798 H ARG 98 H ARG 98 -1.946 -9.946 10.358 799 HA ARG 98 HA ARG 98 -4.459 -10.443 11.629 800 HB2 ARG 98 2HB ARG 98 -4.686 -8.049 11.735 801 HB3 ARG 98 3HB ARG 98 -3.022 -8.468 12.120 802 HG2 ARG 98 2HG ARG 98 -2.360 -7.884 9.829 803 HG3 ARG 98 3HG ARG 98 -4.027 -7.420 9.483 804 HD2 ARG 98 2HD ARG 98 -2.884 -6.177 11.881 805 HD3 ARG 98 3HD ARG 98 -2.087 -5.729 10.373 806 HE ARG 98 HE ARG 98 -4.784 -5.471 9.895 807 HH11 ARG 98 1HH1 ARG 98 -2.472 -4.115 12.117 808 HH12 ARG 98 2HH1 ARG 98 -3.307 -2.604 12.267 809 HH21 ARG 98 1HH2 ARG 98 -5.893 -3.486 10.085 810 HH22 ARG 98 2HH2 ARG 98 -5.253 -2.248 11.112 811 H TYR 99 H TYR 99 -3.416 -9.589 8.388 812 HA TYR 99 HA TYR 99 -5.932 -8.870 7.344 813 HB2 TYR 99 2HB TYR 99 -3.966 -8.272 6.120 814 HB3 TYR 99 3HB TYR 99 -3.439 -9.948 6.025 815 HD1 TYR 99 HD2 TYR 99 -6.805 -8.506 5.348 816 HD2 TYR 99 HD1 TYR 99 -3.352 -10.401 3.738 817 HE1 TYR 99 HE2 TYR 99 -7.949 -8.738 3.182 818 HE2 TYR 99 HE1 TYR 99 -4.485 -10.637 1.568 819 HH TYR 99 HH TYR 99 -6.316 -9.600 0.325 820 H LYS 100 H LYS 100 -4.320 -11.963 7.741 821 HA LYS 100 HA LYS 100 -6.259 -13.432 6.213 822 HB2 LYS 100 2HB LYS 100 -3.965 -14.201 7.997 823 HB3 LYS 100 3HB LYS 100 -5.088 -15.414 7.397 824 HG2 LYS 100 2HG LYS 100 -3.755 -13.537 5.494 825 HG3 LYS 100 3HG LYS 100 -2.892 -14.948 6.110 826 HD2 LYS 100 2HD LYS 100 -4.786 -16.365 5.328 827 HD3 LYS 100 3HD LYS 100 -5.497 -14.929 4.588 828 HE2 LYS 100 2HE LYS 100 -3.210 -14.696 3.405 829 HE3 LYS 100 3HE LYS 100 -2.980 -16.384 3.859 830 HZ1 LYS 100 3HZ LYS 100 -4.266 -15.488 1.634 831 HZ2 LYS 100 1HZ LYS 100 -5.538 -15.907 2.668 832 HZ3 LYS 100 2HZ LYS 100 -4.360 -17.053 2.269 833 H GLU 101 H GLU 101 -5.918 -12.405 9.500 834 HA GLU 101 HA GLU 101 -7.636 -14.310 10.706 835 HB2 GLU 101 2HB GLU 101 -6.648 -11.588 11.503 836 HB3 GLU 101 3HB GLU 101 -7.856 -12.421 12.471 837 HG2 GLU 101 2HG GLU 101 -5.255 -13.717 11.741 838 HG3 GLU 101 3HG GLU 101 -5.412 -12.665 13.146 839 H SER 102 H SER 102 -9.663 -13.376 11.940 840 HA SER 102 HA SER 102 -11.666 -12.970 10.040 841 HB2 SER 102 2HB SER 102 -12.229 -13.893 12.189 842 HB3 SER 102 3HB SER 102 -11.653 -12.448 13.020 843 HG SER 102 HG SER 102 -13.542 -11.602 12.724 844 H SER 103 H SER 103 -11.960 -11.254 8.794 845 HA SER 103 HA SER 103 -12.218 -8.628 9.933 846 HB2 SER 103 2HB SER 103 -10.031 -9.071 7.888 847 HB3 SER 103 3HB SER 103 -10.475 -7.540 8.644 848 HG SER 103 HG SER 103 -8.685 -8.413 9.693 849 H ILE 104 H ILE 104 -12.220 -7.034 7.788 850 HA ILE 104 HA ILE 104 -14.517 -7.973 6.318 851 HB ILE 104 HB ILE 104 -13.043 -5.389 5.851 852 HG12 ILE 104 2HG1 ILE 104 -13.476 -5.398 8.198 853 HG13 ILE 104 3HG1 ILE 104 -14.737 -4.416 7.461 854 HG21 ILE 104 1HG2 ILE 104 -14.653 -5.851 4.159 855 HG22 ILE 104 2HG2 ILE 104 -15.864 -6.311 5.354 856 HG23 ILE 104 3HG2 ILE 104 -15.348 -4.630 5.225 857 HD11 ILE 104 3HD1 ILE 104 -15.805 -6.966 7.495 858 HD12 ILE 104 1HD1 ILE 104 -14.950 -6.828 9.031 859 HD13 ILE 104 2HD1 ILE 104 -16.185 -5.645 8.599 860 H GLN 105 H GLN 105 -14.678 -8.014 4.014 861 HA GLN 105 HA GLN 105 -12.444 -7.752 2.301 862 HB2 GLN 105 2HB GLN 105 -12.901 -10.378 3.551 863 HB3 GLN 105 3HB GLN 105 -12.732 -10.418 1.801 864 HG2 GLN 105 2HG GLN 105 -10.644 -8.871 2.368 865 HG3 GLN 105 3HG GLN 105 -10.745 -9.760 3.887 866 HE21 GLN 105 1HE2 GLN 105 -11.043 -10.473 0.419 867 HE22 GLN 105 2HE2 GLN 105 -10.025 -11.868 0.446 868 H ILE 106 H ILE 106 -12.981 -9.117 0.152 869 HA ILE 106 HA ILE 106 -15.868 -8.821 -0.356 870 HB ILE 106 HB ILE 106 -13.701 -8.093 -2.326 871 HG12 ILE 106 2HG1 ILE 106 -15.231 -5.828 -1.578 872 HG13 ILE 106 3HG1 ILE 106 -14.720 -6.613 -0.088 873 HG21 ILE 106 1HG2 ILE 106 -15.584 -7.047 -3.548 874 HG22 ILE 106 2HG2 ILE 106 -15.742 -8.795 -3.393 875 HG23 ILE 106 3HG2 ILE 106 -16.693 -7.730 -2.360 876 HD11 ILE 106 3HD1 ILE 106 -12.829 -5.922 -2.316 877 HD12 ILE 106 1HD1 ILE 106 -13.186 -4.841 -0.969 878 HD13 ILE 106 2HD1 ILE 106 -12.435 -6.409 -0.668 879 H GLY 107 H GLY 107 -16.528 -10.883 -0.551 880 HA2 GLY 107 2HA GLY 107 -16.887 -12.694 -2.074 881 HA3 GLY 107 3HA GLY 107 -15.233 -12.502 -2.637 882 H ASN 108 H ASN 108 -15.759 -14.981 -2.188 883 HA ASN 108 HA ASN 108 -15.428 -15.791 0.549 884 HB2 ASN 108 2HB ASN 108 -15.271 -17.397 -2.012 885 HB3 ASN 108 3HB ASN 108 -15.307 -18.077 -0.388 886 HD21 ASN 108 1HD2 ASN 108 -17.207 -17.130 0.952 887 HD22 ASN 108 2HD2 ASN 108 -18.739 -17.157 0.154 888 H GLY 109 H GLY 109 -13.569 -15.874 1.615 889 HA2 GLY 109 2HA GLY 109 -11.061 -15.651 0.148 890 HA3 GLY 109 3HA GLY 109 -11.270 -15.495 1.886 891 H HIS 110 H HIS 110 -9.163 -16.915 1.092 892 HA HIS 110 HA HIS 110 -9.983 -19.718 1.487 893 HB2 HIS 110 2HB HIS 110 -7.572 -18.656 -0.001 894 HB3 HIS 110 3HB HIS 110 -7.896 -20.359 0.307 895 HD1 HIS 110 HD1 HIS 110 -9.407 -17.419 -1.548 896 HD2 HIS 110 HD2 HIS 110 -9.462 -21.573 -1.566 897 HE1 HIS 110 HE1 HIS 110 -10.717 -18.065 -3.594 898 H GLY 111 H GLY 111 -8.464 -21.061 2.694 899 HA2 GLY 111 2HA GLY 111 -6.357 -19.851 4.209 900 HA3 GLY 111 3HA GLY 111 -7.808 -20.081 5.174 901 H GLN 112 H GLN 112 -5.015 -21.538 3.892 902 HA GLN 112 HA GLN 112 -5.915 -24.160 4.889 903 HB2 GLN 112 2HB GLN 112 -4.333 -23.440 2.454 904 HB3 GLN 112 3HB GLN 112 -4.040 -24.985 3.243 905 HG2 GLN 112 2HG GLN 112 -5.606 -25.577 1.691 906 HG3 GLN 112 3HG GLN 112 -6.631 -25.231 3.083 907 HE21 GLN 112 1HE2 GLN 112 -8.451 -24.571 2.105 908 HE22 GLN 112 2HE2 GLN 112 -8.561 -23.211 1.047 909 H SER 113 H SER 113 -3.977 -25.595 5.452 910 HA SER 113 HA SER 113 -1.530 -24.382 6.226 911 HB2 SER 113 2HB SER 113 -1.987 -24.834 8.752 912 HB3 SER 113 3HB SER 113 -2.577 -23.336 8.032 913 HG SER 113 HG SER 113 -3.970 -25.393 9.128 914 H GLN 114 H GLN 114 -0.036 -25.881 7.094 915 HA GLN 114 HA GLN 114 -0.949 -28.668 7.229 916 HB2 GLN 114 2HB GLN 114 1.103 -27.496 5.415 917 HB3 GLN 114 3HB GLN 114 1.410 -29.095 6.079 918 HG2 GLN 114 2HG GLN 114 -0.836 -29.783 5.203 919 HG3 GLN 114 3HG GLN 114 -0.904 -28.232 4.368 920 HE21 GLN 114 1HE2 GLN 114 -1.121 -30.265 2.768 921 HE22 GLN 114 2HE2 GLN 114 0.341 -30.602 1.912 922 H GLY 115 H GLY 115 0.420 -30.079 8.445 923 HA2 GLY 115 2HA GLY 115 2.486 -28.758 10.065 924 HA3 GLY 115 3HA GLY 115 1.158 -29.568 10.882 925 H LEU 116 H LEU 116 4.266 -29.918 9.768 926 HA LEU 116 HA LEU 116 4.020 -32.844 9.576 927 HB2 LEU 116 2HB LEU 116 6.459 -31.308 8.776 928 HB3 LEU 116 3HB LEU 116 5.925 -32.900 8.241 929 HG LEU 116 HG LEU 116 3.938 -31.458 7.215 930 HD11 LEU 116 1HD1 LEU 116 4.311 -29.275 7.548 931 HD12 LEU 116 2HD1 LEU 116 5.471 -29.440 6.231 932 HD13 LEU 116 3HD1 LEU 116 6.021 -29.517 7.904 933 HD21 LEU 116 3HD2 LEU 116 4.966 -31.710 5.136 934 HD22 LEU 116 1HD2 LEU 116 5.707 -32.966 6.128 935 HD23 LEU 116 2HD2 LEU 116 6.583 -31.470 5.800 936 H GLU 117 H GLU 117 5.607 -30.205 11.232 937 HA GLU 117 HA GLU 117 7.565 -31.659 12.618 938 HB2 GLU 117 2HB GLU 117 6.142 -29.070 13.149 939 HB3 GLU 117 3HB GLU 117 7.250 -29.734 14.342 940 HG2 GLU 117 2HG GLU 117 9.069 -29.654 12.780 941 HG3 GLU 117 3HG GLU 117 7.984 -29.162 11.481 942 H1 GLY -9 H GLY -9 7.778 -13.213 14.275 943 HA2 GLY -9 2HA GLY -9 9.389 -12.619 12.645 944 HA3 GLY -9 3HA GLY -9 10.631 -13.370 13.635 945 H LYS -8 H LYS -8 8.396 -13.791 11.076 946 HA LYS -8 HA LYS -8 8.376 -16.637 11.013 947 HB2 LYS -8 2HB LYS -8 6.601 -15.486 9.908 948 HB3 LYS -8 3HB LYS -8 7.727 -14.539 8.945 949 HG2 LYS -8 2HG LYS -8 6.640 -16.299 7.639 950 HG3 LYS -8 3HG LYS -8 8.391 -16.513 7.715 951 HD2 LYS -8 2HD LYS -8 8.202 -18.486 8.753 952 HD3 LYS -8 3HD LYS -8 6.993 -17.868 9.880 953 HE2 LYS -8 2HE LYS -8 5.343 -18.036 7.950 954 HE3 LYS -8 3HE LYS -8 6.577 -18.981 7.118 955 HZ1 LYS -8 3HZ LYS -8 5.691 -20.718 8.161 956 HZ2 LYS -8 1HZ LYS -8 4.811 -19.754 9.237 957 HZ3 LYS -8 2HZ LYS -8 6.424 -20.139 9.571 958 H PHE -7 H PHE -7 9.731 -14.502 8.512 959 HA PHE -7 HA PHE -7 11.621 -16.505 7.717 960 HB2 PHE -7 2HB PHE -7 11.102 -13.666 6.854 961 HB3 PHE -7 3HB PHE -7 12.467 -14.585 6.229 962 HD1 PHE -7 HD2 PHE -7 11.972 -16.806 5.080 963 HD2 PHE -7 HD1 PHE -7 8.991 -13.882 5.907 964 HE1 PHE -7 HE2 PHE -7 10.510 -17.820 3.380 965 HE2 PHE -7 HE1 PHE -7 7.525 -14.892 4.209 966 HZ PHE -7 HZ PHE -7 8.284 -16.862 2.942 967 H ILE -6 H ILE -6 12.254 -13.106 8.566 968 HA ILE -6 HA ILE -6 14.040 -12.115 9.579 969 HB ILE -6 HB ILE -6 14.124 -14.551 11.349 970 HG12 ILE -6 2HG1 ILE -6 11.798 -13.877 11.180 971 HG13 ILE -6 3HG1 ILE -6 12.430 -13.394 12.751 972 HG21 ILE -6 1HG2 ILE -6 15.096 -13.181 12.953 973 HG22 ILE -6 2HG2 ILE -6 15.844 -12.632 11.454 974 HG23 ILE -6 3HG2 ILE -6 14.530 -11.702 12.175 975 HD11 ILE -6 3HD1 ILE -6 12.861 -11.222 11.033 976 HD12 ILE -6 1HD1 ILE -6 11.224 -11.796 10.715 977 HD13 ILE -6 2HD1 ILE -6 11.700 -11.349 12.354 978 HA PRO -5 HA PRO -5 17.090 -14.764 7.292 979 HB2 PRO -5 2HB PRO -5 17.999 -12.754 5.711 980 HB3 PRO -5 3HB PRO -5 16.591 -13.739 5.297 981 HG2 PRO -5 2HG PRO -5 16.699 -11.010 6.523 982 HG3 PRO -5 3HG PRO -5 15.633 -11.621 5.244 983 HD2 PRO -5 2HD PRO -5 14.832 -11.385 7.820 984 HD3 PRO -5 3HD PRO -5 14.222 -12.657 6.743 985 H SER -4 H SER -4 18.499 -15.015 8.997 986 HA SER -4 HA SER -4 19.992 -12.726 9.989 987 HB2 SER -4 2HB SER -4 19.274 -14.252 11.684 988 HB3 SER -4 3HB SER -4 19.913 -15.636 10.799 989 HG SER -4 HG SER -4 21.144 -14.220 12.626 990 H ARG -3 H ARG -3 20.253 -14.598 7.355 991 HA ARG -3 HA ARG -3 22.811 -15.609 7.231 992 HB2 ARG -3 2HB ARG -3 20.984 -14.415 5.182 993 HB3 ARG -3 3HB ARG -3 22.628 -14.842 4.726 994 HG2 ARG -3 2HG ARG -3 20.709 -16.771 6.006 995 HG3 ARG -3 3HG ARG -3 20.899 -16.588 4.261 996 HD2 ARG -3 2HD ARG -3 23.071 -17.422 4.286 997 HD3 ARG -3 3HD ARG -3 23.274 -17.105 6.009 998 HE ARG -3 HE ARG -3 22.205 -19.464 4.815 999 HH11 ARG -3 1HH1 ARG -3 22.025 -17.413 7.623 1000 HH12 ARG -3 2HH1 ARG -3 21.473 -18.677 8.672 1001 HH21 ARG -3 1HH2 ARG -3 21.478 -21.136 6.186 1002 HH22 ARG -3 2HH2 ARG -3 21.163 -20.794 7.854 1003 HA PRO -2 HA PRO -2 25.675 -12.287 7.268 1004 HB2 PRO -2 2HB PRO -2 27.487 -13.054 5.398 1005 HB3 PRO -2 3HB PRO -2 27.339 -13.843 6.972 1006 HG2 PRO -2 2HG PRO -2 26.251 -14.696 4.317 1007 HG3 PRO -2 3HG PRO -2 27.035 -15.674 5.572 1008 HD2 PRO -2 2HD PRO -2 24.347 -15.599 5.250 1009 HD3 PRO -2 3HD PRO -2 25.114 -15.819 6.837 1010 H ALA -1 H ALA -1 24.161 -13.124 4.246 1011 HA ALA -1 HA ALA -1 23.511 -11.875 2.457 1012 HB1 ALA -1 1HB ALA -1 22.774 -10.326 4.302 1013 HB2 ALA -1 2HB ALA -1 24.275 -9.436 4.045 1014 HB3 ALA -1 3HB ALA -1 23.090 -9.561 2.745 1015 HA PRO 0 HA PRO 0 27.880 -11.551 1.069 1016 HB2 PRO 0 2HB PRO 0 27.465 -12.911 -1.243 1017 HB3 PRO 0 3HB PRO 0 27.792 -13.713 0.298 1018 HG2 PRO 0 2HG PRO 0 25.174 -13.254 -1.080 1019 HG3 PRO 0 3HG PRO 0 25.764 -14.708 -0.254 1020 HD2 PRO 0 2HD PRO 0 24.040 -12.972 0.906 1021 HD3 PRO 0 3HD PRO 0 25.246 -13.884 1.836 1022 H LYS 1 H LYS 1 28.784 -10.445 -0.754 1023 HA LYS 1 HA LYS 1 26.952 -8.464 -1.872 1024 HB2 LYS 1 2HB LYS 1 29.907 -8.607 -1.454 1025 HB3 LYS 1 3HB LYS 1 29.282 -7.545 -2.708 1026 HG2 LYS 1 2HG LYS 1 28.195 -6.176 -1.190 1027 HG3 LYS 1 3HG LYS 1 28.184 -7.413 0.069 1028 HD2 LYS 1 2HD LYS 1 29.815 -5.876 0.761 1029 HD3 LYS 1 3HD LYS 1 30.731 -7.206 0.049 1030 HE2 LYS 1 2HE LYS 1 30.385 -5.665 -2.126 1031 HE3 LYS 1 3HE LYS 1 30.383 -4.422 -0.876 1032 HZ1 LYS 1 3HZ LYS 1 32.490 -6.449 -0.785 1033 HZ2 LYS 1 1HZ LYS 1 32.543 -4.816 -0.347 1034 HZ3 LYS 1 2HZ LYS 1 32.599 -5.256 -1.979 1035 HA PRO 2 HA PRO 2 26.959 -10.029 -5.971 1036 HB2 PRO 2 2HB PRO 2 27.120 -7.764 -7.460 1037 HB3 PRO 2 3HB PRO 2 25.668 -8.223 -6.562 1038 HG2 PRO 2 2HG PRO 2 27.818 -6.276 -5.820 1039 HG3 PRO 2 3HG PRO 2 26.059 -6.119 -5.652 1040 HD2 PRO 2 2HD PRO 2 27.668 -6.779 -3.577 1041 HD3 PRO 2 3HD PRO 2 26.004 -7.381 -3.724 1042 HA PRO 3 HA PRO 3 30.999 -10.464 -7.652 1043 HB2 PRO 3 2HB PRO 3 30.516 -10.626 -10.318 1044 HB3 PRO 3 3HB PRO 3 30.105 -11.921 -9.187 1045 HG2 PRO 3 2HG PRO 3 28.344 -9.805 -10.364 1046 HG3 PRO 3 3HG PRO 3 28.017 -11.533 -10.134 1047 HD2 PRO 3 2HD PRO 3 27.067 -9.634 -8.454 1048 HD3 PRO 3 3HD PRO 3 27.497 -11.266 -7.905 1049 H SER 4 H SER 4 29.016 -7.841 -8.810 1050 HA SER 4 HA SER 4 30.738 -6.487 -10.489 1051 HB2 SER 4 2HB SER 4 29.564 -4.385 -9.444 1052 HB3 SER 4 3HB SER 4 28.618 -5.544 -10.378 1053 HG SER 4 HG SER 4 28.145 -4.777 -7.946 1054 H SER 5 H SER 5 30.673 -6.557 -6.969 1055 HA SER 5 HA SER 5 33.300 -5.235 -6.966 1056 HB2 SER 5 2HB SER 5 31.282 -4.731 -4.788 1057 HB3 SER 5 3HB SER 5 32.738 -3.814 -5.173 1058 HG SER 5 HG SER 5 31.685 -2.755 -6.675 1059 H ALA 6 H ALA 6 34.796 -6.094 -5.610 1060 HA ALA 6 HA ALA 6 34.033 -8.562 -4.230 1061 HB1 ALA 6 1HB ALA 6 36.868 -7.691 -4.528 1062 HB2 ALA 6 2HB ALA 6 36.183 -9.316 -4.517 1063 HB3 ALA 6 3HB ALA 6 35.997 -8.291 -5.940 Start of MODEL 16 1 H1 MET -2 H MET -2 1.440 1.151 -6.604 2 HA MET -2 HA MET -2 4.054 0.184 -5.759 3 HB2 MET -2 2HB MET -2 3.029 0.312 -3.630 4 HB3 MET -2 3HB MET -2 1.499 -0.303 -4.242 5 HG2 MET -2 2HG MET -2 2.689 -1.956 -2.894 6 HG3 MET -2 3HG MET -2 2.460 -2.493 -4.557 7 HE1 MET -2 3HE MET -2 5.885 -4.123 -3.657 8 HE2 MET -2 1HE MET -2 4.350 -4.036 -2.792 9 HE3 MET -2 2HE MET -2 4.368 -4.377 -4.522 10 H ALA -1 H ALA -1 4.627 -1.589 -6.855 11 HA ALA -1 HA ALA -1 2.565 -3.354 -7.941 12 HB1 ALA -1 1HB ALA -1 4.183 -3.280 -10.086 13 HB2 ALA -1 2HB ALA -1 2.748 -2.270 -9.913 14 HB3 ALA -1 3HB ALA -1 4.339 -1.614 -9.530 15 HA PRO 1 HA PRO 1 5.355 -6.580 -6.906 16 HB2 PRO 1 2HB PRO 1 4.824 -8.409 -8.841 17 HB3 PRO 1 3HB PRO 1 3.704 -8.055 -7.520 18 HG2 PRO 1 2HG PRO 1 3.680 -7.058 -10.342 19 HG3 PRO 1 3HG PRO 1 2.328 -7.625 -9.344 20 HD2 PRO 1 2HD PRO 1 2.848 -4.996 -9.735 21 HD3 PRO 1 3HD PRO 1 2.146 -5.617 -8.227 22 H LEU 2 H LEU 2 7.261 -5.271 -7.423 23 HA LEU 2 HA LEU 2 8.436 -5.268 -9.998 24 HB2 LEU 2 2HB LEU 2 10.340 -4.313 -8.975 25 HB3 LEU 2 3HB LEU 2 8.933 -3.673 -8.130 26 HG LEU 2 HG LEU 2 10.317 -6.043 -6.975 27 HD11 LEU 2 1HD1 LEU 2 11.358 -3.219 -6.842 28 HD12 LEU 2 2HD1 LEU 2 12.187 -4.629 -7.500 29 HD13 LEU 2 3HD1 LEU 2 11.860 -4.526 -5.770 30 HD21 LEU 2 3HD2 LEU 2 8.814 -3.656 -5.934 31 HD22 LEU 2 1HD2 LEU 2 9.723 -4.741 -4.882 32 HD23 LEU 2 2HD2 LEU 2 8.372 -5.361 -5.832 33 H PHE 3 H PHE 3 10.117 -6.488 -10.848 34 HA PHE 3 HA PHE 3 10.564 -9.073 -9.511 35 HB2 PHE 3 2HB PHE 3 10.411 -8.326 -12.424 36 HB3 PHE 3 3HB PHE 3 11.173 -9.824 -11.897 37 HD1 PHE 3 HD1 PHE 3 8.016 -7.936 -11.249 38 HD2 PHE 3 HD2 PHE 3 9.869 -11.701 -11.962 39 HE1 PHE 3 HE1 PHE 3 5.812 -9.028 -11.187 40 HE2 PHE 3 HE2 PHE 3 7.668 -12.799 -11.902 41 HZ PHE 3 HZ PHE 3 5.636 -11.463 -11.515 42 H ALA 4 H ALA 4 12.633 -9.920 -9.392 43 HA ALA 4 HA ALA 4 14.821 -8.120 -10.202 44 HB1 ALA 4 1HB ALA 4 15.160 -9.781 -7.764 45 HB2 ALA 4 2HB ALA 4 15.829 -8.197 -8.160 46 HB3 ALA 4 3HB ALA 4 14.147 -8.341 -7.650 47 H VAL 5 H VAL 5 16.839 -9.135 -10.664 48 HA VAL 5 HA VAL 5 16.614 -12.014 -11.261 49 HB VAL 5 HB VAL 5 16.561 -10.783 -13.341 50 HG11 VAL 5 1HG1 VAL 5 17.694 -8.744 -12.397 51 HG12 VAL 5 2HG1 VAL 5 19.228 -9.585 -12.622 52 HG13 VAL 5 3HG1 VAL 5 18.212 -9.214 -14.015 53 HG21 VAL 5 3HG2 VAL 5 18.434 -12.754 -12.685 54 HG22 VAL 5 1HG2 VAL 5 17.832 -12.341 -14.291 55 HG23 VAL 5 2HG2 VAL 5 19.305 -11.588 -13.680 56 H THR 6 H THR 6 18.036 -13.234 -10.224 57 HA THR 6 HA THR 6 20.001 -12.244 -8.503 58 HB THR 6 HB THR 6 20.678 -14.900 -9.421 59 HG1 THR 6 HG1 THR 6 18.628 -15.840 -8.836 60 HG21 THR 6 3HG2 THR 6 21.228 -14.104 -7.213 61 HG22 THR 6 1HG2 THR 6 20.101 -15.452 -7.062 62 HG23 THR 6 2HG2 THR 6 19.529 -13.796 -6.857 63 H LEU 7 H LEU 7 22.177 -11.923 -8.673 64 HA LEU 7 HA LEU 7 23.276 -11.969 -11.399 65 HB2 LEU 7 2HB LEU 7 24.329 -10.455 -9.020 66 HB3 LEU 7 3HB LEU 7 24.805 -10.265 -10.706 67 HG LEU 7 HG LEU 7 21.965 -9.741 -10.011 68 HD11 LEU 7 1HD1 LEU 7 24.214 -8.344 -8.795 69 HD12 LEU 7 2HD1 LEU 7 22.497 -8.297 -8.396 70 HD13 LEU 7 3HD1 LEU 7 23.129 -7.279 -9.689 71 HD21 LEU 7 3HD2 LEU 7 23.482 -9.507 -12.269 72 HD22 LEU 7 1HD2 LEU 7 23.508 -7.861 -11.636 73 HD23 LEU 7 2HD2 LEU 7 21.967 -8.652 -11.969 74 H TYR 8 H TYR 8 23.503 -13.441 -8.344 75 HA TYR 8 HA TYR 8 25.886 -14.902 -9.220 76 HB2 TYR 8 2HB TYR 8 25.531 -13.736 -6.451 77 HB3 TYR 8 3HB TYR 8 26.845 -14.795 -6.952 78 HD1 TYR 8 HD1 TYR 8 25.307 -11.477 -7.613 79 HD2 TYR 8 HD2 TYR 8 28.785 -13.908 -7.927 80 HE1 TYR 8 HE1 TYR 8 26.608 -9.514 -8.325 81 HE2 TYR 8 HE2 TYR 8 30.095 -11.952 -8.638 82 HH TYR 8 HH TYR 8 28.692 -9.060 -9.624 83 H GLU 9 H GLU 9 26.219 -16.916 -7.938 84 HA GLU 9 HA GLU 9 23.660 -18.234 -7.569 85 HB2 GLU 9 2HB GLU 9 25.258 -19.450 -8.862 86 HB3 GLU 9 3HB GLU 9 26.502 -19.240 -7.639 87 HG2 GLU 9 2HG GLU 9 25.563 -20.817 -6.225 88 HG3 GLU 9 3HG GLU 9 23.984 -20.717 -7.002 89 H PHE 10 H PHE 10 22.737 -17.872 -5.644 90 HA PHE 10 HA PHE 10 24.412 -18.036 -3.233 91 HB2 PHE 10 2HB PHE 10 23.176 -15.939 -3.459 92 HB3 PHE 10 3HB PHE 10 21.664 -16.828 -3.612 93 HD1 PHE 10 HD2 PHE 10 20.735 -18.028 -1.668 94 HD2 PHE 10 HD1 PHE 10 24.166 -15.531 -1.342 95 HE1 PHE 10 HE2 PHE 10 20.445 -17.953 0.774 96 HE2 PHE 10 HE1 PHE 10 23.883 -15.454 1.101 97 HZ PHE 10 HZ PHE 10 22.019 -16.665 2.162 98 H LYS 11 H LYS 11 24.429 -20.023 -2.412 99 HA LYS 11 HA LYS 11 22.176 -21.809 -2.737 100 HB2 LYS 11 2HB LYS 11 24.866 -22.131 -1.404 101 HB3 LYS 11 3HB LYS 11 23.648 -23.399 -1.441 102 HG2 LYS 11 2HG LYS 11 23.945 -23.816 -3.663 103 HG3 LYS 11 3HG LYS 11 24.463 -22.166 -4.017 104 HD2 LYS 11 2HD LYS 11 26.635 -22.570 -3.395 105 HD3 LYS 11 3HD LYS 11 26.188 -23.859 -2.275 106 HE2 LYS 11 2HE LYS 11 25.916 -24.126 -5.259 107 HE3 LYS 11 3HE LYS 11 27.391 -24.559 -4.397 108 HZ1 LYS 11 3HZ LYS 11 25.799 -25.973 -2.969 109 HZ2 LYS 11 1HZ LYS 11 26.253 -26.544 -4.496 110 HZ3 LYS 11 2HZ LYS 11 24.736 -25.828 -4.277 111 H ALA 12 H ALA 12 20.831 -22.561 -1.140 112 HA ALA 12 HA ALA 12 20.344 -20.835 1.064 113 HB1 ALA 12 1HB ALA 12 18.673 -22.284 -0.240 114 HB2 ALA 12 2HB ALA 12 19.197 -23.594 0.820 115 HB3 ALA 12 3HB ALA 12 18.466 -22.143 1.506 116 H GLU 13 H GLU 13 20.884 -21.004 3.175 117 HA GLU 13 HA GLU 13 22.701 -23.197 3.903 118 HB2 GLU 13 2HB GLU 13 23.456 -21.681 5.726 119 HB3 GLU 13 3HB GLU 13 23.731 -21.031 4.116 120 HG2 GLU 13 2HG GLU 13 22.162 -19.386 4.355 121 HG3 GLU 13 3HG GLU 13 21.225 -20.299 5.536 122 H ARG 14 H ARG 14 19.690 -21.667 4.684 123 HA ARG 14 HA ARG 14 19.289 -23.639 6.834 124 HB2 ARG 14 2HB ARG 14 18.522 -20.726 6.775 125 HB3 ARG 14 3HB ARG 14 17.738 -21.874 7.852 126 HG2 ARG 14 2HG ARG 14 20.714 -21.654 7.835 127 HG3 ARG 14 3HG ARG 14 19.743 -20.456 8.693 128 HD2 ARG 14 2HD ARG 14 18.582 -22.491 9.766 129 HD3 ARG 14 3HD ARG 14 19.977 -23.403 9.190 130 HE ARG 14 HE ARG 14 21.073 -21.300 10.518 131 HH11 ARG 14 1HH1 ARG 14 18.742 -23.750 11.344 132 HH12 ARG 14 2HH1 ARG 14 19.166 -23.772 13.023 133 HH21 ARG 14 1HH2 ARG 14 21.641 -21.319 12.727 134 HH22 ARG 14 2HH2 ARG 14 20.814 -22.389 13.809 135 H ASP 15 H ASP 15 16.739 -23.536 7.374 136 HA ASP 15 HA ASP 15 15.475 -24.672 5.107 137 HB2 ASP 15 2HB ASP 15 14.521 -23.907 7.856 138 HB3 ASP 15 3HB ASP 15 13.399 -24.510 6.639 139 H ASP 16 H ASP 16 15.607 -21.464 6.400 140 HA ASP 16 HA ASP 16 13.301 -20.516 4.946 141 HB2 ASP 16 2HB ASP 16 15.390 -18.711 6.119 142 HB3 ASP 16 3HB ASP 16 13.652 -18.458 5.985 143 H GLU 17 H GLU 17 16.825 -20.195 4.683 144 HA GLU 17 HA GLU 17 16.933 -18.479 2.499 145 HB2 GLU 17 2HB GLU 17 18.823 -20.734 3.194 146 HB3 GLU 17 3HB GLU 17 19.178 -19.419 2.083 147 HG2 GLU 17 2HG GLU 17 18.836 -19.318 5.056 148 HG3 GLU 17 3HG GLU 17 20.219 -18.819 4.083 149 H LEU 18 H LEU 18 17.456 -18.943 0.255 150 HA LEU 18 HA LEU 18 16.440 -21.525 -0.708 151 HB2 LEU 18 2HB LEU 18 14.675 -19.785 -0.852 152 HB3 LEU 18 3HB LEU 18 15.734 -18.849 -1.904 153 HG LEU 18 HG LEU 18 15.640 -21.198 -3.249 154 HD11 LEU 18 1HD1 LEU 18 13.447 -21.255 -1.382 155 HD12 LEU 18 2HD1 LEU 18 13.995 -22.492 -2.512 156 HD13 LEU 18 3HD1 LEU 18 12.862 -21.251 -3.046 157 HD21 LEU 18 3HD2 LEU 18 15.294 -19.265 -4.461 158 HD22 LEU 18 1HD2 LEU 18 14.013 -18.695 -3.390 159 HD23 LEU 18 2HD2 LEU 18 13.698 -20.016 -4.516 160 H ASP 19 H ASP 19 17.353 -22.283 -2.611 161 HA ASP 19 HA ASP 19 19.952 -21.184 -3.235 162 HB2 ASP 19 2HB ASP 19 20.078 -23.170 -4.790 163 HB3 ASP 19 3HB ASP 19 19.839 -23.564 -3.090 164 H VAL 20 H VAL 20 20.478 -19.968 -4.942 165 HA VAL 20 HA VAL 20 18.645 -19.820 -7.223 166 HB VAL 20 HB VAL 20 19.239 -17.249 -7.170 167 HG11 VAL 20 1HG1 VAL 20 17.024 -17.237 -7.041 168 HG12 VAL 20 2HG1 VAL 20 17.027 -18.842 -6.306 169 HG13 VAL 20 3HG1 VAL 20 17.147 -17.404 -5.290 170 HG21 VAL 20 3HG2 VAL 20 20.545 -17.859 -4.935 171 HG22 VAL 20 1HG2 VAL 20 19.746 -16.303 -5.162 172 HG23 VAL 20 2HG2 VAL 20 18.952 -17.574 -4.234 173 H SER 21 H SER 21 19.617 -18.849 -9.134 174 HA SER 21 HA SER 21 22.560 -18.979 -9.113 175 HB2 SER 21 2HB SER 21 20.590 -20.294 -10.934 176 HB3 SER 21 3HB SER 21 22.126 -19.754 -11.610 177 HG SER 21 HG SER 21 21.649 -21.666 -9.593 178 HA PRO 22 HA PRO 22 22.646 -15.079 -11.119 179 HB2 PRO 22 2HB PRO 22 24.735 -15.362 -12.830 180 HB3 PRO 22 3HB PRO 22 24.939 -15.223 -11.080 181 HG2 PRO 22 2HG PRO 22 24.946 -17.673 -12.800 182 HG3 PRO 22 3HG PRO 22 26.021 -17.247 -11.455 183 HD2 PRO 22 2HD PRO 22 23.947 -18.965 -11.174 184 HD3 PRO 22 3HD PRO 22 24.492 -17.903 -9.860 185 H GLY 23 H GLY 23 21.101 -14.445 -12.491 186 HA2 GLY 23 2HA GLY 23 20.527 -13.969 -14.785 187 HA3 GLY 23 3HA GLY 23 21.133 -15.561 -15.218 188 H GLU 24 H GLU 24 19.396 -15.754 -12.371 189 HA GLU 24 HA GLU 24 17.146 -16.956 -13.781 190 HB2 GLU 24 2HB GLU 24 18.098 -17.039 -10.928 191 HB3 GLU 24 3HB GLU 24 16.508 -17.635 -11.382 192 HG2 GLU 24 2HG GLU 24 18.915 -18.619 -12.837 193 HG3 GLU 24 3HG GLU 24 18.535 -19.259 -11.239 194 H ASN 25 H ASN 25 14.956 -16.474 -13.240 195 HA ASN 25 HA ASN 25 14.579 -13.654 -12.579 196 HB2 ASN 25 2HB ASN 25 12.574 -15.647 -13.659 197 HB3 ASN 25 3HB ASN 25 12.358 -13.903 -13.542 198 HD21 ASN 25 1HD2 ASN 25 12.836 -12.735 -15.260 199 HD22 ASN 25 2HD2 ASN 25 13.784 -13.259 -16.607 200 H LEU 26 H LEU 26 13.907 -13.033 -10.641 201 HA LEU 26 HA LEU 26 12.412 -14.957 -8.984 202 HB2 LEU 26 2HB LEU 26 14.735 -13.218 -8.324 203 HB3 LEU 26 3HB LEU 26 13.523 -13.507 -7.078 204 HG LEU 26 HG LEU 26 13.963 -15.861 -7.103 205 HD11 LEU 26 1HD1 LEU 26 15.414 -15.210 -9.613 206 HD12 LEU 26 2HD1 LEU 26 14.357 -16.570 -9.234 207 HD13 LEU 26 3HD1 LEU 26 16.010 -16.541 -8.621 208 HD21 LEU 26 3HD2 LEU 26 15.810 -13.933 -6.331 209 HD22 LEU 26 1HD2 LEU 26 16.764 -15.154 -7.175 210 HD23 LEU 26 2HD2 LEU 26 15.753 -15.617 -5.806 211 H SER 27 H SER 27 10.808 -14.112 -7.618 212 HA SER 27 HA SER 27 9.807 -11.490 -8.473 213 HB2 SER 27 2HB SER 27 8.506 -13.889 -8.334 214 HB3 SER 27 3HB SER 27 8.066 -13.166 -6.787 215 HG SER 27 HG SER 27 6.753 -11.917 -7.829 216 H ILE 28 H ILE 28 9.944 -9.809 -7.152 217 HA ILE 28 HA ILE 28 10.992 -10.086 -4.504 218 HB ILE 28 HB ILE 28 9.893 -7.648 -5.909 219 HG12 ILE 28 2HG1 ILE 28 11.893 -8.717 -6.963 220 HG13 ILE 28 3HG1 ILE 28 12.193 -7.085 -6.374 221 HG21 ILE 28 1HG2 ILE 28 11.391 -6.504 -4.142 222 HG22 ILE 28 2HG2 ILE 28 9.798 -7.085 -3.660 223 HG23 ILE 28 3HG2 ILE 28 11.236 -8.024 -3.261 224 HD11 ILE 28 3HD1 ILE 28 12.791 -9.129 -4.398 225 HD12 ILE 28 1HD1 ILE 28 13.736 -9.293 -5.877 226 HD13 ILE 28 2HD1 ILE 28 13.771 -7.780 -4.972 227 H CYS 29 H CYS 29 9.993 -9.692 -2.545 228 HA CYS 29 HA CYS 29 7.055 -9.496 -2.605 229 HB2 CYS 29 2HB CYS 29 8.686 -11.112 -0.637 230 HB3 CYS 29 3HB CYS 29 6.931 -11.014 -0.712 231 HG CYS 29 HG CYS 29 7.063 -13.362 -1.845 232 H ALA 30 H ALA 30 10.043 -8.741 -0.925 233 HA ALA 30 HA ALA 30 9.112 -6.259 0.013 234 HB1 ALA 30 1HB ALA 30 9.504 -7.352 2.536 235 HB2 ALA 30 2HB ALA 30 7.971 -6.836 1.832 236 HB3 ALA 30 3HB ALA 30 8.480 -8.520 1.700 237 H HIS 31 H HIS 31 10.664 -5.349 1.738 238 HA HIS 31 HA HIS 31 13.363 -6.448 1.301 239 HB2 HIS 31 2HB HIS 31 14.264 -4.269 1.015 240 HB3 HIS 31 3HB HIS 31 12.838 -4.342 -0.016 241 HD1 HIS 31 HD1 HIS 31 14.411 -2.003 1.970 242 HD2 HIS 31 HD2 HIS 31 10.488 -3.362 1.838 243 HE1 HIS 31 HE1 HIS 31 13.034 -0.186 3.032 244 H TYR 32 H TYR 32 14.956 -5.378 2.923 245 HA TYR 32 HA TYR 32 13.685 -5.060 5.551 246 HB2 TYR 32 2HB TYR 32 14.502 -7.432 5.174 247 HB3 TYR 32 3HB TYR 32 16.134 -6.775 5.127 248 HD1 TYR 32 HD2 TYR 32 13.111 -6.967 7.292 249 HD2 TYR 32 HD1 TYR 32 17.334 -6.483 7.106 250 HE1 TYR 32 HE2 TYR 32 13.229 -7.104 9.745 251 HE2 TYR 32 HE1 TYR 32 17.464 -6.619 9.558 252 HH TYR 32 HH TYR 32 16.170 -7.494 11.424 253 H ASP 33 H ASP 33 14.165 -2.942 5.825 254 HA ASP 33 HA ASP 33 15.375 -1.041 6.155 255 HB2 ASP 33 2HB ASP 33 16.291 -2.539 7.956 256 HB3 ASP 33 3HB ASP 33 17.623 -2.931 6.871 257 H TYR 34 H TYR 34 15.476 -2.363 3.501 258 HA TYR 34 HA TYR 34 16.449 -2.017 1.475 259 HB2 TYR 34 2HB TYR 34 18.039 0.144 2.870 260 HB3 TYR 34 3HB TYR 34 17.753 -0.004 1.139 261 HD1 TYR 34 HD2 TYR 34 16.202 0.808 4.380 262 HD2 TYR 34 HD1 TYR 34 15.699 0.738 0.156 263 HE1 TYR 34 HE2 TYR 34 14.183 2.195 4.603 264 HE2 TYR 34 HE1 TYR 34 13.680 2.126 0.367 265 HH TYR 34 HH TYR 34 12.609 3.603 1.859 266 H GLU 35 H GLU 35 17.632 -3.845 3.470 267 HA GLU 35 HA GLU 35 20.398 -3.897 2.453 268 HB2 GLU 35 2HB GLU 35 19.550 -5.341 4.941 269 HB3 GLU 35 3HB GLU 35 21.154 -4.799 4.467 270 HG2 GLU 35 2HG GLU 35 18.878 -3.032 5.335 271 HG3 GLU 35 3HG GLU 35 20.278 -3.478 6.308 272 H TRP 36 H TRP 36 17.693 -5.957 3.490 273 HA TRP 36 HA TRP 36 18.715 -8.056 1.691 274 HB2 TRP 36 2HB TRP 36 16.922 -8.381 4.107 275 HB3 TRP 36 3HB TRP 36 17.543 -9.680 3.093 276 HD1 TRP 36 HD1 TRP 36 18.654 -7.195 5.786 277 HE1 TRP 36 HE1 TRP 36 20.903 -7.988 6.756 278 HE3 TRP 36 HE3 TRP 36 19.627 -11.030 2.549 279 HZ2 TRP 36 HZ2 TRP 36 22.833 -9.976 6.219 280 HZ3 TRP 36 HZ3 TRP 36 21.696 -12.328 2.846 281 HH2 TRP 36 HH2 TRP 36 23.265 -11.810 4.643 282 H PHE 37 H PHE 37 17.295 -9.093 0.296 283 HA PHE 37 HA PHE 37 14.650 -7.824 0.012 284 HB2 PHE 37 2HB PHE 37 16.815 -8.109 -1.899 285 HB3 PHE 37 3HB PHE 37 15.335 -8.854 -2.493 286 HD1 PHE 37 HD2 PHE 37 13.212 -7.187 -1.609 287 HD2 PHE 37 HD1 PHE 37 17.114 -6.062 -2.881 288 HE1 PHE 37 HE2 PHE 37 12.358 -4.973 -2.257 289 HE2 PHE 37 HE1 PHE 37 16.267 -3.845 -3.530 290 HZ PHE 37 HZ PHE 37 13.886 -3.299 -3.220 291 H ILE 38 H ILE 38 12.907 -9.125 -0.330 292 HA ILE 38 HA ILE 38 13.349 -11.988 0.058 293 HB ILE 38 HB ILE 38 10.701 -10.546 0.045 294 HG12 ILE 38 2HG1 ILE 38 12.102 -9.513 1.742 295 HG13 ILE 38 3HG1 ILE 38 10.891 -10.526 2.518 296 HG21 ILE 38 1HG2 ILE 38 10.496 -12.654 1.754 297 HG22 ILE 38 2HG2 ILE 38 10.011 -12.679 0.060 298 HG23 ILE 38 3HG2 ILE 38 11.596 -13.292 0.532 299 HD11 ILE 38 3HD1 ILE 38 13.695 -10.585 2.822 300 HD12 ILE 38 1HD1 ILE 38 12.484 -11.609 3.593 301 HD13 ILE 38 2HD1 ILE 38 13.208 -12.099 2.060 302 H ALA 39 H ALA 39 13.911 -12.771 -1.939 303 HA ALA 39 HA ALA 39 12.009 -12.328 -4.141 304 HB1 ALA 39 1HB ALA 39 14.473 -13.688 -4.863 305 HB2 ALA 39 2HB ALA 39 13.735 -12.240 -5.550 306 HB3 ALA 39 3HB ALA 39 14.759 -12.113 -4.120 307 H LYS 40 H LYS 40 11.127 -14.055 -5.256 308 HA LYS 40 HA LYS 40 11.549 -16.714 -4.058 309 HB2 LYS 40 2HB LYS 40 9.105 -17.118 -4.707 310 HB3 LYS 40 3HB LYS 40 9.409 -16.093 -3.310 311 HG2 LYS 40 2HG LYS 40 8.708 -14.192 -4.377 312 HG3 LYS 40 3HG LYS 40 9.092 -14.819 -5.982 313 HD2 LYS 40 2HD LYS 40 6.792 -14.918 -6.003 314 HD3 LYS 40 3HD LYS 40 7.196 -16.539 -5.434 315 HE2 LYS 40 2HE LYS 40 5.836 -16.126 -3.715 316 HE3 LYS 40 3HE LYS 40 7.094 -15.047 -3.114 317 HZ1 LYS 40 3HZ LYS 40 5.213 -13.724 -3.146 318 HZ2 LYS 40 1HZ LYS 40 4.637 -14.371 -4.598 319 HZ3 LYS 40 2HZ LYS 40 5.960 -13.318 -4.608 320 HA PRO 41 HA PRO 41 12.319 -18.288 -8.082 321 HB2 PRO 41 2HB PRO 41 11.231 -20.770 -7.918 322 HB3 PRO 41 3HB PRO 41 12.726 -20.320 -7.089 323 HG2 PRO 41 2HG PRO 41 9.941 -20.497 -6.007 324 HG3 PRO 41 3HG PRO 41 11.461 -21.045 -5.277 325 HD2 PRO 41 2HD PRO 41 10.257 -18.726 -4.567 326 HD3 PRO 41 3HD PRO 41 12.020 -18.930 -4.550 327 H ILE 42 H ILE 42 11.362 -17.784 -9.941 328 HA ILE 42 HA ILE 42 8.481 -17.586 -10.110 329 HB ILE 42 HB ILE 42 10.569 -17.054 -12.227 330 HG12 ILE 42 2HG1 ILE 42 9.115 -15.152 -10.376 331 HG13 ILE 42 3HG1 ILE 42 10.817 -15.588 -10.270 332 HG21 ILE 42 1HG2 ILE 42 8.898 -16.758 -13.655 333 HG22 ILE 42 2HG2 ILE 42 7.764 -17.296 -12.417 334 HG23 ILE 42 3HG2 ILE 42 8.152 -15.583 -12.573 335 HD11 ILE 42 3HD1 ILE 42 11.153 -13.735 -11.458 336 HD12 ILE 42 1HD1 ILE 42 10.626 -14.700 -12.837 337 HD13 ILE 42 2HD1 ILE 42 9.475 -13.660 -11.996 338 H ASN 43 H ASN 43 11.044 -19.622 -11.390 339 HA ASN 43 HA ASN 43 9.377 -21.029 -13.234 340 HB2 ASN 43 2HB ASN 43 12.153 -21.383 -12.173 341 HB3 ASN 43 3HB ASN 43 11.386 -22.722 -13.022 342 HD21 ASN 43 1HD2 ASN 43 13.413 -20.241 -13.429 343 HD22 ASN 43 2HD2 ASN 43 13.150 -19.890 -15.100 344 H ARG 43 H ARG 43 10.607 -21.710 -9.979 345 HA ARG 43 HA ARG 43 9.556 -24.294 -9.719 346 HB2 ARG 43 2HB ARG 43 9.956 -22.263 -7.517 347 HB3 ARG 43 3HB ARG 43 9.862 -24.008 -7.328 348 HG2 ARG 43 2HG ARG 43 12.005 -22.587 -8.890 349 HG3 ARG 43 3HG ARG 43 12.163 -23.098 -7.209 350 HD2 ARG 43 2HD ARG 43 12.194 -25.340 -7.755 351 HD3 ARG 43 3HD ARG 43 11.343 -25.086 -9.278 352 HE ARG 43 HE ARG 43 13.931 -23.870 -9.248 353 HH11 ARG 43 1HH1 ARG 43 12.222 -26.864 -9.730 354 HH12 ARG 43 2HH1 ARG 43 13.445 -27.549 -10.749 355 HH21 ARG 43 1HH2 ARG 43 15.548 -24.760 -10.588 356 HH22 ARG 43 2HH2 ARG 43 15.336 -26.352 -11.236 357 H LEU 44 H LEU 44 7.977 -24.400 -7.509 358 HA LEU 44 HA LEU 44 5.456 -23.323 -8.537 359 HB2 LEU 44 2HB LEU 44 6.210 -25.640 -6.826 360 HB3 LEU 44 3HB LEU 44 4.602 -24.943 -6.640 361 HG LEU 44 HG LEU 44 4.905 -26.969 -8.198 362 HD11 LEU 44 1HD1 LEU 44 3.483 -24.456 -9.053 363 HD12 LEU 44 2HD1 LEU 44 2.835 -25.779 -8.084 364 HD13 LEU 44 3HD1 LEU 44 3.225 -26.041 -9.784 365 HD21 LEU 44 3HD2 LEU 44 5.696 -26.616 -10.370 366 HD22 LEU 44 1HD2 LEU 44 6.891 -25.827 -9.339 367 HD23 LEU 44 2HD2 LEU 44 5.684 -24.861 -10.188 368 H GLY 45 H GLY 45 7.733 -22.823 -6.064 369 HA2 GLY 45 2HA GLY 45 6.912 -20.517 -5.032 370 HA3 GLY 45 3HA GLY 45 5.815 -21.626 -4.222 371 H GLY 46 H GLY 46 8.774 -20.087 -4.041 372 HA2 GLY 46 2HA GLY 46 9.459 -21.584 -1.648 373 HA3 GLY 46 3HA GLY 46 10.636 -21.678 -2.950 374 HA PRO 47 HA PRO 47 10.503 -17.024 -1.648 375 HB2 PRO 47 2HB PRO 47 9.025 -16.408 0.545 376 HB3 PRO 47 3HB PRO 47 8.366 -16.386 -1.095 377 HG2 PRO 47 2HG PRO 47 8.138 -18.502 1.010 378 HG3 PRO 47 3HG PRO 47 6.893 -17.875 -0.086 379 HD2 PRO 47 2HD PRO 47 8.184 -20.213 -0.533 380 HD3 PRO 47 3HD PRO 47 7.617 -19.168 -1.851 381 H GLY 48 H GLY 48 12.535 -16.931 -0.891 382 HA2 GLY 48 2HA GLY 48 13.025 -17.893 1.861 383 HA3 GLY 48 3HA GLY 48 14.228 -17.946 0.581 384 H LEU 49 H LEU 49 15.765 -16.485 0.848 385 HA LEU 49 HA LEU 49 15.125 -13.718 1.279 386 HB2 LEU 49 2HB LEU 49 15.304 -15.086 3.565 387 HB3 LEU 49 3HB LEU 49 17.016 -14.756 3.310 388 HG LEU 49 HG LEU 49 15.180 -12.445 3.101 389 HD11 LEU 49 1HD1 LEU 49 14.139 -13.330 4.992 390 HD12 LEU 49 2HD1 LEU 49 15.355 -12.233 5.647 391 HD13 LEU 49 3HD1 LEU 49 15.650 -13.971 5.639 392 HD21 LEU 49 3HD2 LEU 49 17.024 -11.323 4.205 393 HD22 LEU 49 1HD2 LEU 49 17.616 -12.255 2.830 394 HD23 LEU 49 2HD2 LEU 49 17.835 -12.867 4.469 395 H VAL 50 H VAL 50 16.510 -12.560 0.118 396 HA VAL 50 HA VAL 50 19.283 -13.467 -0.150 397 HB VAL 50 HB VAL 50 18.168 -14.325 -2.135 398 HG11 VAL 50 1HG1 VAL 50 16.903 -13.035 -3.623 399 HG12 VAL 50 2HG1 VAL 50 16.343 -12.535 -2.026 400 HG13 VAL 50 3HG1 VAL 50 17.467 -11.516 -2.927 401 HG21 VAL 50 3HG2 VAL 50 19.512 -13.140 -3.863 402 HG22 VAL 50 1HG2 VAL 50 19.916 -11.924 -2.652 403 HG23 VAL 50 2HG2 VAL 50 20.437 -13.594 -2.432 404 HA PRO 51 HA PRO 51 20.005 -9.179 0.665 405 HB2 PRO 51 2HB PRO 51 22.662 -9.162 0.109 406 HB3 PRO 51 3HB PRO 51 21.995 -9.859 1.590 407 HG2 PRO 51 2HG PRO 51 22.849 -11.230 -0.930 408 HG3 PRO 51 3HG PRO 51 23.139 -11.703 0.754 409 HD2 PRO 51 2HD PRO 51 21.200 -12.830 -0.763 410 HD3 PRO 51 3HD PRO 51 21.035 -12.615 0.991 411 H VAL 52 H VAL 52 20.323 -7.260 -0.453 412 HA VAL 52 HA VAL 52 19.675 -7.194 -3.165 413 HB VAL 52 HB VAL 52 21.142 -5.015 -1.679 414 HG11 VAL 52 1HG1 VAL 52 20.172 -5.221 -4.325 415 HG12 VAL 52 2HG1 VAL 52 19.118 -4.097 -3.465 416 HG13 VAL 52 3HG1 VAL 52 20.857 -3.809 -3.520 417 HG21 VAL 52 3HG2 VAL 52 18.508 -4.333 -1.569 418 HG22 VAL 52 1HG2 VAL 52 18.433 -6.081 -1.344 419 HG23 VAL 52 2HG2 VAL 52 19.407 -5.093 -0.255 420 H SER 53 H SER 53 22.711 -7.646 -1.610 421 HA SER 53 HA SER 53 24.334 -6.810 -3.828 422 HB2 SER 53 2HB SER 53 24.945 -8.338 -1.294 423 HB3 SER 53 3HB SER 53 26.169 -7.970 -2.508 424 HG SER 53 HG SER 53 25.966 -6.424 -0.738 425 H TYR 54 H TYR 54 22.326 -9.370 -3.439 426 HA TYR 54 HA TYR 54 23.925 -11.045 -5.259 427 HB2 TYR 54 2HB TYR 54 22.428 -11.786 -2.795 428 HB3 TYR 54 3HB TYR 54 22.382 -12.916 -4.144 429 HD1 TYR 54 HD1 TYR 54 24.634 -11.160 -1.792 430 HD2 TYR 54 HD2 TYR 54 24.255 -14.275 -4.665 431 HE1 TYR 54 HE1 TYR 54 26.829 -12.041 -1.117 432 HE2 TYR 54 HE2 TYR 54 26.449 -15.165 -3.998 433 HH TYR 54 HH TYR 54 27.928 -15.095 -1.981 434 H VAL 55 H VAL 55 21.517 -9.009 -5.298 435 HA VAL 55 HA VAL 55 20.103 -10.437 -7.409 436 HB VAL 55 HB VAL 55 18.846 -9.542 -4.858 437 HG11 VAL 55 1HG1 VAL 55 17.609 -9.299 -7.581 438 HG12 VAL 55 2HG1 VAL 55 16.628 -9.556 -6.137 439 HG13 VAL 55 3HG1 VAL 55 17.641 -8.119 -6.272 440 HG21 VAL 55 3HG2 VAL 55 17.605 -11.571 -5.077 441 HG22 VAL 55 1HG2 VAL 55 18.127 -11.774 -6.749 442 HG23 VAL 55 2HG2 VAL 55 19.292 -11.937 -5.435 443 H ARG 56 H ARG 56 19.380 -9.127 -9.024 444 HA ARG 56 HA ARG 56 20.009 -6.270 -8.748 445 HB2 ARG 56 2HB ARG 56 21.256 -7.195 -10.532 446 HB3 ARG 56 3HB ARG 56 19.875 -8.106 -11.130 447 HG2 ARG 56 2HG ARG 56 18.800 -6.057 -11.851 448 HG3 ARG 56 3HG ARG 56 20.130 -5.106 -11.187 449 HD2 ARG 56 2HD ARG 56 20.630 -7.240 -13.230 450 HD3 ARG 56 3HD ARG 56 20.107 -5.628 -13.716 451 HE ARG 56 HE ARG 56 22.204 -5.098 -12.120 452 HH11 ARG 56 1HH1 ARG 56 21.786 -7.283 -14.797 453 HH12 ARG 56 2HH1 ARG 56 23.443 -7.193 -15.298 454 HH21 ARG 56 1HH2 ARG 56 24.387 -4.971 -12.769 455 HH22 ARG 56 2HH2 ARG 56 24.921 -5.879 -14.143 456 H ILE 57 H ILE 57 18.456 -4.770 -8.881 457 HA ILE 57 HA ILE 57 15.704 -5.655 -9.144 458 HB ILE 57 HB ILE 57 16.712 -2.860 -8.614 459 HG12 ILE 57 2HG1 ILE 57 17.540 -4.459 -6.918 460 HG13 ILE 57 3HG1 ILE 57 16.375 -3.324 -6.245 461 HG21 ILE 57 1HG2 ILE 57 14.035 -4.145 -8.091 462 HG22 ILE 57 2HG2 ILE 57 14.484 -2.484 -7.706 463 HG23 ILE 57 3HG2 ILE 57 14.394 -3.006 -9.388 464 HD11 ILE 57 3HD1 ILE 57 16.154 -5.726 -5.523 465 HD12 ILE 57 1HD1 ILE 57 14.691 -4.964 -6.146 466 HD13 ILE 57 2HD1 ILE 57 15.609 -6.075 -7.163 467 H ILE 58 H ILE 58 14.933 -5.866 -11.144 468 HA ILE 58 HA ILE 58 15.482 -3.708 -13.074 469 HB ILE 58 HB ILE 58 15.131 -5.440 -14.867 470 HG12 ILE 58 2HG1 ILE 58 15.880 -7.565 -12.933 471 HG13 ILE 58 3HG1 ILE 58 14.202 -7.034 -12.911 472 HG21 ILE 58 1HG2 ILE 58 17.496 -6.354 -13.351 473 HG22 ILE 58 2HG2 ILE 58 17.364 -5.772 -15.010 474 HG23 ILE 58 3HG2 ILE 58 17.384 -4.624 -13.672 475 HD11 ILE 58 3HD1 ILE 58 14.402 -8.927 -14.352 476 HD12 ILE 58 1HD1 ILE 58 14.081 -7.502 -15.339 477 HD13 ILE 58 2HD1 ILE 58 15.714 -8.163 -15.250 478 H ASP 59 H ASP 59 13.791 -3.388 -14.700 479 HA ASP 59 HA ASP 59 11.144 -3.721 -13.496 480 HB2 ASP 59 2HB ASP 59 11.936 -1.445 -14.182 481 HB3 ASP 59 3HB ASP 59 11.932 -2.000 -15.853 482 H LEU 60 H LEU 60 9.733 -5.149 -14.255 483 HA LEU 60 HA LEU 60 10.286 -7.050 -16.174 484 HB2 LEU 60 2HB LEU 60 7.963 -6.182 -14.669 485 HB3 LEU 60 3HB LEU 60 7.528 -6.790 -16.265 486 HG LEU 60 HG LEU 60 9.050 -8.292 -14.135 487 HD11 LEU 60 1HD1 LEU 60 6.273 -8.696 -15.237 488 HD12 LEU 60 2HD1 LEU 60 6.662 -8.015 -13.658 489 HD13 LEU 60 3HD1 LEU 60 7.070 -9.692 -14.019 490 HD21 LEU 60 3HD2 LEU 60 8.255 -9.042 -16.941 491 HD22 LEU 60 1HD2 LEU 60 8.717 -10.219 -15.711 492 HD23 LEU 60 2HD2 LEU 60 9.876 -9.003 -16.247 493 H MET 61 H MET 61 8.741 -3.908 -16.557 494 HA MET 61 HA MET 61 8.131 -4.348 -19.340 495 HB2 MET 61 2HB MET 61 7.981 -1.905 -17.574 496 HB3 MET 61 3HB MET 61 7.538 -1.892 -19.276 497 HG2 MET 61 2HG MET 61 5.488 -2.286 -18.454 498 HG3 MET 61 3HG MET 61 6.050 -3.956 -18.448 499 HE1 MET 61 3HE MET 61 4.615 -5.020 -16.010 500 HE2 MET 61 1HE MET 61 6.136 -5.351 -16.840 501 HE3 MET 61 2HE MET 61 6.117 -5.127 -15.091 502 H ASP 62 H ASP 62 10.685 -2.879 -17.467 503 HA ASP 62 HA ASP 62 12.210 -2.493 -19.942 504 HB2 ASP 62 2HB ASP 62 13.140 -0.393 -18.544 505 HB3 ASP 62 3HB ASP 62 11.804 -0.267 -19.686 506 HA PRO 63 HA PRO 63 14.603 -4.849 -16.767 507 HB2 PRO 63 2HB PRO 63 15.607 -6.645 -18.538 508 HB3 PRO 63 3HB PRO 63 14.033 -6.842 -17.759 509 HG2 PRO 63 2HG PRO 63 14.677 -5.813 -20.496 510 HG3 PRO 63 3HG PRO 63 13.393 -6.929 -19.993 511 HD2 PRO 63 2HD PRO 63 12.936 -4.303 -20.471 512 HD3 PRO 63 3HD PRO 63 12.027 -5.225 -19.256 513 H ALA 64 H ALA 64 15.269 -2.990 -19.516 514 HA ALA 64 HA ALA 64 18.170 -3.255 -19.241 515 HB1 ALA 64 1HB ALA 64 18.287 -2.752 -21.406 516 HB2 ALA 64 2HB ALA 64 16.528 -2.885 -21.444 517 HB3 ALA 64 3HB ALA 64 17.288 -1.313 -21.198 518 H LYS 65 H LYS 65 15.555 -0.972 -18.747 519 HA LYS 65 HA LYS 65 17.129 1.329 -18.304 520 HB2 LYS 65 2HB LYS 65 14.518 0.984 -18.618 521 HB3 LYS 65 3HB LYS 65 14.543 0.963 -16.860 522 HG2 LYS 65 2HG LYS 65 16.038 3.167 -18.094 523 HG3 LYS 65 3HG LYS 65 14.294 3.193 -18.365 524 HD2 LYS 65 2HD LYS 65 14.436 4.353 -16.388 525 HD3 LYS 65 3HD LYS 65 14.206 2.710 -15.785 526 HE2 LYS 65 2HE LYS 65 16.191 2.725 -14.777 527 HE3 LYS 65 3HE LYS 65 17.000 3.269 -16.245 528 HZ1 LYS 65 3HZ LYS 65 16.538 4.726 -13.932 529 HZ2 LYS 65 1HZ LYS 65 15.536 5.400 -15.117 530 HZ3 LYS 65 2HZ LYS 65 17.202 5.284 -15.384 531 H TYR 66 H TYR 66 15.642 -0.956 -16.011 532 HA TYR 66 HA TYR 66 17.175 0.210 -13.826 533 HB2 TYR 66 2HB TYR 66 14.976 -1.839 -13.975 534 HB3 TYR 66 3HB TYR 66 15.904 -1.601 -12.498 535 HD1 TYR 66 HD1 TYR 66 14.011 0.405 -15.024 536 HD2 TYR 66 HD2 TYR 66 15.089 -0.107 -10.940 537 HE1 TYR 66 HE1 TYR 66 12.535 2.273 -14.406 538 HE2 TYR 66 HE2 TYR 66 13.615 1.759 -10.311 539 HH TYR 66 HH TYR 66 11.586 3.388 -12.711 540 H ALA 67 H ALA 67 18.283 -1.488 -16.112 541 HA ALA 67 HA ALA 67 19.285 -3.841 -14.758 542 HB1 ALA 67 1HB ALA 67 19.454 -4.592 -16.836 543 HB2 ALA 67 2HB ALA 67 18.992 -3.008 -17.458 544 HB3 ALA 67 3HB ALA 67 20.692 -3.382 -17.175 545 H SER 68 H SER 68 20.282 -0.587 -15.313 546 HA SER 68 HA SER 68 23.064 -1.174 -14.647 547 HB2 SER 68 2HB SER 68 22.656 0.397 -16.482 548 HB3 SER 68 3HB SER 68 21.727 1.436 -15.402 549 HG SER 68 HG SER 68 23.523 2.235 -14.664 550 H VAL 69 H VAL 69 20.241 -0.571 -13.029 551 HA VAL 69 HA VAL 69 20.795 1.298 -11.080 552 HB VAL 69 HB VAL 69 19.254 -1.286 -10.851 553 HG11 VAL 69 1HG1 VAL 69 19.459 0.999 -8.895 554 HG12 VAL 69 2HG1 VAL 69 18.229 -0.265 -8.828 555 HG13 VAL 69 3HG1 VAL 69 19.932 -0.679 -8.629 556 HG21 VAL 69 3HG2 VAL 69 17.738 1.159 -10.694 557 HG22 VAL 69 1HG2 VAL 69 18.706 1.114 -12.167 558 HG23 VAL 69 2HG2 VAL 69 17.574 -0.192 -11.816 559 H ASP 70 H ASP 70 22.338 1.467 -9.607 560 HA ASP 70 HA ASP 70 24.129 -0.713 -9.070 561 HB2 ASP 70 2HB ASP 70 23.987 2.019 -7.776 562 HB3 ASP 70 3HB ASP 70 25.331 0.887 -7.666 563 H THR 71 H THR 71 22.450 -2.151 -8.196 564 HA THR 71 HA THR 71 20.903 -1.774 -5.972 565 HB THR 71 HB THR 71 21.677 -4.313 -5.499 566 HG1 THR 71 HG1 THR 71 22.220 -5.225 -7.563 567 HG21 THR 71 3HG2 THR 71 20.068 -4.298 -7.895 568 HG22 THR 71 1HG2 THR 71 19.559 -3.021 -6.791 569 HG23 THR 71 2HG2 THR 71 19.607 -4.696 -6.240 570 H TYR 72 H TYR 72 24.365 -2.326 -6.109 571 HA TYR 72 HA TYR 72 24.848 -2.924 -3.425 572 HB2 TYR 72 2HB TYR 72 26.609 -3.225 -5.012 573 HB3 TYR 72 3HB TYR 72 26.554 -1.533 -5.492 574 HD1 TYR 72 HD2 TYR 72 27.378 -3.776 -2.647 575 HD2 TYR 72 HD1 TYR 72 27.902 0.058 -4.417 576 HE1 TYR 72 HE2 TYR 72 29.122 -3.257 -0.992 577 HE2 TYR 72 HE1 TYR 72 29.648 0.587 -2.767 578 HH TYR 72 HH TYR 72 30.283 -0.158 -0.454 579 H ASP 73 H ASP 73 24.683 0.207 -5.079 580 HA ASP 73 HA ASP 73 25.315 1.757 -2.785 581 HB2 ASP 73 2HB ASP 73 25.464 2.474 -5.229 582 HB3 ASP 73 3HB ASP 73 23.721 2.714 -5.160 583 H ARG 74 H ARG 74 24.103 1.892 -1.024 584 HA ARG 74 HA ARG 74 21.464 1.051 -0.776 585 HB2 ARG 74 2HB ARG 74 21.499 1.957 1.407 586 HB3 ARG 74 3HB ARG 74 23.157 1.476 1.071 587 HG2 ARG 74 2HG ARG 74 22.157 4.287 0.709 588 HG3 ARG 74 3HG ARG 74 22.870 3.693 2.210 589 HD2 ARG 74 2HD ARG 74 24.174 3.885 -0.498 590 HD3 ARG 74 3HD ARG 74 24.587 4.787 0.959 591 HE ARG 74 HE ARG 74 24.924 2.181 1.672 592 HH11 ARG 74 1HH1 ARG 74 26.146 4.190 -0.895 593 HH12 ARG 74 2HH1 ARG 74 27.647 3.335 -1.026 594 HH21 ARG 74 1HH2 ARG 74 26.897 1.048 1.510 595 HH22 ARG 74 2HH2 ARG 74 28.073 1.548 0.342 596 H GLU 75 H GLU 75 22.743 4.031 -1.953 597 HA GLU 75 HA GLU 75 20.505 5.695 -1.506 598 HB2 GLU 75 2HB GLU 75 22.973 5.803 -3.109 599 HB3 GLU 75 3HB GLU 75 21.633 6.736 -3.760 600 HG2 GLU 75 2HG GLU 75 21.417 7.783 -1.474 601 HG3 GLU 75 3HG GLU 75 22.959 7.024 -1.082 602 H GLN 76 H GLN 76 21.553 3.976 -4.450 603 HA GLN 76 HA GLN 76 19.332 4.608 -6.018 604 HB2 GLN 76 2HB GLN 76 21.009 2.097 -6.149 605 HB3 GLN 76 3HB GLN 76 19.996 2.736 -7.436 606 HG2 GLN 76 2HG GLN 76 21.813 4.764 -6.583 607 HG3 GLN 76 3HG GLN 76 22.705 3.281 -6.917 608 HE21 GLN 76 1HE2 GLN 76 23.614 3.629 -8.832 609 HE22 GLN 76 2HE2 GLN 76 22.775 4.100 -10.267 610 H VAL 77 H VAL 77 19.970 1.556 -4.280 611 HA VAL 77 HA VAL 77 17.558 0.301 -4.744 612 HB VAL 77 HB VAL 77 19.727 -0.441 -3.402 613 HG11 VAL 77 1HG1 VAL 77 17.776 0.063 -1.165 614 HG12 VAL 77 2HG1 VAL 77 19.424 -0.559 -1.046 615 HG13 VAL 77 3HG1 VAL 77 19.144 1.117 -1.519 616 HG21 VAL 77 3HG2 VAL 77 16.964 -1.455 -3.508 617 HG22 VAL 77 1HG2 VAL 77 18.481 -2.237 -3.954 618 HG23 VAL 77 2HG2 VAL 77 17.989 -2.166 -2.262 619 H MET 78 H MET 78 18.313 2.849 -2.470 620 HA MET 78 HA MET 78 15.961 2.629 -0.898 621 HB2 MET 78 2HB MET 78 18.179 4.547 -1.195 622 HB3 MET 78 3HB MET 78 16.662 5.249 -0.649 623 HG2 MET 78 2HG MET 78 16.621 3.431 1.114 624 HG3 MET 78 3HG MET 78 18.292 3.101 0.662 625 HE1 MET 78 3HE MET 78 20.334 5.571 2.442 626 HE2 MET 78 1HE MET 78 20.128 3.980 1.709 627 HE3 MET 78 2HE MET 78 20.178 5.419 0.691 628 H LYS 79 H LYS 79 16.851 4.815 -3.564 629 HA LYS 79 HA LYS 79 14.460 6.236 -3.707 630 HB2 LYS 79 2HB LYS 79 16.429 5.514 -5.882 631 HB3 LYS 79 3HB LYS 79 15.108 6.655 -6.100 632 HG2 LYS 79 2HG LYS 79 16.095 8.261 -4.812 633 HG3 LYS 79 3HG LYS 79 16.992 7.090 -3.842 634 HD2 LYS 79 2HD LYS 79 18.402 6.623 -5.850 635 HD3 LYS 79 3HD LYS 79 17.580 7.951 -6.672 636 HE2 LYS 79 2HE LYS 79 18.887 8.380 -4.013 637 HE3 LYS 79 3HE LYS 79 19.846 8.392 -5.491 638 HZ1 LYS 79 3HZ LYS 79 19.289 10.589 -5.288 639 HZ2 LYS 79 1HZ LYS 79 17.771 10.274 -4.610 640 HZ3 LYS 79 2HZ LYS 79 18.020 10.050 -6.268 641 H ILE 80 H ILE 80 15.403 3.214 -5.298 642 HA ILE 80 HA ILE 80 13.071 2.915 -6.854 643 HB ILE 80 HB ILE 80 15.104 0.937 -5.855 644 HG12 ILE 80 2HG1 ILE 80 14.927 0.980 -8.659 645 HG13 ILE 80 3HG1 ILE 80 14.812 2.662 -8.154 646 HG21 ILE 80 1HG2 ILE 80 12.487 0.436 -7.143 647 HG22 ILE 80 2HG2 ILE 80 13.865 -0.487 -7.737 648 HG23 ILE 80 3HG2 ILE 80 13.418 -0.570 -6.034 649 HD11 ILE 80 3HD1 ILE 80 16.929 1.089 -6.857 650 HD12 ILE 80 1HD1 ILE 80 17.127 1.374 -8.586 651 HD13 ILE 80 2HD1 ILE 80 16.952 2.738 -7.482 652 H ILE 81 H ILE 81 13.978 1.415 -3.749 653 HA ILE 81 HA ILE 81 11.574 0.049 -3.323 654 HB ILE 81 HB ILE 81 13.590 1.115 -1.350 655 HG12 ILE 81 2HG1 ILE 81 13.045 -1.698 -2.319 656 HG13 ILE 81 3HG1 ILE 81 14.327 -0.662 -2.936 657 HG21 ILE 81 1HG2 ILE 81 12.020 0.807 0.209 658 HG22 ILE 81 2HG2 ILE 81 10.960 -0.057 -0.903 659 HG23 ILE 81 3HG2 ILE 81 12.259 -0.917 -0.076 660 HD11 ILE 81 3HD1 ILE 81 14.305 -1.012 -0.024 661 HD12 ILE 81 1HD1 ILE 81 14.637 -2.469 -0.960 662 HD13 ILE 81 2HD1 ILE 81 15.648 -1.038 -1.168 663 H ASP 82 H ASP 82 12.527 3.350 -2.567 664 HA ASP 82 HA ASP 82 10.236 3.960 -0.988 665 HB2 ASP 82 2HB ASP 82 12.292 5.259 -0.776 666 HB3 ASP 82 3HB ASP 82 12.154 5.785 -2.452 667 H GLU 83 H GLU 83 11.137 4.771 -4.340 668 HA GLU 83 HA GLU 83 8.749 6.076 -5.008 669 HB2 GLU 83 2HB GLU 83 10.916 4.748 -6.591 670 HB3 GLU 83 3HB GLU 83 9.454 5.285 -7.407 671 HG2 GLU 83 2HG GLU 83 11.294 7.022 -5.777 672 HG3 GLU 83 3HG GLU 83 11.232 6.947 -7.537 673 H PHE 84 H PHE 84 9.745 2.707 -5.584 674 HA PHE 84 HA PHE 84 7.282 1.914 -6.737 675 HB2 PHE 84 2HB PHE 84 9.613 0.412 -5.572 676 HB3 PHE 84 3HB PHE 84 8.169 -0.434 -6.116 677 HD1 PHE 84 HD1 PHE 84 10.400 2.274 -7.398 678 HD2 PHE 84 HD2 PHE 84 8.304 -1.341 -8.209 679 HE1 PHE 84 HE1 PHE 84 11.264 2.293 -9.702 680 HE2 PHE 84 HE2 PHE 84 9.166 -1.328 -10.513 681 HZ PHE 84 HZ PHE 84 10.648 0.490 -11.263 682 H LYS 85 H LYS 85 8.193 2.561 -3.540 683 HA LYS 85 HA LYS 85 7.166 2.314 -1.525 684 HB2 LYS 85 2HB LYS 85 4.787 1.917 -3.343 685 HB3 LYS 85 3HB LYS 85 4.659 2.043 -1.593 686 HG2 LYS 85 2HG LYS 85 6.022 4.186 -3.170 687 HG3 LYS 85 3HG LYS 85 4.262 4.139 -3.043 688 HD2 LYS 85 2HD LYS 85 4.313 4.432 -0.714 689 HD3 LYS 85 3HD LYS 85 6.025 4.012 -0.613 690 HE2 LYS 85 2HE LYS 85 6.171 6.283 -0.431 691 HE3 LYS 85 3HE LYS 85 6.275 6.118 -2.183 692 HZ1 LYS 85 3HZ LYS 85 4.428 7.293 -2.413 693 HZ2 LYS 85 1HZ LYS 85 4.432 7.593 -0.748 694 HZ3 LYS 85 2HZ LYS 85 3.570 6.277 -1.367 695 H ILE 86 H ILE 86 8.581 0.144 -2.114 696 HA ILE 86 HA ILE 86 7.017 -2.266 -2.057 697 HB ILE 86 HB ILE 86 9.957 -2.000 -1.439 698 HG12 ILE 86 2HG1 ILE 86 8.637 -2.417 -4.130 699 HG13 ILE 86 3HG1 ILE 86 9.410 -0.927 -3.602 700 HG21 ILE 86 1HG2 ILE 86 8.622 -4.336 -2.745 701 HG22 ILE 86 2HG2 ILE 86 10.126 -4.276 -1.826 702 HG23 ILE 86 3HG2 ILE 86 8.578 -4.149 -0.992 703 HD11 ILE 86 3HD1 ILE 86 10.763 -2.407 -5.115 704 HD12 ILE 86 1HD1 ILE 86 11.545 -1.924 -3.610 705 HD13 ILE 86 2HD1 ILE 86 10.867 -3.545 -3.771 706 HA PRO 87 HA PRO 87 6.365 -2.344 2.322 707 HB2 PRO 87 2HB PRO 87 5.492 -4.909 2.485 708 HB3 PRO 87 3HB PRO 87 4.494 -3.593 1.855 709 HG2 PRO 87 2HG PRO 87 6.079 -5.649 0.364 710 HG3 PRO 87 3HG PRO 87 4.443 -5.045 0.039 711 HD2 PRO 87 2HD PRO 87 6.614 -4.184 -1.332 712 HD3 PRO 87 3HD PRO 87 5.218 -3.138 -0.999 713 H THR 88 H THR 88 7.317 -3.193 4.180 714 HA THR 88 HA THR 88 9.932 -4.356 3.784 715 HB THR 88 HB THR 88 9.288 -4.244 6.554 716 HG1 THR 88 HG1 THR 88 8.877 -1.826 6.442 717 HG21 THR 88 3HG2 THR 88 11.494 -3.878 5.427 718 HG22 THR 88 1HG2 THR 88 11.088 -2.661 6.635 719 HG23 THR 88 2HG2 THR 88 10.910 -2.294 4.919 720 H VAL 89 H VAL 89 10.625 -6.115 5.381 721 HA VAL 89 HA VAL 89 9.369 -8.500 4.786 722 HB VAL 89 HB VAL 89 11.044 -7.887 7.225 723 HG11 VAL 89 1HG1 VAL 89 9.684 -10.287 6.375 724 HG12 VAL 89 2HG1 VAL 89 11.430 -10.534 6.450 725 HG13 VAL 89 3HG1 VAL 89 10.558 -9.959 7.871 726 HG21 VAL 89 3HG2 VAL 89 12.778 -9.095 5.704 727 HG22 VAL 89 1HG2 VAL 89 11.699 -8.602 4.398 728 HG23 VAL 89 2HG2 VAL 89 12.431 -7.385 5.444 729 H GLU 90 H GLU 90 9.177 -6.721 7.874 730 HA GLU 90 HA GLU 90 7.380 -8.353 9.187 731 HB2 GLU 90 2HB GLU 90 8.009 -5.437 9.336 732 HB3 GLU 90 3HB GLU 90 6.617 -6.044 10.223 733 HG2 GLU 90 2HG GLU 90 8.062 -7.641 11.386 734 HG3 GLU 90 3HG GLU 90 9.454 -7.006 10.512 735 H GLN 91 H GLN 91 6.682 -5.629 7.020 736 HA GLN 91 HA GLN 91 3.895 -5.674 7.252 737 HB2 GLN 91 2HB GLN 91 5.451 -4.929 4.774 738 HB3 GLN 91 3HB GLN 91 3.844 -4.376 5.225 739 HG2 GLN 91 2HG GLN 91 6.442 -3.704 6.584 740 HG3 GLN 91 3HG GLN 91 5.420 -2.624 5.636 741 HE21 GLN 91 1HE2 GLN 91 6.326 -2.336 8.371 742 HE22 GLN 91 2HE2 GLN 91 4.906 -2.232 9.349 743 H TRP 92 H TRP 92 6.056 -7.400 5.044 744 HA TRP 92 HA TRP 92 4.036 -8.596 3.479 745 HB2 TRP 92 2HB TRP 92 6.413 -8.447 2.794 746 HB3 TRP 92 3HB TRP 92 6.826 -9.624 4.038 747 HD1 TRP 92 HD1 TRP 92 4.258 -9.561 1.109 748 HE1 TRP 92 HE1 TRP 92 4.376 -11.840 -0.081 749 HE3 TRP 92 HE3 TRP 92 7.844 -11.796 3.987 750 HZ2 TRP 92 HZ2 TRP 92 5.799 -14.264 0.167 751 HZ3 TRP 92 HZ3 TRP 92 8.526 -14.097 3.444 752 HH2 TRP 92 HH2 TRP 92 7.524 -15.304 1.574 753 H LYS 93 H LYS 93 5.660 -9.589 6.444 754 HA LYS 93 HA LYS 93 4.637 -12.217 6.552 755 HB2 LYS 93 2HB LYS 93 5.455 -10.418 8.842 756 HB3 LYS 93 3HB LYS 93 5.272 -12.166 8.917 757 HG2 LYS 93 2HG LYS 93 7.140 -11.067 6.895 758 HG3 LYS 93 3HG LYS 93 7.625 -11.001 8.591 759 HD2 LYS 93 2HD LYS 93 8.289 -13.118 8.398 760 HD3 LYS 93 3HD LYS 93 6.591 -13.569 8.226 761 HE2 LYS 93 2HE LYS 93 7.465 -14.481 6.313 762 HE3 LYS 93 3HE LYS 93 6.994 -12.888 5.723 763 HZ1 LYS 93 3HZ LYS 93 9.702 -13.260 6.791 764 HZ2 LYS 93 1HZ LYS 93 9.153 -12.193 5.598 765 HZ3 LYS 93 2HZ LYS 93 9.356 -13.833 5.238 766 H ASP 94 H ASP 94 3.527 -9.204 8.085 767 HA ASP 94 HA ASP 94 1.291 -10.300 9.381 768 HB2 ASP 94 2HB ASP 94 2.140 -7.554 8.584 769 HB3 ASP 94 3HB ASP 94 0.462 -7.794 9.064 770 H GLN 95 H GLN 95 1.613 -8.762 6.200 771 HA GLN 95 HA GLN 95 -1.083 -8.811 5.471 772 HB2 GLN 95 2HB GLN 95 1.493 -8.732 3.961 773 HB3 GLN 95 3HB GLN 95 0.002 -9.016 3.073 774 HG2 GLN 95 2HG GLN 95 0.531 -6.655 4.864 775 HG3 GLN 95 3HG GLN 95 0.657 -6.652 3.105 776 HE21 GLN 95 1HE2 GLN 95 -1.515 -8.010 2.306 777 HE22 GLN 95 2HE2 GLN 95 -2.961 -7.201 2.797 778 H THR 96 H THR 96 1.480 -11.179 4.759 779 HA THR 96 HA THR 96 -0.115 -13.018 3.383 780 HB THR 96 HB THR 96 1.647 -14.717 4.221 781 HG1 THR 96 HG1 THR 96 3.356 -13.894 5.308 782 HG21 THR 96 3HG2 THR 96 1.669 -13.630 2.003 783 HG22 THR 96 1HG2 THR 96 3.293 -13.889 2.639 784 HG23 THR 96 2HG2 THR 96 2.571 -12.281 2.693 785 H ARG 97 H ARG 97 0.717 -12.838 6.832 786 HA ARG 97 HA ARG 97 -0.551 -15.171 7.675 787 HB2 ARG 97 2HB ARG 97 0.068 -12.568 9.043 788 HB3 ARG 97 3HB ARG 97 -0.804 -13.841 9.886 789 HG2 ARG 97 2HG ARG 97 1.773 -14.483 8.531 790 HG3 ARG 97 3HG ARG 97 1.785 -13.655 10.090 791 HD2 ARG 97 2HD ARG 97 0.659 -15.442 11.153 792 HD3 ARG 97 3HD ARG 97 0.240 -16.189 9.612 793 HE ARG 97 HE ARG 97 3.033 -16.047 9.822 794 HH11 ARG 97 1HH1 ARG 97 0.325 -17.702 11.253 795 HH12 ARG 97 2HH1 ARG 97 1.239 -19.115 11.665 796 HH21 ARG 97 1HH2 ARG 97 4.247 -17.902 10.360 797 HH22 ARG 97 2HH2 ARG 97 3.470 -19.227 11.157 798 H ARG 98 H ARG 98 -1.835 -11.876 7.372 799 HA ARG 98 HA ARG 98 -4.428 -12.520 8.336 800 HB2 ARG 98 2HB ARG 98 -3.356 -10.207 6.726 801 HB3 ARG 98 3HB ARG 98 -5.045 -10.323 7.203 802 HG2 ARG 98 2HG ARG 98 -4.007 -10.650 9.596 803 HG3 ARG 98 3HG ARG 98 -2.633 -9.820 8.863 804 HD2 ARG 98 2HD ARG 98 -4.020 -8.167 9.880 805 HD3 ARG 98 3HD ARG 98 -4.210 -8.025 8.133 806 HE ARG 98 HE ARG 98 -6.228 -9.698 8.968 807 HH11 ARG 98 1HH1 ARG 98 -5.213 -6.436 9.639 808 HH12 ARG 98 2HH1 ARG 98 -6.813 -5.870 9.983 809 HH21 ARG 98 1HH2 ARG 98 -8.340 -8.965 9.419 810 HH22 ARG 98 2HH2 ARG 98 -8.591 -7.309 9.859 811 H TYR 99 H TYR 99 -2.915 -12.583 5.184 812 HA TYR 99 HA TYR 99 -5.292 -12.801 3.652 813 HB2 TYR 99 2HB TYR 99 -3.282 -12.119 2.545 814 HB3 TYR 99 3HB TYR 99 -2.430 -13.567 3.069 815 HD1 TYR 99 HD1 TYR 99 -5.825 -13.270 1.570 816 HD2 TYR 99 HD2 TYR 99 -1.821 -14.624 1.079 817 HE1 TYR 99 HE1 TYR 99 -6.469 -14.398 -0.518 818 HE2 TYR 99 HE2 TYR 99 -2.454 -15.754 -1.012 819 HH TYR 99 HH TYR 99 -4.974 -16.715 -1.893 820 H LYS 100 H LYS 100 -3.158 -15.146 5.181 821 HA LYS 100 HA LYS 100 -4.558 -17.409 4.061 822 HB2 LYS 100 2HB LYS 100 -2.323 -17.104 6.053 823 HB3 LYS 100 3HB LYS 100 -3.082 -18.663 5.760 824 HG2 LYS 100 2HG LYS 100 -1.982 -17.042 3.498 825 HG3 LYS 100 3HG LYS 100 -0.936 -18.071 4.480 826 HD2 LYS 100 2HD LYS 100 -2.339 -20.004 3.944 827 HD3 LYS 100 3HD LYS 100 -3.389 -18.974 2.968 828 HE2 LYS 100 2HE LYS 100 -1.526 -18.474 1.476 829 HE3 LYS 100 3HE LYS 100 -0.453 -19.464 2.466 830 HZ1 LYS 100 3HZ LYS 100 -1.656 -21.409 1.879 831 HZ2 LYS 100 1HZ LYS 100 -1.325 -20.582 0.441 832 HZ3 LYS 100 2HZ LYS 100 -2.875 -20.518 1.116 833 H GLU 101 H GLU 101 -4.772 -15.431 6.879 834 HA GLU 101 HA GLU 101 -6.423 -17.375 8.297 835 HB2 GLU 101 2HB GLU 101 -5.058 -16.359 9.850 836 HB3 GLU 101 3HB GLU 101 -5.086 -14.810 9.020 837 HG2 GLU 101 2HG GLU 101 -6.994 -14.132 10.043 838 HG3 GLU 101 3HG GLU 101 -7.627 -15.770 10.197 839 H SER 102 H SER 102 -8.588 -17.223 8.540 840 HA SER 102 HA SER 102 -10.739 -16.563 8.200 841 HB2 SER 102 2HB SER 102 -9.775 -14.479 9.390 842 HB3 SER 102 3HB SER 102 -9.777 -13.739 7.789 843 HG SER 102 HG SER 102 -11.743 -13.622 9.308 844 H SER 103 H SER 103 -9.494 -17.618 6.026 845 HA SER 103 HA SER 103 -9.523 -16.049 3.695 846 HB2 SER 103 2HB SER 103 -10.025 -19.028 3.888 847 HB3 SER 103 3HB SER 103 -9.452 -18.143 2.474 848 HG SER 103 HG SER 103 -7.835 -19.263 3.859 849 H ILE 104 H ILE 104 -11.078 -17.238 1.828 850 HA ILE 104 HA ILE 104 -13.506 -15.944 2.009 851 HB ILE 104 HB ILE 104 -12.985 -18.470 0.437 852 HG12 ILE 104 2HG1 ILE 104 -11.277 -16.829 -0.071 853 HG13 ILE 104 3HG1 ILE 104 -12.411 -16.908 -1.415 854 HG21 ILE 104 1HG2 ILE 104 -14.664 -17.179 -1.110 855 HG22 ILE 104 2HG2 ILE 104 -15.248 -18.166 0.229 856 HG23 ILE 104 3HG2 ILE 104 -15.141 -16.415 0.406 857 HD11 ILE 104 3HD1 ILE 104 -12.517 -14.700 -1.283 858 HD12 ILE 104 1HD1 ILE 104 -13.440 -14.921 0.203 859 HD13 ILE 104 2HD1 ILE 104 -11.695 -14.679 0.277 860 H GLN 105 H GLN 105 -15.604 -16.546 2.524 861 HA GLN 105 HA GLN 105 -16.356 -19.141 3.360 862 HB2 GLN 105 2HB GLN 105 -16.666 -18.711 5.758 863 HB3 GLN 105 3HB GLN 105 -14.970 -18.629 5.300 864 HG2 GLN 105 2HG GLN 105 -15.042 -16.214 5.329 865 HG3 GLN 105 3HG GLN 105 -16.769 -16.246 5.681 866 HE21 GLN 105 1HE2 GLN 105 -14.361 -15.204 7.146 867 HE22 GLN 105 2HE2 GLN 105 -14.500 -15.872 8.733 868 H ILE 106 H ILE 106 -18.453 -18.741 4.968 869 HA ILE 106 HA ILE 106 -20.113 -16.829 3.464 870 HB ILE 106 HB ILE 106 -21.021 -19.310 4.927 871 HG12 ILE 106 2HG1 ILE 106 -21.470 -19.382 2.096 872 HG13 ILE 106 3HG1 ILE 106 -19.769 -19.048 2.396 873 HG21 ILE 106 1HG2 ILE 106 -22.746 -17.631 4.870 874 HG22 ILE 106 2HG2 ILE 106 -22.489 -17.372 3.146 875 HG23 ILE 106 3HG2 ILE 106 -23.146 -18.905 3.719 876 HD11 ILE 106 3HD1 ILE 106 -20.535 -21.486 2.172 877 HD12 ILE 106 1HD1 ILE 106 -19.439 -21.063 3.487 878 HD13 ILE 106 2HD1 ILE 106 -21.159 -21.283 3.809 879 H GLY 107 H GLY 107 -21.571 -15.510 4.556 880 HA2 GLY 107 2HA GLY 107 -20.800 -14.431 6.983 881 HA3 GLY 107 3HA GLY 107 -22.412 -14.273 6.299 882 H ASN 108 H ASN 108 -21.216 -14.795 9.090 883 HA ASN 108 HA ASN 108 -22.513 -17.315 9.764 884 HB2 ASN 108 2HB ASN 108 -20.853 -15.376 11.383 885 HB3 ASN 108 3HB ASN 108 -21.610 -16.811 12.070 886 HD21 ASN 108 1HD2 ASN 108 -20.820 -18.835 11.549 887 HD22 ASN 108 2HD2 ASN 108 -19.287 -19.063 10.787 888 H GLY 109 H GLY 109 -24.187 -17.497 11.298 889 HA2 GLY 109 2HA GLY 109 -26.295 -15.722 11.072 890 HA3 GLY 109 3HA GLY 109 -26.117 -16.880 12.381 891 H HIS 110 H HIS 110 -27.383 -14.621 12.995 892 HA HIS 110 HA HIS 110 -25.947 -12.378 13.735 893 HB2 HIS 110 2HB HIS 110 -28.447 -12.670 13.826 894 HB3 HIS 110 3HB HIS 110 -28.226 -13.557 15.331 895 HD1 HIS 110 HD1 HIS 110 -28.211 -12.194 17.408 896 HD2 HIS 110 HD2 HIS 110 -27.472 -9.897 14.025 897 HE1 HIS 110 HE1 HIS 110 -28.149 -9.812 18.212 898 H GLY 111 H GLY 111 -26.093 -15.511 15.254 899 HA2 GLY 111 2HA GLY 111 -24.842 -14.606 17.704 900 HA3 GLY 111 3HA GLY 111 -25.232 -16.266 17.280 901 H GLN 112 H GLN 112 -23.155 -13.745 15.849 902 HA GLN 112 HA GLN 112 -20.721 -14.974 16.503 903 HB2 GLN 112 2HB GLN 112 -21.919 -16.525 14.685 904 HB3 GLN 112 3HB GLN 112 -21.171 -15.369 13.591 905 HG2 GLN 112 2HG GLN 112 -19.564 -16.700 15.732 906 HG3 GLN 112 3HG GLN 112 -19.902 -17.523 14.210 907 HE21 GLN 112 1HE2 GLN 112 -17.538 -16.042 15.665 908 HE22 GLN 112 2HE2 GLN 112 -16.790 -15.194 14.360 909 H SER 113 H SER 113 -19.310 -13.364 16.459 910 HA SER 113 HA SER 113 -19.846 -11.055 14.746 911 HB2 SER 113 2HB SER 113 -17.905 -11.387 17.047 912 HB3 SER 113 3HB SER 113 -18.197 -9.887 16.167 913 HG SER 113 HG SER 113 -19.444 -9.917 18.039 914 H GLN 114 H GLN 114 -18.396 -10.258 13.261 915 HA GLN 114 HA GLN 114 -16.434 -12.169 12.290 916 HB2 GLN 114 2HB GLN 114 -17.429 -9.555 11.145 917 HB3 GLN 114 3HB GLN 114 -16.254 -10.601 10.357 918 HG2 GLN 114 2HG GLN 114 -18.146 -11.293 9.312 919 HG3 GLN 114 3HG GLN 114 -18.144 -12.402 10.682 920 HE21 GLN 114 1HE2 GLN 114 -20.385 -12.666 10.498 921 HE22 GLN 114 2HE2 GLN 114 -21.487 -11.448 11.034 922 H GLY 115 H GLY 115 -16.270 -8.616 12.437 923 HA2 GLY 115 2HA GLY 115 -14.701 -7.279 13.536 924 HA3 GLY 115 3HA GLY 115 -13.874 -8.733 14.074 925 H LEU 116 H LEU 116 -14.698 -7.373 10.882 926 HA LEU 116 HA LEU 116 -11.836 -7.379 10.226 927 HB2 LEU 116 2HB LEU 116 -12.706 -8.092 7.860 928 HB3 LEU 116 3HB LEU 116 -12.359 -9.293 9.103 929 HG LEU 116 HG LEU 116 -14.804 -9.326 9.636 930 HD11 LEU 116 1HD1 LEU 116 -15.958 -8.449 7.297 931 HD12 LEU 116 2HD1 LEU 116 -14.777 -7.191 7.662 932 HD13 LEU 116 3HD1 LEU 116 -16.005 -7.620 8.853 933 HD21 LEU 116 3HD2 LEU 116 -15.409 -10.527 7.470 934 HD22 LEU 116 1HD2 LEU 116 -14.008 -11.125 8.359 935 HD23 LEU 116 2HD2 LEU 116 -13.781 -10.121 6.926 936 H GLU 117 H GLU 117 -11.563 -6.267 7.965 937 HA GLU 117 HA GLU 117 -13.231 -3.838 7.993 938 HB2 GLU 117 2HB GLU 117 -10.305 -4.261 7.642 939 HB3 GLU 117 3HB GLU 117 -11.056 -2.964 6.723 940 HG2 GLU 117 2HG GLU 117 -12.045 -2.228 8.982 941 HG3 GLU 117 3HG GLU 117 -10.812 -3.272 9.687 942 H1 GLY -9 H GLY -9 4.845 -14.984 10.423 943 HA2 GLY -9 2HA GLY -9 5.919 -16.946 8.972 944 HA3 GLY -9 3HA GLY -9 6.789 -15.559 8.335 945 H LYS -8 H LYS -8 8.802 -16.003 9.090 946 HA LYS -8 HA LYS -8 9.463 -15.278 11.715 947 HB2 LYS -8 2HB LYS -8 10.389 -17.642 12.325 948 HB3 LYS -8 3HB LYS -8 8.701 -17.260 12.636 949 HG2 LYS -8 2HG LYS -8 8.881 -19.462 11.680 950 HG3 LYS -8 3HG LYS -8 8.081 -18.380 10.537 951 HD2 LYS -8 2HD LYS -8 10.155 -18.125 9.295 952 HD3 LYS -8 3HD LYS -8 11.003 -19.136 10.467 953 HE2 LYS -8 2HE LYS -8 8.886 -20.716 9.727 954 HE3 LYS -8 3HE LYS -8 9.287 -19.887 8.224 955 HZ1 LYS -8 3HZ LYS -8 11.660 -20.738 9.464 956 HZ2 LYS -8 1HZ LYS -8 11.019 -21.217 7.974 957 HZ3 LYS -8 2HZ LYS -8 10.598 -22.052 9.383 958 H PHE -7 H PHE -7 10.402 -14.537 9.256 959 HA PHE -7 HA PHE -7 12.868 -15.939 8.691 960 HB2 PHE -7 2HB PHE -7 11.526 -13.512 7.516 961 HB3 PHE -7 3HB PHE -7 13.164 -13.970 7.061 962 HD1 PHE -7 HD2 PHE -7 9.850 -15.642 7.485 963 HD2 PHE -7 HD1 PHE -7 13.358 -15.163 5.122 964 HE1 PHE -7 HE2 PHE -7 8.943 -17.216 5.825 965 HE2 PHE -7 HE1 PHE -7 12.456 -16.735 3.458 966 HZ PHE -7 HZ PHE -7 10.246 -17.765 3.809 967 H ILE -6 H ILE -6 12.382 -12.445 9.091 968 HA ILE -6 HA ILE -6 13.694 -10.847 10.055 969 HB ILE -6 HB ILE -6 14.185 -12.884 12.221 970 HG12 ILE -6 2HG1 ILE -6 11.803 -12.898 11.727 971 HG13 ILE -6 3HG1 ILE -6 12.085 -12.065 13.251 972 HG21 ILE -6 1HG2 ILE -6 13.957 -10.721 13.602 973 HG22 ILE -6 2HG2 ILE -6 15.444 -10.989 12.694 974 HG23 ILE -6 3HG2 ILE -6 14.213 -9.894 12.065 975 HD11 ILE -6 3HD1 ILE -6 10.715 -11.142 10.960 976 HD12 ILE -6 1HD1 ILE -6 10.992 -10.307 12.489 977 HD13 ILE -6 2HD1 ILE -6 12.152 -10.141 11.171 978 HA PRO -5 HA PRO -5 17.628 -12.696 8.502 979 HB2 PRO -5 2HB PRO -5 18.230 -10.594 6.892 980 HB3 PRO -5 3HB PRO -5 17.185 -11.926 6.383 981 HG2 PRO -5 2HG PRO -5 16.435 -9.207 7.386 982 HG3 PRO -5 3HG PRO -5 15.750 -10.129 6.035 983 HD2 PRO -5 2HD PRO -5 14.551 -9.988 8.458 984 HD3 PRO -5 3HD PRO -5 14.438 -11.423 7.419 985 H SER -4 H SER -4 19.094 -12.525 10.089 986 HA SER -4 HA SER -4 19.973 -9.822 10.870 987 HB2 SER -4 2HB SER -4 20.289 -12.085 12.787 988 HB3 SER -4 3HB SER -4 20.017 -10.372 13.104 989 HG SER -4 HG SER -4 18.104 -11.280 13.565 990 H ARG -3 H ARG -3 21.271 -10.711 8.807 991 HA ARG -3 HA ARG -3 23.696 -12.052 9.803 992 HB2 ARG -3 2HB ARG -3 23.475 -11.754 6.904 993 HB3 ARG -3 3HB ARG -3 23.835 -13.182 7.865 994 HG2 ARG -3 2HG ARG -3 21.069 -12.069 7.450 995 HG3 ARG -3 3HG ARG -3 21.778 -13.375 6.498 996 HD2 ARG -3 2HD ARG -3 22.215 -14.352 8.946 997 HD3 ARG -3 3HD ARG -3 20.792 -13.369 9.291 998 HE ARG -3 HE ARG -3 20.206 -14.848 7.026 999 HH11 ARG -3 1HH1 ARG -3 20.997 -15.454 10.361 1000 HH12 ARG -3 2HH1 ARG -3 20.093 -16.930 10.443 1001 HH21 ARG -3 1HH2 ARG -3 19.012 -16.789 7.121 1002 HH22 ARG -3 2HH2 ARG -3 18.965 -17.689 8.599 1003 HA PRO -2 HA PRO -2 26.205 -8.521 9.113 1004 HB2 PRO -2 2HB PRO -2 28.431 -9.560 7.958 1005 HB3 PRO -2 3HB PRO -2 28.028 -9.807 9.661 1006 HG2 PRO -2 2HG PRO -2 27.603 -11.636 7.329 1007 HG3 PRO -2 3HG PRO -2 28.191 -12.017 8.958 1008 HD2 PRO -2 2HD PRO -2 25.636 -12.473 8.188 1009 HD3 PRO -2 3HD PRO -2 26.069 -12.042 9.856 1010 H ALA -1 H ALA -1 24.960 -10.253 6.502 1011 HA ALA -1 HA ALA -1 24.695 -9.832 4.276 1012 HB1 ALA -1 1HB ALA -1 23.826 -7.689 5.605 1013 HB2 ALA -1 2HB ALA -1 25.102 -6.925 4.656 1014 HB3 ALA -1 3HB ALA -1 23.799 -7.794 3.845 1015 HA PRO 0 HA PRO 0 29.184 -9.534 3.399 1016 HB2 PRO 0 2HB PRO 0 29.164 -11.528 1.557 1017 HB3 PRO 0 3HB PRO 0 29.292 -11.827 3.294 1018 HG2 PRO 0 2HG PRO 0 26.889 -11.990 1.517 1019 HG3 PRO 0 3HG PRO 0 27.406 -13.096 2.803 1020 HD2 PRO 0 2HD PRO 0 25.465 -11.243 3.167 1021 HD3 PRO 0 3HD PRO 0 26.557 -11.752 4.472 1022 H LYS 1 H LYS 1 29.877 -8.038 2.019 1023 HA LYS 1 HA LYS 1 28.267 -6.976 -0.050 1024 HB2 LYS 1 2HB LYS 1 31.080 -6.577 0.870 1025 HB3 LYS 1 3HB LYS 1 30.615 -5.945 -0.704 1026 HG2 LYS 1 2HG LYS 1 28.795 -4.680 0.372 1027 HG3 LYS 1 3HG LYS 1 29.347 -5.268 1.943 1028 HD2 LYS 1 2HD LYS 1 31.213 -3.831 0.087 1029 HD3 LYS 1 3HD LYS 1 30.124 -2.939 1.151 1030 HE2 LYS 1 2HE LYS 1 31.820 -5.112 2.290 1031 HE3 LYS 1 3HE LYS 1 32.557 -3.554 1.921 1032 HZ1 LYS 1 3HZ LYS 1 31.029 -2.467 3.376 1033 HZ2 LYS 1 1HZ LYS 1 31.731 -3.750 4.227 1034 HZ3 LYS 1 2HZ LYS 1 30.155 -3.893 3.630 1035 HA PRO 2 HA PRO 2 29.225 -9.415 -3.569 1036 HB2 PRO 2 2HB PRO 2 29.428 -7.552 -5.533 1037 HB3 PRO 2 3HB PRO 2 27.888 -8.004 -4.794 1038 HG2 PRO 2 2HG PRO 2 29.639 -5.642 -4.229 1039 HG3 PRO 2 3HG PRO 2 27.875 -5.714 -4.390 1040 HD2 PRO 2 2HD PRO 2 29.116 -5.637 -1.985 1041 HD3 PRO 2 3HD PRO 2 27.584 -6.497 -2.242 1042 HA PRO 3 HA PRO 3 33.532 -9.618 -4.430 1043 HB2 PRO 3 2HB PRO 3 33.586 -10.423 -7.022 1044 HB3 PRO 3 3HB PRO 3 33.102 -11.486 -5.695 1045 HG2 PRO 3 2HG PRO 3 31.391 -9.954 -7.615 1046 HG3 PRO 3 3HG PRO 3 31.205 -11.619 -7.034 1047 HD2 PRO 3 2HD PRO 3 29.761 -9.557 -6.035 1048 HD3 PRO 3 3HD PRO 3 30.244 -10.951 -5.048 1049 H SER 4 H SER 4 35.009 -8.090 -4.780 1050 HA SER 4 HA SER 4 35.106 -6.555 -7.191 1051 HB2 SER 4 2HB SER 4 33.337 -5.451 -5.590 1052 HB3 SER 4 3HB SER 4 34.766 -4.849 -4.750 1053 HG SER 4 HG SER 4 35.387 -3.780 -6.589 1054 H SER 5 H SER 5 37.076 -5.515 -7.476 1055 HA SER 5 HA SER 5 39.248 -6.552 -5.973 1056 HB2 SER 5 2HB SER 5 39.792 -6.133 -8.202 1057 HB3 SER 5 3HB SER 5 38.988 -4.564 -8.207 1058 HG SER 5 HG SER 5 41.523 -4.981 -7.894 1059 H ALA 6 H ALA 6 37.384 -3.629 -5.806 1060 HA ALA 6 HA ALA 6 39.292 -2.298 -4.066 1061 HB1 ALA 6 1HB ALA 6 37.917 -1.087 -5.789 1062 HB2 ALA 6 2HB ALA 6 36.513 -1.378 -4.762 1063 HB3 ALA 6 3HB ALA 6 37.859 -0.410 -4.161 Start of MODEL 17 1 H1 MET -2 H MET -2 0.522 2.544 -3.333 2 HA MET -2 HA MET -2 3.368 2.190 -3.401 3 HB2 MET -2 2HB MET -2 2.547 0.886 -1.356 4 HB3 MET -2 3HB MET -2 1.772 -0.201 -2.501 5 HG2 MET -2 2HG MET -2 4.226 -0.193 -3.538 6 HG3 MET -2 3HG MET -2 4.632 0.162 -1.861 7 HE1 MET -2 3HE MET -2 6.084 -2.266 -2.283 8 HE2 MET -2 1HE MET -2 5.242 -3.759 -2.698 9 HE3 MET -2 2HE MET -2 5.290 -2.425 -3.851 10 H ALA -1 H ALA -1 3.799 1.883 -5.475 11 HA ALA -1 HA ALA -1 1.746 0.780 -7.231 12 HB1 ALA -1 1HB ALA -1 2.500 2.370 -8.583 13 HB2 ALA -1 2HB ALA -1 3.867 2.698 -7.516 14 HB3 ALA -1 3HB ALA -1 3.995 1.449 -8.754 15 HA PRO 1 HA PRO 1 3.597 -3.151 -7.839 16 HB2 PRO 1 2HB PRO 1 3.248 -3.555 -10.501 17 HB3 PRO 1 3HB PRO 1 1.917 -3.604 -9.339 18 HG2 PRO 1 2HG PRO 1 2.763 -1.382 -11.158 19 HG3 PRO 1 3HG PRO 1 1.130 -1.965 -10.790 20 HD2 PRO 1 2HD PRO 1 2.180 0.248 -9.637 21 HD3 PRO 1 3HD PRO 1 1.031 -0.812 -8.796 22 H LEU 2 H LEU 2 5.736 -3.400 -7.632 23 HA LEU 2 HA LEU 2 7.464 -2.438 -9.816 24 HB2 LEU 2 2HB LEU 2 9.180 -1.927 -8.276 25 HB3 LEU 2 3HB LEU 2 7.701 -1.204 -7.648 26 HG LEU 2 HG LEU 2 7.748 -3.629 -6.374 27 HD11 LEU 2 1HD1 LEU 2 10.111 -3.631 -5.405 28 HD12 LEU 2 2HD1 LEU 2 10.563 -2.697 -6.830 29 HD13 LEU 2 3HD1 LEU 2 9.890 -4.316 -7.016 30 HD21 LEU 2 3HD2 LEU 2 8.992 -1.065 -5.389 31 HD22 LEU 2 1HD2 LEU 2 8.314 -2.361 -4.404 32 HD23 LEU 2 2HD2 LEU 2 7.259 -1.393 -5.434 33 H PHE 3 H PHE 3 8.825 -3.876 -10.718 34 HA PHE 3 HA PHE 3 8.969 -6.553 -9.494 35 HB2 PHE 3 2HB PHE 3 8.832 -5.735 -12.394 36 HB3 PHE 3 3HB PHE 3 9.352 -7.340 -11.891 37 HD1 PHE 3 HD1 PHE 3 6.551 -4.965 -11.218 38 HD2 PHE 3 HD2 PHE 3 7.765 -8.989 -11.891 39 HE1 PHE 3 HE1 PHE 3 4.201 -5.687 -11.116 40 HE2 PHE 3 HE2 PHE 3 5.417 -9.717 -11.791 41 HZ PHE 3 HZ PHE 3 3.631 -8.066 -11.405 42 H ALA 4 H ALA 4 10.931 -7.802 -10.103 43 HA ALA 4 HA ALA 4 13.266 -6.094 -10.615 44 HB1 ALA 4 1HB ALA 4 14.423 -7.624 -8.843 45 HB2 ALA 4 2HB ALA 4 13.481 -6.224 -8.327 46 HB3 ALA 4 3HB ALA 4 12.777 -7.839 -8.244 47 H VAL 5 H VAL 5 15.231 -7.382 -11.142 48 HA VAL 5 HA VAL 5 14.577 -9.976 -12.368 49 HB VAL 5 HB VAL 5 14.581 -8.358 -14.169 50 HG11 VAL 5 1HG1 VAL 5 15.958 -6.650 -13.032 51 HG12 VAL 5 2HG1 VAL 5 17.387 -7.644 -13.325 52 HG13 VAL 5 3HG1 VAL 5 16.488 -6.969 -14.684 53 HG21 VAL 5 3HG2 VAL 5 17.147 -9.386 -14.905 54 HG22 VAL 5 1HG2 VAL 5 16.253 -10.618 -14.013 55 HG23 VAL 5 2HG2 VAL 5 15.549 -9.888 -15.456 56 H THR 6 H THR 6 16.000 -11.550 -11.955 57 HA THR 6 HA THR 6 18.177 -11.073 -10.171 58 HB THR 6 HB THR 6 18.571 -13.630 -11.134 59 HG1 THR 6 HG1 THR 6 16.783 -14.226 -12.078 60 HG21 THR 6 3HG2 THR 6 18.421 -13.877 -8.925 61 HG22 THR 6 1HG2 THR 6 16.665 -13.828 -9.073 62 HG23 THR 6 2HG2 THR 6 17.566 -12.342 -8.773 63 H LEU 7 H LEU 7 20.325 -10.945 -10.558 64 HA LEU 7 HA LEU 7 21.165 -10.949 -13.378 65 HB2 LEU 7 2HB LEU 7 22.548 -9.638 -11.046 66 HB3 LEU 7 3HB LEU 7 22.928 -9.444 -12.755 67 HG LEU 7 HG LEU 7 20.298 -8.576 -11.581 68 HD11 LEU 7 1HD1 LEU 7 21.819 -6.305 -12.052 69 HD12 LEU 7 2HD1 LEU 7 22.914 -7.401 -11.210 70 HD13 LEU 7 3HD1 LEU 7 21.367 -6.968 -10.481 71 HD21 LEU 7 3HD2 LEU 7 21.182 -8.831 -14.186 72 HD22 LEU 7 1HD2 LEU 7 21.404 -7.118 -13.834 73 HD23 LEU 7 2HD2 LEU 7 19.816 -7.859 -13.636 74 H TYR 8 H TYR 8 21.498 -12.571 -10.412 75 HA TYR 8 HA TYR 8 23.696 -14.168 -11.528 76 HB2 TYR 8 2HB TYR 8 23.527 -13.294 -8.637 77 HB3 TYR 8 3HB TYR 8 24.781 -14.302 -9.350 78 HD1 TYR 8 HD1 TYR 8 23.319 -10.893 -9.407 79 HD2 TYR 8 HD2 TYR 8 26.661 -13.336 -10.391 80 HE1 TYR 8 HE1 TYR 8 24.628 -8.879 -9.935 81 HE2 TYR 8 HE2 TYR 8 27.980 -11.329 -10.920 82 HH TYR 8 HH TYR 8 26.536 -8.096 -10.797 83 H GLU 9 H GLU 9 23.882 -16.317 -10.511 84 HA GLU 9 HA GLU 9 21.248 -17.456 -10.137 85 HB2 GLU 9 2HB GLU 9 22.717 -18.673 -11.576 86 HB3 GLU 9 3HB GLU 9 24.000 -18.668 -10.374 87 HG2 GLU 9 2HG GLU 9 22.732 -20.833 -10.693 88 HG3 GLU 9 3HG GLU 9 22.914 -20.252 -9.039 89 H PHE 10 H PHE 10 20.400 -17.200 -8.163 90 HA PHE 10 HA PHE 10 22.082 -17.389 -5.798 91 HB2 PHE 10 2HB PHE 10 20.347 -15.618 -5.981 92 HB3 PHE 10 3HB PHE 10 19.109 -16.871 -6.000 93 HD1 PHE 10 HD1 PHE 10 22.064 -15.911 -3.928 94 HD2 PHE 10 HD2 PHE 10 18.029 -17.264 -4.023 95 HE1 PHE 10 HE1 PHE 10 21.997 -15.874 -1.469 96 HE2 PHE 10 HE2 PHE 10 17.956 -17.228 -1.564 97 HZ PHE 10 HZ PHE 10 19.941 -16.532 -0.284 98 H LYS 11 H LYS 11 22.622 -19.470 -5.404 99 HA LYS 11 HA LYS 11 20.721 -21.616 -5.687 100 HB2 LYS 11 2HB LYS 11 23.510 -21.587 -4.518 101 HB3 LYS 11 3HB LYS 11 22.558 -23.033 -4.824 102 HG2 LYS 11 2HG LYS 11 23.576 -21.086 -6.882 103 HG3 LYS 11 3HG LYS 11 24.171 -22.721 -6.585 104 HD2 LYS 11 2HD LYS 11 21.686 -23.393 -7.044 105 HD3 LYS 11 3HD LYS 11 21.619 -21.828 -7.858 106 HE2 LYS 11 2HE LYS 11 22.184 -23.365 -9.539 107 HE3 LYS 11 3HE LYS 11 23.702 -22.575 -9.116 108 HZ1 LYS 11 3HZ LYS 11 23.214 -25.276 -9.160 109 HZ2 LYS 11 1HZ LYS 11 23.256 -24.883 -7.515 110 HZ3 LYS 11 2HZ LYS 11 24.572 -24.507 -8.508 111 H ALA 12 H ALA 12 19.115 -21.726 -4.247 112 HA ALA 12 HA ALA 12 19.132 -20.708 -1.648 113 HB1 ALA 12 1HB ALA 12 17.024 -21.108 -2.557 114 HB2 ALA 12 2HB ALA 12 17.432 -22.761 -3.020 115 HB3 ALA 12 3HB ALA 12 17.187 -22.356 -1.321 116 H GLU 13 H GLU 13 19.204 -21.762 0.395 117 HA GLU 13 HA GLU 13 20.864 -24.197 0.386 118 HB2 GLU 13 2HB GLU 13 21.588 -23.395 2.683 119 HB3 GLU 13 3HB GLU 13 22.160 -22.451 1.315 120 HG2 GLU 13 2HG GLU 13 20.409 -20.800 1.717 121 HG3 GLU 13 3HG GLU 13 19.830 -21.747 3.086 122 H ARG 14 H ARG 14 18.052 -22.616 1.718 123 HA ARG 14 HA ARG 14 17.354 -25.123 3.101 124 HB2 ARG 14 2HB ARG 14 16.862 -22.263 3.906 125 HB3 ARG 14 3HB ARG 14 15.914 -23.588 4.570 126 HG2 ARG 14 2HG ARG 14 18.914 -23.500 4.712 127 HG3 ARG 14 3HG ARG 14 17.867 -22.811 5.955 128 HD2 ARG 14 2HD ARG 14 18.183 -24.896 6.830 129 HD3 ARG 14 3HD ARG 14 16.753 -25.201 5.845 130 HE ARG 14 HE ARG 14 18.013 -26.556 4.496 131 HH11 ARG 14 1HH1 ARG 14 20.128 -24.626 6.477 132 HH12 ARG 14 2HH1 ARG 14 21.561 -25.475 6.003 133 HH21 ARG 14 1HH2 ARG 14 19.893 -27.682 3.864 134 HH22 ARG 14 2HH2 ARG 14 21.427 -27.213 4.516 135 H ASP 15 H ASP 15 14.812 -24.981 3.593 136 HA ASP 15 HA ASP 15 13.544 -25.286 1.094 137 HB2 ASP 15 2HB ASP 15 12.633 -26.567 2.834 138 HB3 ASP 15 3HB ASP 15 12.553 -25.190 3.930 139 H ASP 16 H ASP 16 13.559 -22.659 3.446 140 HA ASP 16 HA ASP 16 11.538 -21.092 2.270 141 HB2 ASP 16 2HB ASP 16 12.715 -19.186 3.489 142 HB3 ASP 16 3HB ASP 16 12.175 -20.537 4.482 143 H GLU 17 H GLU 17 15.080 -20.934 1.931 144 HA GLU 17 HA GLU 17 15.220 -18.816 0.143 145 HB2 GLU 17 2HB GLU 17 16.999 -21.251 0.347 146 HB3 GLU 17 3HB GLU 17 17.393 -19.805 -0.572 147 HG2 GLU 17 2HG GLU 17 16.994 -19.985 2.405 148 HG3 GLU 17 3HG GLU 17 18.523 -19.770 1.554 149 H LEU 18 H LEU 18 14.933 -18.571 -2.005 150 HA LEU 18 HA LEU 18 13.940 -20.910 -3.488 151 HB2 LEU 18 2HB LEU 18 12.506 -18.802 -3.097 152 HB3 LEU 18 3HB LEU 18 13.536 -18.059 -4.319 153 HG LEU 18 HG LEU 18 12.767 -20.285 -5.635 154 HD11 LEU 18 1HD1 LEU 18 11.079 -21.305 -4.617 155 HD12 LEU 18 2HD1 LEU 18 10.106 -19.869 -4.932 156 HD13 LEU 18 3HD1 LEU 18 10.963 -20.033 -3.400 157 HD21 LEU 18 3HD2 LEU 18 12.568 -18.260 -6.734 158 HD22 LEU 18 1HD2 LEU 18 11.595 -17.540 -5.451 159 HD23 LEU 18 2HD2 LEU 18 10.883 -18.741 -6.529 160 H ASP 19 H ASP 19 14.872 -21.523 -5.369 161 HA ASP 19 HA ASP 19 17.443 -20.353 -6.014 162 HB2 ASP 19 2HB ASP 19 17.060 -22.832 -5.929 163 HB3 ASP 19 3HB ASP 19 16.045 -22.672 -7.360 164 H VAL 20 H VAL 20 17.842 -18.983 -7.628 165 HA VAL 20 HA VAL 20 15.948 -18.785 -9.855 166 HB VAL 20 HB VAL 20 15.251 -17.044 -8.302 167 HG11 VAL 20 1HG1 VAL 20 16.740 -15.235 -7.650 168 HG12 VAL 20 2HG1 VAL 20 17.382 -16.787 -7.109 169 HG13 VAL 20 3HG1 VAL 20 18.070 -15.992 -8.525 170 HG21 VAL 20 3HG2 VAL 20 16.747 -15.643 -10.493 171 HG22 VAL 20 1HG2 VAL 20 15.381 -16.702 -10.844 172 HG23 VAL 20 2HG2 VAL 20 15.155 -15.278 -9.828 173 H SER 21 H SER 21 16.846 -18.179 -11.796 174 HA SER 21 HA SER 21 19.780 -18.117 -11.848 175 HB2 SER 21 2HB SER 21 17.683 -19.097 -13.716 176 HB3 SER 21 3HB SER 21 19.154 -18.441 -14.436 177 HG SER 21 HG SER 21 18.761 -20.801 -13.143 178 HA PRO 22 HA PRO 22 20.031 -13.972 -13.260 179 HB2 PRO 22 2HB PRO 22 22.007 -14.105 -15.117 180 HB3 PRO 22 3HB PRO 22 22.309 -14.252 -13.381 181 HG2 PRO 22 2HG PRO 22 22.066 -16.402 -15.450 182 HG3 PRO 22 3HG PRO 22 23.233 -16.252 -14.124 183 HD2 PRO 22 2HD PRO 22 21.067 -17.871 -13.982 184 HD3 PRO 22 3HD PRO 22 21.748 -17.060 -12.557 185 H GLY 23 H GLY 23 18.563 -12.954 -14.466 186 HA2 GLY 23 2HA GLY 23 17.976 -12.142 -16.675 187 HA3 GLY 23 3HA GLY 23 18.279 -13.760 -17.290 188 H GLU 24 H GLU 24 16.714 -13.998 -14.362 189 HA GLU 24 HA GLU 24 14.206 -14.636 -15.704 190 HB2 GLU 24 2HB GLU 24 15.235 -15.176 -12.919 191 HB3 GLU 24 3HB GLU 24 13.594 -15.555 -13.422 192 HG2 GLU 24 2HG GLU 24 14.707 -16.890 -15.315 193 HG3 GLU 24 3HG GLU 24 16.167 -16.774 -14.334 194 H ASN 25 H ASN 25 12.161 -14.094 -14.441 195 HA ASN 25 HA ASN 25 12.324 -11.293 -13.545 196 HB2 ASN 25 2HB ASN 25 10.031 -12.733 -14.896 197 HB3 ASN 25 3HB ASN 25 9.991 -11.063 -14.338 198 HD21 ASN 25 1HD2 ASN 25 10.628 -9.524 -15.686 199 HD22 ASN 25 2HD2 ASN 25 11.446 -9.781 -17.186 200 H LEU 26 H LEU 26 11.833 -10.913 -11.493 201 HA LEU 26 HA LEU 26 10.095 -12.829 -10.083 202 HB2 LEU 26 2HB LEU 26 12.453 -11.323 -8.960 203 HB3 LEU 26 3HB LEU 26 11.385 -12.391 -8.050 204 HG LEU 26 HG LEU 26 12.247 -14.084 -9.974 205 HD11 LEU 26 1HD1 LEU 26 14.341 -13.676 -10.737 206 HD12 LEU 26 2HD1 LEU 26 14.800 -12.741 -9.315 207 HD13 LEU 26 3HD1 LEU 26 13.805 -12.004 -10.570 208 HD21 LEU 26 3HD2 LEU 26 14.186 -14.342 -8.034 209 HD22 LEU 26 1HD2 LEU 26 12.577 -15.064 -7.998 210 HD23 LEU 26 2HD2 LEU 26 12.870 -13.525 -7.188 211 H SER 27 H SER 27 8.709 -11.987 -8.486 212 HA SER 27 HA SER 27 8.152 -9.119 -8.816 213 HB2 SER 27 2HB SER 27 6.449 -11.209 -9.162 214 HB3 SER 27 3HB SER 27 6.139 -10.815 -7.471 215 HG SER 27 HG SER 27 4.846 -9.657 -9.080 216 H ILE 28 H ILE 28 8.928 -7.898 -7.235 217 HA ILE 28 HA ILE 28 9.570 -8.957 -4.647 218 HB ILE 28 HB ILE 28 9.594 -6.108 -5.649 219 HG12 ILE 28 2HG1 ILE 28 11.812 -8.137 -5.305 220 HG13 ILE 28 3HG1 ILE 28 11.166 -7.557 -6.836 221 HG21 ILE 28 1HG2 ILE 28 9.379 -6.181 -3.229 222 HG22 ILE 28 2HG2 ILE 28 10.746 -7.289 -3.125 223 HG23 ILE 28 3HG2 ILE 28 10.992 -5.637 -3.688 224 HD11 ILE 28 3HD1 ILE 28 13.284 -6.499 -6.313 225 HD12 ILE 28 1HD1 ILE 28 11.978 -5.315 -6.329 226 HD13 ILE 28 2HD1 ILE 28 12.623 -5.897 -4.794 227 H CYS 29 H CYS 29 8.612 -8.494 -2.678 228 HA CYS 29 HA CYS 29 5.931 -7.280 -2.825 229 HB2 CYS 29 2HB CYS 29 6.775 -9.434 -0.884 230 HB3 CYS 29 3HB CYS 29 5.148 -8.834 -1.177 231 HG CYS 29 HG CYS 29 6.744 -11.304 -2.641 232 H ALA 30 H ALA 30 8.910 -7.610 -1.022 233 HA ALA 30 HA ALA 30 8.610 -5.063 0.193 234 HB1 ALA 30 1HB ALA 30 8.820 -6.481 2.553 235 HB2 ALA 30 2HB ALA 30 7.390 -5.627 1.971 236 HB3 ALA 30 3HB ALA 30 7.578 -7.351 1.652 237 H HIS 31 H HIS 31 10.366 -4.792 1.980 238 HA HIS 31 HA HIS 31 12.749 -6.337 1.194 239 HB2 HIS 31 2HB HIS 31 14.084 -4.391 1.184 240 HB3 HIS 31 3HB HIS 31 12.616 -3.931 0.326 241 HD1 HIS 31 HD1 HIS 31 14.832 -2.655 2.757 242 HD2 HIS 31 HD2 HIS 31 10.697 -2.676 2.351 243 HE1 HIS 31 HE1 HIS 31 14.002 -0.793 4.230 244 H TYR 32 H TYR 32 14.592 -5.778 2.893 245 HA TYR 32 HA TYR 32 13.574 -5.578 5.604 246 HB2 TYR 32 2HB TYR 32 13.370 -7.993 4.985 247 HB3 TYR 32 3HB TYR 32 15.112 -8.032 4.733 248 HD1 TYR 32 HD1 TYR 32 16.602 -7.414 6.735 249 HD2 TYR 32 HD2 TYR 32 12.478 -8.393 7.106 250 HE1 TYR 32 HE1 TYR 32 16.941 -7.912 9.120 251 HE2 TYR 32 HE2 TYR 32 12.805 -8.892 9.492 252 HH TYR 32 HH TYR 32 14.331 -8.383 11.287 253 H ASP 33 H ASP 33 14.842 -3.940 6.232 254 HA ASP 33 HA ASP 33 16.695 -2.754 6.811 255 HB2 ASP 33 2HB ASP 33 17.616 -5.583 6.905 256 HB3 ASP 33 3HB ASP 33 18.851 -4.328 6.958 257 H TYR 34 H TYR 34 16.045 -3.487 3.902 258 HA TYR 34 HA TYR 34 16.842 -2.968 1.836 259 HB2 TYR 34 2HB TYR 34 19.036 -1.461 3.262 260 HB3 TYR 34 3HB TYR 34 18.422 -1.177 1.638 261 HD1 TYR 34 HD2 TYR 34 17.722 -0.789 5.227 262 HD2 TYR 34 HD1 TYR 34 16.400 0.076 1.276 263 HE1 TYR 34 HE2 TYR 34 16.126 0.852 6.126 264 HE2 TYR 34 HE1 TYR 34 14.801 1.720 2.165 265 HH TYR 34 HH TYR 34 14.890 3.169 4.735 266 H GLU 35 H GLU 35 17.965 -5.252 3.491 267 HA GLU 35 HA GLU 35 20.413 -5.684 1.907 268 HB2 GLU 35 2HB GLU 35 20.749 -7.473 3.853 269 HB3 GLU 35 3HB GLU 35 21.291 -5.808 4.008 270 HG2 GLU 35 2HG GLU 35 19.212 -5.260 5.195 271 HG3 GLU 35 3HG GLU 35 18.721 -6.949 5.080 272 H TRP 36 H TRP 36 17.299 -6.871 2.807 273 HA TRP 36 HA TRP 36 17.678 -9.148 0.986 274 HB2 TRP 36 2HB TRP 36 16.167 -9.236 3.607 275 HB3 TRP 36 3HB TRP 36 16.296 -10.555 2.447 276 HD1 TRP 36 HD1 TRP 36 18.192 -8.835 5.241 277 HE1 TRP 36 HE1 TRP 36 20.327 -10.176 5.763 278 HE3 TRP 36 HE3 TRP 36 18.090 -12.092 1.301 279 HZ2 TRP 36 HZ2 TRP 36 21.776 -12.328 4.652 280 HZ3 TRP 36 HZ3 TRP 36 19.887 -13.760 1.103 281 HH2 TRP 36 HH2 TRP 36 21.692 -13.874 2.744 282 H PHE 37 H PHE 37 16.071 -9.473 -0.456 283 HA PHE 37 HA PHE 37 13.676 -7.775 -0.200 284 HB2 PHE 37 2HB PHE 37 15.574 -8.102 -2.382 285 HB3 PHE 37 3HB PHE 37 13.918 -8.407 -2.898 286 HD1 PHE 37 HD2 PHE 37 12.194 -6.595 -1.882 287 HD2 PHE 37 HD1 PHE 37 16.336 -5.963 -2.631 288 HE1 PHE 37 HE2 PHE 37 11.794 -4.172 -2.032 289 HE2 PHE 37 HE1 PHE 37 15.943 -3.539 -2.780 290 HZ PHE 37 HZ PHE 37 13.670 -2.640 -2.482 291 H ILE 38 H ILE 38 11.738 -8.737 -0.296 292 HA ILE 38 HA ILE 38 11.662 -11.633 -0.545 293 HB ILE 38 HB ILE 38 9.288 -9.874 0.010 294 HG12 ILE 38 2HG1 ILE 38 10.991 -9.171 1.586 295 HG13 ILE 38 3HG1 ILE 38 9.801 -10.158 2.428 296 HG21 ILE 38 1HG2 ILE 38 8.631 -12.092 -0.361 297 HG22 ILE 38 2HG2 ILE 38 10.006 -12.740 0.532 298 HG23 ILE 38 3HG2 ILE 38 8.695 -11.937 1.395 299 HD11 ILE 38 3HD1 ILE 38 12.622 -10.514 2.222 300 HD12 ILE 38 1HD1 ILE 38 11.450 -11.413 3.186 301 HD13 ILE 38 2HD1 ILE 38 11.800 -11.913 1.530 302 H ALA 39 H ALA 39 11.853 -12.091 -2.710 303 HA ALA 39 HA ALA 39 9.727 -11.035 -4.459 304 HB1 ALA 39 1HB ALA 39 12.431 -12.078 -5.295 305 HB2 ALA 39 2HB ALA 39 11.204 -11.363 -6.342 306 HB3 ALA 39 3HB ALA 39 12.010 -10.373 -5.126 307 H LYS 40 H LYS 40 8.754 -12.477 -5.955 308 HA LYS 40 HA LYS 40 9.062 -15.326 -5.265 309 HB2 LYS 40 2HB LYS 40 6.582 -15.466 -5.935 310 HB3 LYS 40 3HB LYS 40 6.972 -14.772 -4.367 311 HG2 LYS 40 2HG LYS 40 6.352 -12.663 -4.988 312 HG3 LYS 40 3HG LYS 40 6.707 -12.942 -6.695 313 HD2 LYS 40 2HD LYS 40 4.345 -12.802 -6.504 314 HD3 LYS 40 3HD LYS 40 4.732 -14.509 -6.732 315 HE2 LYS 40 2HE LYS 40 3.244 -14.653 -4.998 316 HE3 LYS 40 3HE LYS 40 4.757 -14.518 -4.104 317 HZ1 LYS 40 3HZ LYS 40 2.524 -12.796 -4.063 318 HZ2 LYS 40 1HZ LYS 40 3.878 -11.933 -4.593 319 HZ3 LYS 40 2HZ LYS 40 3.920 -12.743 -3.109 320 HA PRO 41 HA PRO 41 9.670 -16.207 -9.521 321 HB2 PRO 41 2HB PRO 41 8.433 -18.611 -9.770 322 HB3 PRO 41 3HB PRO 41 9.965 -18.403 -8.913 323 HG2 PRO 41 2HG PRO 41 7.189 -18.607 -7.810 324 HG3 PRO 41 3HG PRO 41 8.683 -19.363 -7.227 325 HD2 PRO 41 2HD PRO 41 7.634 -17.142 -6.088 326 HD3 PRO 41 3HD PRO 41 9.382 -17.447 -6.152 327 H ILE 42 H ILE 42 8.736 -15.667 -11.406 328 HA ILE 42 HA ILE 42 5.811 -15.362 -11.444 329 HB ILE 42 HB ILE 42 7.882 -14.036 -13.199 330 HG12 ILE 42 2HG1 ILE 42 6.182 -12.893 -10.972 331 HG13 ILE 42 3HG1 ILE 42 7.902 -13.249 -10.854 332 HG21 ILE 42 1HG2 ILE 42 6.225 -13.493 -14.569 333 HG22 ILE 42 2HG2 ILE 42 5.104 -14.432 -13.585 334 HG23 ILE 42 3HG2 ILE 42 5.363 -12.723 -13.236 335 HD11 ILE 42 3HD1 ILE 42 6.564 -11.166 -12.553 336 HD12 ILE 42 1HD1 ILE 42 7.685 -10.923 -11.214 337 HD13 ILE 42 2HD1 ILE 42 8.258 -11.623 -12.729 338 H ASN 43 H ASN 43 8.554 -16.480 -13.395 339 HA ASN 43 HA ASN 43 7.145 -17.370 -15.626 340 HB2 ASN 43 2HB ASN 43 9.511 -17.271 -15.782 341 HB3 ASN 43 3HB ASN 43 9.723 -18.307 -14.373 342 HD21 ASN 43 1HD2 ASN 43 7.962 -18.461 -17.455 343 HD22 ASN 43 2HD2 ASN 43 8.505 -20.046 -17.878 344 H ARG 43 H ARG 43 8.555 -19.622 -13.263 345 HA ARG 43 HA ARG 43 6.556 -21.599 -13.886 346 HB2 ARG 43 2HB ARG 43 7.805 -23.080 -12.513 347 HB3 ARG 43 3HB ARG 43 8.981 -22.098 -13.377 348 HG2 ARG 43 2HG ARG 43 9.256 -20.691 -11.391 349 HG3 ARG 43 3HG ARG 43 8.094 -21.701 -10.527 350 HD2 ARG 43 2HD ARG 43 10.132 -22.570 -9.847 351 HD3 ARG 43 3HD ARG 43 9.670 -23.648 -11.164 352 HE ARG 43 HE ARG 43 11.464 -22.890 -12.368 353 HH11 ARG 43 1HH1 ARG 43 10.874 -20.724 -9.708 354 HH12 ARG 43 2HH1 ARG 43 12.325 -19.811 -9.959 355 HH21 ARG 43 1HH2 ARG 43 13.378 -21.697 -12.709 356 HH22 ARG 43 2HH2 ARG 43 13.748 -20.365 -11.667 357 H LEU 44 H LEU 44 5.838 -22.864 -11.700 358 HA LEU 44 HA LEU 44 4.574 -20.843 -9.969 359 HB2 LEU 44 2HB LEU 44 3.422 -23.207 -11.366 360 HB3 LEU 44 3HB LEU 44 2.768 -22.755 -9.793 361 HG LEU 44 HG LEU 44 1.501 -21.875 -11.762 362 HD11 LEU 44 1HD1 LEU 44 1.770 -20.816 -9.371 363 HD12 LEU 44 2HD1 LEU 44 0.900 -19.971 -10.651 364 HD13 LEU 44 3HD1 LEU 44 2.565 -19.528 -10.276 365 HD21 LEU 44 3HD2 LEU 44 2.375 -20.350 -13.233 366 HD22 LEU 44 1HD2 LEU 44 3.789 -21.363 -12.944 367 HD23 LEU 44 2HD2 LEU 44 3.627 -19.817 -12.111 368 H GLY 45 H GLY 45 5.388 -20.994 -7.989 369 HA2 GLY 45 2HA GLY 45 5.573 -23.636 -6.742 370 HA3 GLY 45 3HA GLY 45 7.035 -22.661 -6.796 371 H GLY 46 H GLY 46 6.836 -20.435 -5.845 372 HA2 GLY 46 2HA GLY 46 4.841 -19.541 -4.187 373 HA3 GLY 46 3HA GLY 46 5.757 -20.671 -3.201 374 HA PRO 47 HA PRO 47 7.689 -16.325 -3.335 375 HB2 PRO 47 2HB PRO 47 6.969 -15.503 -0.850 376 HB3 PRO 47 3HB PRO 47 5.984 -15.198 -2.286 377 HG2 PRO 47 2HG PRO 47 5.685 -17.326 -0.201 378 HG3 PRO 47 3HG PRO 47 4.437 -16.324 -0.964 379 HD2 PRO 47 2HD PRO 47 4.920 -18.879 -1.721 380 HD3 PRO 47 3HD PRO 47 4.368 -17.634 -2.860 381 H GLY 48 H GLY 48 9.727 -16.051 -2.579 382 HA2 GLY 48 2HA GLY 48 10.585 -17.751 -0.322 383 HA3 GLY 48 3HA GLY 48 11.538 -17.638 -1.795 384 H LEU 49 H LEU 49 13.362 -16.678 -1.082 385 HA LEU 49 HA LEU 49 13.146 -13.903 -0.240 386 HB2 LEU 49 2HB LEU 49 13.347 -15.696 1.727 387 HB3 LEU 49 3HB LEU 49 15.056 -15.540 1.328 388 HG LEU 49 HG LEU 49 13.505 -13.048 1.803 389 HD11 LEU 49 1HD1 LEU 49 13.079 -13.377 3.963 390 HD12 LEU 49 2HD1 LEU 49 14.652 -14.123 4.244 391 HD13 LEU 49 3HD1 LEU 49 13.311 -15.095 3.640 392 HD21 LEU 49 3HD2 LEU 49 16.302 -13.981 2.434 393 HD22 LEU 49 1HD2 LEU 49 15.658 -12.388 2.831 394 HD23 LEU 49 2HD2 LEU 49 15.816 -12.880 1.145 395 H VAL 50 H VAL 50 14.590 -12.709 -1.293 396 HA VAL 50 HA VAL 50 17.124 -13.931 -2.131 397 HB VAL 50 HB VAL 50 15.656 -14.044 -4.076 398 HG11 VAL 50 1HG1 VAL 50 15.445 -11.042 -3.909 399 HG12 VAL 50 2HG1 VAL 50 14.664 -12.109 -5.078 400 HG13 VAL 50 3HG1 VAL 50 14.182 -12.155 -3.381 401 HG21 VAL 50 3HG2 VAL 50 17.805 -11.937 -4.262 402 HG22 VAL 50 1HG2 VAL 50 17.987 -13.673 -4.516 403 HG23 VAL 50 2HG2 VAL 50 17.044 -12.710 -5.653 404 HA PRO 51 HA PRO 51 18.728 -10.179 -0.424 405 HB2 PRO 51 2HB PRO 51 21.269 -10.434 -1.347 406 HB3 PRO 51 3HB PRO 51 20.638 -11.382 0.005 407 HG2 PRO 51 2HG PRO 51 20.952 -12.157 -2.870 408 HG3 PRO 51 3HG PRO 51 21.318 -13.097 -1.411 409 HD2 PRO 51 2HD PRO 51 19.055 -13.465 -2.852 410 HD3 PRO 51 3HD PRO 51 19.116 -13.696 -1.093 411 H VAL 52 H VAL 52 19.568 -8.139 -1.099 412 HA VAL 52 HA VAL 52 18.614 -7.284 -3.638 413 HB VAL 52 HB VAL 52 20.482 -5.713 -1.874 414 HG11 VAL 52 1HG1 VAL 52 20.059 -4.041 -3.272 415 HG12 VAL 52 2HG1 VAL 52 19.159 -5.162 -4.295 416 HG13 VAL 52 3HG1 VAL 52 18.322 -4.243 -3.043 417 HG21 VAL 52 3HG2 VAL 52 18.976 -5.999 -0.235 418 HG22 VAL 52 1HG2 VAL 52 17.983 -4.880 -1.169 419 HG23 VAL 52 2HG2 VAL 52 17.749 -6.620 -1.339 420 H SER 53 H SER 53 21.615 -8.529 -2.534 421 HA SER 53 HA SER 53 23.210 -7.352 -4.630 422 HB2 SER 53 2HB SER 53 23.752 -9.425 -2.508 423 HB3 SER 53 3HB SER 53 24.934 -9.047 -3.761 424 HG SER 53 HG SER 53 25.009 -7.840 -1.665 425 H TYR 54 H TYR 54 20.864 -9.552 -4.771 426 HA TYR 54 HA TYR 54 22.140 -10.978 -7.004 427 HB2 TYR 54 2HB TYR 54 20.478 -12.142 -4.777 428 HB3 TYR 54 3HB TYR 54 20.659 -12.961 -6.324 429 HD1 TYR 54 HD1 TYR 54 22.808 -11.357 -3.715 430 HD2 TYR 54 HD2 TYR 54 22.326 -14.544 -6.493 431 HE1 TYR 54 HE1 TYR 54 24.920 -12.348 -2.935 432 HE2 TYR 54 HE2 TYR 54 24.436 -15.544 -5.720 433 HH TYR 54 HH TYR 54 26.701 -14.288 -4.427 434 H VAL 55 H VAL 55 20.258 -8.637 -6.690 435 HA VAL 55 HA VAL 55 18.408 -9.469 -8.764 436 HB VAL 55 HB VAL 55 16.446 -8.471 -7.586 437 HG11 VAL 55 1HG1 VAL 55 16.714 -10.881 -7.714 438 HG12 VAL 55 2HG1 VAL 55 17.720 -10.866 -6.264 439 HG13 VAL 55 3HG1 VAL 55 16.015 -10.425 -6.160 440 HG21 VAL 55 3HG2 VAL 55 17.430 -7.105 -5.931 441 HG22 VAL 55 1HG2 VAL 55 16.640 -8.418 -5.058 442 HG23 VAL 55 2HG2 VAL 55 18.388 -8.439 -5.289 443 H ARG 56 H ARG 56 17.277 -7.635 -9.747 444 HA ARG 56 HA ARG 56 18.637 -5.067 -9.272 445 HB2 ARG 56 2HB ARG 56 19.635 -5.869 -11.258 446 HB3 ARG 56 3HB ARG 56 18.104 -6.469 -11.882 447 HG2 ARG 56 2HG ARG 56 17.346 -4.304 -12.400 448 HG3 ARG 56 3HG ARG 56 18.617 -3.546 -11.438 449 HD2 ARG 56 2HD ARG 56 19.030 -3.416 -13.873 450 HD3 ARG 56 3HD ARG 56 20.299 -4.272 -12.999 451 HE ARG 56 HE ARG 56 18.692 -6.276 -13.792 452 HH11 ARG 56 1HH1 ARG 56 20.104 -3.585 -15.491 453 HH12 ARG 56 2HH1 ARG 56 20.204 -4.424 -17.003 454 HH21 ARG 56 1HH2 ARG 56 18.820 -7.392 -15.778 455 HH22 ARG 56 2HH2 ARG 56 19.473 -6.589 -17.165 456 H ILE 57 H ILE 57 17.250 -3.523 -8.749 457 HA ILE 57 HA ILE 57 14.430 -3.878 -8.962 458 HB ILE 57 HB ILE 57 15.992 -1.387 -8.268 459 HG12 ILE 57 2HG1 ILE 57 16.425 -3.306 -6.762 460 HG13 ILE 57 3HG1 ILE 57 15.581 -1.993 -5.948 461 HG21 ILE 57 1HG2 ILE 57 13.938 -0.499 -8.668 462 HG22 ILE 57 2HG2 ILE 57 13.098 -2.018 -8.362 463 HG23 ILE 57 3HG2 ILE 57 13.676 -1.043 -7.011 464 HD11 ILE 57 3HD1 ILE 57 13.496 -3.190 -6.103 465 HD12 ILE 57 1HD1 ILE 57 14.270 -4.474 -7.031 466 HD13 ILE 57 2HD1 ILE 57 14.719 -4.210 -5.346 467 H ILE 58 H ILE 58 13.162 -3.453 -10.635 468 HA ILE 58 HA ILE 58 13.861 -1.284 -12.469 469 HB ILE 58 HB ILE 58 13.177 -2.771 -14.407 470 HG12 ILE 58 2HG1 ILE 58 13.864 -4.996 -12.481 471 HG13 ILE 58 3HG1 ILE 58 12.213 -4.554 -12.900 472 HG21 ILE 58 1HG2 ILE 58 15.354 -2.870 -14.847 473 HG22 ILE 58 2HG2 ILE 58 15.640 -2.326 -13.195 474 HG23 ILE 58 3HG2 ILE 58 15.623 -4.050 -13.565 475 HD11 ILE 58 3HD1 ILE 58 12.938 -4.943 -15.325 476 HD12 ILE 58 1HD1 ILE 58 14.326 -5.777 -14.626 477 HD13 ILE 58 2HD1 ILE 58 12.692 -6.349 -14.289 478 H ASP 59 H ASP 59 12.001 -0.972 -14.099 479 HA ASP 59 HA ASP 59 9.440 -1.349 -12.688 480 HB2 ASP 59 2HB ASP 59 10.151 0.997 -12.642 481 HB3 ASP 59 3HB ASP 59 10.301 0.995 -14.397 482 H LEU 60 H LEU 60 7.859 -2.335 -13.776 483 HA LEU 60 HA LEU 60 8.259 -3.665 -16.168 484 HB2 LEU 60 2HB LEU 60 5.834 -2.875 -14.623 485 HB3 LEU 60 3HB LEU 60 5.636 -3.573 -16.230 486 HG LEU 60 HG LEU 60 7.011 -4.895 -13.891 487 HD11 LEU 60 1HD1 LEU 60 4.655 -4.811 -13.496 488 HD12 LEU 60 2HD1 LEU 60 5.065 -6.444 -14.019 489 HD13 LEU 60 3HD1 LEU 60 4.307 -5.321 -15.148 490 HD21 LEU 60 3HD2 LEU 60 6.520 -5.759 -16.728 491 HD22 LEU 60 1HD2 LEU 60 6.832 -6.907 -15.426 492 HD23 LEU 60 2HD2 LEU 60 8.048 -5.700 -15.847 493 H MET 61 H MET 61 7.252 -0.388 -15.602 494 HA MET 61 HA MET 61 6.412 0.008 -18.354 495 HB2 MET 61 2HB MET 61 6.755 2.141 -16.253 496 HB3 MET 61 3HB MET 61 5.747 2.191 -17.693 497 HG2 MET 61 2HG MET 61 5.304 0.379 -15.332 498 HG3 MET 61 3HG MET 61 4.455 1.895 -15.627 499 HE1 MET 61 3HE MET 61 3.087 -1.998 -16.377 500 HE2 MET 61 1HE MET 61 4.525 -2.050 -17.397 501 HE3 MET 61 2HE MET 61 4.654 -1.525 -15.719 502 H ASP 62 H ASP 62 9.164 0.648 -16.298 503 HA ASP 62 HA ASP 62 10.666 1.514 -18.659 504 HB2 ASP 62 2HB ASP 62 11.112 2.921 -16.046 505 HB3 ASP 62 3HB ASP 62 11.533 3.444 -17.675 506 HA PRO 63 HA PRO 63 12.842 -1.745 -16.170 507 HB2 PRO 63 2HB PRO 63 13.486 -3.282 -18.313 508 HB3 PRO 63 3HB PRO 63 11.947 -3.426 -17.455 509 HG2 PRO 63 2HG PRO 63 12.566 -1.985 -20.005 510 HG3 PRO 63 3HG PRO 63 11.173 -3.008 -19.608 511 HD2 PRO 63 2HD PRO 63 11.054 -0.303 -19.564 512 HD3 PRO 63 3HD PRO 63 10.099 -1.319 -18.465 513 H ALA 64 H ALA 64 13.596 0.499 -18.593 514 HA ALA 64 HA ALA 64 16.462 -0.134 -18.493 515 HB1 ALA 64 1HB ALA 64 16.738 1.137 -20.467 516 HB2 ALA 64 2HB ALA 64 15.291 0.158 -20.712 517 HB3 ALA 64 3HB ALA 64 15.140 1.868 -20.307 518 H LYS 65 H LYS 65 14.153 1.932 -17.157 519 HA LYS 65 HA LYS 65 15.794 4.254 -16.823 520 HB2 LYS 65 2HB LYS 65 13.214 4.084 -16.776 521 HB3 LYS 65 3HB LYS 65 13.422 3.574 -15.105 522 HG2 LYS 65 2HG LYS 65 14.770 5.713 -14.794 523 HG3 LYS 65 3HG LYS 65 14.109 6.214 -16.352 524 HD2 LYS 65 2HD LYS 65 12.468 5.393 -13.955 525 HD3 LYS 65 3HD LYS 65 12.799 7.060 -14.433 526 HE2 LYS 65 2HE LYS 65 11.842 6.065 -16.753 527 HE3 LYS 65 3HE LYS 65 10.951 5.078 -15.595 528 HZ1 LYS 65 3HZ LYS 65 10.186 7.109 -14.519 529 HZ2 LYS 65 1HZ LYS 65 9.731 7.078 -16.148 530 HZ3 LYS 65 2HZ LYS 65 11.024 8.047 -15.650 531 H TYR 66 H TYR 66 14.697 1.680 -14.618 532 HA TYR 66 HA TYR 66 16.699 2.532 -12.663 533 HB2 TYR 66 2HB TYR 66 14.345 0.654 -12.506 534 HB3 TYR 66 3HB TYR 66 15.539 0.776 -11.220 535 HD1 TYR 66 HD1 TYR 66 13.020 2.713 -13.132 536 HD2 TYR 66 HD2 TYR 66 15.433 2.516 -9.633 537 HE1 TYR 66 HE1 TYR 66 11.795 4.625 -12.186 538 HE2 TYR 66 HE2 TYR 66 14.213 4.427 -8.677 539 HH TYR 66 HH TYR 66 11.814 6.196 -10.549 540 H ALA 67 H ALA 67 17.258 1.071 -15.232 541 HA ALA 67 HA ALA 67 18.184 -1.532 -14.354 542 HB1 ALA 67 1HB ALA 67 17.324 -0.614 -16.758 543 HB2 ALA 67 2HB ALA 67 19.074 -0.556 -16.975 544 HB3 ALA 67 3HB ALA 67 18.290 -2.072 -16.531 545 H SER 68 H SER 68 19.398 1.657 -14.554 546 HA SER 68 HA SER 68 22.185 0.786 -14.584 547 HB2 SER 68 2HB SER 68 21.550 2.730 -15.963 548 HB3 SER 68 3HB SER 68 21.019 3.581 -14.513 549 HG SER 68 HG SER 68 23.026 4.270 -14.600 550 H VAL 69 H VAL 69 19.732 1.825 -12.398 551 HA VAL 69 HA VAL 69 21.140 2.929 -10.302 552 HB VAL 69 HB VAL 69 18.648 2.644 -10.428 553 HG11 VAL 69 1HG1 VAL 69 19.110 0.033 -10.784 554 HG12 VAL 69 2HG1 VAL 69 18.847 0.041 -9.039 555 HG13 VAL 69 3HG1 VAL 69 17.600 0.659 -10.123 556 HG21 VAL 69 3HG2 VAL 69 18.467 3.023 -8.204 557 HG22 VAL 69 1HG2 VAL 69 19.387 1.581 -7.774 558 HG23 VAL 69 2HG2 VAL 69 20.228 3.042 -8.292 559 H ASP 70 H ASP 70 21.944 2.046 -8.320 560 HA ASP 70 HA ASP 70 23.114 -0.630 -8.677 561 HB2 ASP 70 2HB ASP 70 24.439 1.683 -8.229 562 HB3 ASP 70 3HB ASP 70 24.178 1.157 -6.569 563 H THR 71 H THR 71 21.991 -2.135 -7.635 564 HA THR 71 HA THR 71 20.307 -1.581 -5.405 565 HB THR 71 HB THR 71 20.705 -4.328 -5.393 566 HG1 THR 71 HG1 THR 71 21.635 -4.719 -7.259 567 HG21 THR 71 3HG2 THR 71 18.508 -4.434 -6.110 568 HG22 THR 71 1HG2 THR 71 18.695 -3.081 -7.225 569 HG23 THR 71 2HG2 THR 71 18.597 -2.786 -5.489 570 H TYR 72 H TYR 72 23.518 -2.995 -5.782 571 HA TYR 72 HA TYR 72 23.911 -3.981 -3.219 572 HB2 TYR 72 2HB TYR 72 25.516 -4.471 -4.925 573 HB3 TYR 72 3HB TYR 72 25.863 -2.764 -5.176 574 HD1 TYR 72 HD2 TYR 72 25.705 -4.901 -2.111 575 HD2 TYR 72 HD1 TYR 72 28.036 -2.311 -4.552 576 HE1 TYR 72 HE2 TYR 72 27.549 -5.042 -0.489 577 HE2 TYR 72 HE1 TYR 72 29.887 -2.446 -2.938 578 HH TYR 72 HH TYR 72 30.699 -3.869 -1.182 579 H ASP 73 H ASP 73 24.381 -0.704 -4.464 580 HA ASP 73 HA ASP 73 25.513 0.394 -2.128 581 HB2 ASP 73 2HB ASP 73 25.529 1.445 -4.411 582 HB3 ASP 73 3HB ASP 73 23.833 1.855 -4.173 583 H ARG 74 H ARG 74 24.530 0.198 -0.212 584 HA ARG 74 HA ARG 74 21.835 -0.098 0.302 585 HB2 ARG 74 2HB ARG 74 22.320 0.343 2.579 586 HB3 ARG 74 3HB ARG 74 23.769 -0.397 1.912 587 HG2 ARG 74 2HG ARG 74 23.421 2.576 2.181 588 HG3 ARG 74 3HG ARG 74 24.141 1.564 3.435 589 HD2 ARG 74 2HD ARG 74 25.139 2.015 0.630 590 HD3 ARG 74 3HD ARG 74 25.918 2.487 2.139 591 HE ARG 74 HE ARG 74 25.676 -0.232 2.300 592 HH11 ARG 74 1HH1 ARG 74 27.124 1.998 0.052 593 HH12 ARG 74 2HH1 ARG 74 28.369 0.898 -0.439 594 HH21 ARG 74 1HH2 ARG 74 27.311 -1.689 1.662 595 HH22 ARG 74 2HH2 ARG 74 28.474 -1.199 0.477 596 H GLU 75 H GLU 75 23.642 2.806 -0.351 597 HA GLU 75 HA GLU 75 21.761 4.674 0.639 598 HB2 GLU 75 2HB GLU 75 24.143 4.759 -1.122 599 HB3 GLU 75 3HB GLU 75 22.999 6.083 -1.293 600 HG2 GLU 75 2HG GLU 75 23.168 6.441 1.172 601 HG3 GLU 75 3HG GLU 75 24.468 5.251 1.193 602 H GLN 76 H GLN 76 22.438 3.620 -2.702 603 HA GLN 76 HA GLN 76 20.318 4.984 -3.908 604 HB2 GLN 76 2HB GLN 76 21.623 2.396 -4.768 605 HB3 GLN 76 3HB GLN 76 20.614 3.415 -5.786 606 HG2 GLN 76 2HG GLN 76 22.461 5.205 -4.962 607 HG3 GLN 76 3HG GLN 76 23.419 3.726 -4.985 608 HE21 GLN 76 1HE2 GLN 76 24.566 3.714 -6.780 609 HE22 GLN 76 2HE2 GLN 76 23.978 4.071 -8.364 610 H VAL 77 H VAL 77 20.493 1.550 -2.959 611 HA VAL 77 HA VAL 77 17.900 0.824 -3.612 612 HB VAL 77 HB VAL 77 19.804 -0.679 -2.818 613 HG11 VAL 77 1HG1 VAL 77 18.646 0.011 -0.119 614 HG12 VAL 77 2HG1 VAL 77 19.889 -1.198 -0.449 615 HG13 VAL 77 3HG1 VAL 77 20.230 0.513 -0.709 616 HG21 VAL 77 3HG2 VAL 77 18.102 -2.089 -3.127 617 HG22 VAL 77 1HG2 VAL 77 17.830 -1.985 -1.388 618 HG23 VAL 77 2HG2 VAL 77 16.931 -0.937 -2.485 619 H MET 78 H MET 78 19.106 2.534 -0.804 620 HA MET 78 HA MET 78 16.785 2.284 0.799 621 HB2 MET 78 2HB MET 78 19.261 3.892 0.837 622 HB3 MET 78 3HB MET 78 17.884 4.612 1.661 623 HG2 MET 78 2HG MET 78 17.644 2.535 2.981 624 HG3 MET 78 3HG MET 78 19.105 1.919 2.212 625 HE1 MET 78 3HE MET 78 21.610 3.321 2.559 626 HE2 MET 78 1HE MET 78 21.857 3.123 4.294 627 HE3 MET 78 2HE MET 78 21.087 1.840 3.361 628 H LYS 79 H LYS 79 17.969 5.014 -1.170 629 HA LYS 79 HA LYS 79 15.785 6.695 -0.841 630 HB2 LYS 79 2HB LYS 79 17.675 6.370 -3.172 631 HB3 LYS 79 3HB LYS 79 16.483 7.660 -3.074 632 HG2 LYS 79 2HG LYS 79 17.586 8.736 -1.367 633 HG3 LYS 79 3HG LYS 79 18.408 7.269 -0.830 634 HD2 LYS 79 2HD LYS 79 19.577 7.384 -3.146 635 HD3 LYS 79 3HD LYS 79 19.055 9.070 -3.133 636 HE2 LYS 79 2HE LYS 79 20.495 7.910 -0.780 637 HE3 LYS 79 3HE LYS 79 21.395 8.446 -2.198 638 HZ1 LYS 79 3HZ LYS 79 21.179 10.544 -1.563 639 HZ2 LYS 79 1HZ LYS 79 20.500 10.007 -0.110 640 HZ3 LYS 79 2HZ LYS 79 19.499 10.404 -1.414 641 H ILE 80 H ILE 80 16.270 4.047 -3.116 642 HA ILE 80 HA ILE 80 13.984 4.522 -4.703 643 HB ILE 80 HB ILE 80 15.413 1.914 -4.173 644 HG12 ILE 80 2HG1 ILE 80 15.696 3.588 -6.647 645 HG13 ILE 80 3HG1 ILE 80 16.639 3.977 -5.212 646 HG21 ILE 80 1HG2 ILE 80 14.374 1.630 -6.630 647 HG22 ILE 80 2HG2 ILE 80 13.552 1.102 -5.162 648 HG23 ILE 80 3HG2 ILE 80 13.135 2.650 -5.898 649 HD11 ILE 80 3HD1 ILE 80 18.140 2.540 -5.981 650 HD12 ILE 80 1HD1 ILE 80 17.014 1.264 -5.519 651 HD13 ILE 80 2HD1 ILE 80 17.016 1.883 -7.171 652 H ILE 81 H ILE 81 14.516 2.171 -2.073 653 HA ILE 81 HA ILE 81 11.880 1.223 -1.966 654 HB ILE 81 HB ILE 81 13.966 1.335 0.214 655 HG12 ILE 81 2HG1 ILE 81 13.098 -0.989 -1.514 656 HG13 ILE 81 3HG1 ILE 81 14.493 0.023 -1.870 657 HG21 ILE 81 1HG2 ILE 81 12.353 0.723 1.617 658 HG22 ILE 81 2HG2 ILE 81 11.184 0.578 0.305 659 HG23 ILE 81 3HG2 ILE 81 12.228 -0.784 0.709 660 HD11 ILE 81 3HD1 ILE 81 14.436 -2.275 -0.319 661 HD12 ILE 81 1HD1 ILE 81 15.762 -1.122 -0.466 662 HD13 ILE 81 2HD1 ILE 81 14.586 -0.952 0.838 663 H ASP 82 H ASP 82 13.439 3.961 -0.406 664 HA ASP 82 HA ASP 82 11.284 4.564 1.356 665 HB2 ASP 82 2HB ASP 82 13.604 5.331 1.750 666 HB3 ASP 82 3HB ASP 82 13.481 6.380 0.340 667 H GLU 83 H GLU 83 12.323 5.895 -1.772 668 HA GLU 83 HA GLU 83 10.289 7.826 -1.989 669 HB2 GLU 83 2HB GLU 83 12.059 6.448 -3.986 670 HB3 GLU 83 3HB GLU 83 10.800 7.554 -4.517 671 HG2 GLU 83 2HG GLU 83 12.140 8.924 -2.505 672 HG3 GLU 83 3HG GLU 83 13.407 8.116 -3.427 673 H PHE 84 H PHE 84 10.530 4.570 -3.415 674 HA PHE 84 HA PHE 84 7.935 4.613 -4.551 675 HB2 PHE 84 2HB PHE 84 9.938 2.449 -3.981 676 HB3 PHE 84 3HB PHE 84 8.322 2.039 -4.548 677 HD1 PHE 84 HD1 PHE 84 11.165 4.295 -5.401 678 HD2 PHE 84 HD2 PHE 84 7.969 1.865 -6.811 679 HE1 PHE 84 HE1 PHE 84 11.883 4.702 -7.719 680 HE2 PHE 84 HE2 PHE 84 8.682 2.267 -9.131 681 HZ PHE 84 HZ PHE 84 10.642 3.686 -9.588 682 H LYS 85 H LYS 85 9.026 4.205 -1.366 683 HA LYS 85 HA LYS 85 7.985 3.714 0.596 684 HB2 LYS 85 2HB LYS 85 5.442 3.993 -1.016 685 HB3 LYS 85 3HB LYS 85 5.576 4.059 0.736 686 HG2 LYS 85 2HG LYS 85 7.108 5.990 -0.948 687 HG3 LYS 85 3HG LYS 85 5.392 6.254 -0.630 688 HD2 LYS 85 2HD LYS 85 6.018 5.897 1.844 689 HD3 LYS 85 3HD LYS 85 7.679 6.166 1.311 690 HE2 LYS 85 2HE LYS 85 5.609 8.115 0.450 691 HE3 LYS 85 3HE LYS 85 6.117 8.148 2.138 692 HZ1 LYS 85 3HZ LYS 85 8.478 8.122 1.065 693 HZ2 LYS 85 1HZ LYS 85 7.614 9.571 1.196 694 HZ3 LYS 85 2HZ LYS 85 7.666 8.747 -0.280 695 H ILE 86 H ILE 86 9.003 1.534 -0.195 696 HA ILE 86 HA ILE 86 6.989 -0.523 -0.652 697 HB ILE 86 HB ILE 86 9.981 -0.843 -0.404 698 HG12 ILE 86 2HG1 ILE 86 8.293 -0.661 -2.908 699 HG13 ILE 86 3HG1 ILE 86 9.302 0.641 -2.286 700 HG21 ILE 86 1HG2 ILE 86 7.962 -2.699 -1.647 701 HG22 ILE 86 2HG2 ILE 86 9.674 -3.008 -1.358 702 HG23 ILE 86 3HG2 ILE 86 8.563 -2.861 0.003 703 HD11 ILE 86 3HD1 ILE 86 10.245 -2.047 -3.253 704 HD12 ILE 86 1HD1 ILE 86 10.425 -0.502 -4.084 705 HD13 ILE 86 2HD1 ILE 86 11.277 -0.793 -2.566 706 HA PRO 87 HA PRO 87 6.698 -1.492 3.656 707 HB2 PRO 87 2HB PRO 87 5.397 -3.860 3.387 708 HB3 PRO 87 3HB PRO 87 4.602 -2.297 3.165 709 HG2 PRO 87 2HG PRO 87 5.668 -4.188 1.104 710 HG3 PRO 87 3HG PRO 87 4.146 -3.279 1.107 711 HD2 PRO 87 2HD PRO 87 6.317 -2.482 -0.303 712 HD3 PRO 87 3HD PRO 87 5.162 -1.333 0.403 713 H THR 88 H THR 88 7.221 -3.339 5.123 714 HA THR 88 HA THR 88 9.638 -4.711 4.162 715 HB THR 88 HB THR 88 9.780 -5.055 6.830 716 HG1 THR 88 HG1 THR 88 7.963 -3.861 7.357 717 HG21 THR 88 3HG2 THR 88 11.626 -4.152 5.711 718 HG22 THR 88 1HG2 THR 88 11.136 -2.865 6.812 719 HG23 THR 88 2HG2 THR 88 10.704 -2.777 5.104 720 H VAL 89 H VAL 89 10.051 -6.777 5.619 721 HA VAL 89 HA VAL 89 8.188 -8.712 4.834 722 HB VAL 89 HB VAL 89 10.159 -9.006 7.100 723 HG11 VAL 89 1HG1 VAL 89 8.972 -11.019 5.192 724 HG12 VAL 89 2HG1 VAL 89 10.165 -11.362 6.448 725 HG13 VAL 89 3HG1 VAL 89 8.544 -10.824 6.892 726 HG21 VAL 89 3HG2 VAL 89 11.394 -8.136 5.255 727 HG22 VAL 89 1HG2 VAL 89 11.698 -9.872 5.319 728 HG23 VAL 89 2HG2 VAL 89 10.579 -9.216 4.124 729 H GLU 90 H GLU 90 8.827 -7.394 8.086 730 HA GLU 90 HA GLU 90 6.885 -8.794 9.479 731 HB2 GLU 90 2HB GLU 90 7.882 -5.978 9.937 732 HB3 GLU 90 3HB GLU 90 6.932 -6.898 11.095 733 HG2 GLU 90 2HG GLU 90 8.659 -8.374 11.539 734 HG3 GLU 90 3HG GLU 90 9.502 -7.994 10.038 735 H GLN 91 H GLN 91 6.590 -5.567 7.998 736 HA GLN 91 HA GLN 91 3.885 -5.176 8.610 737 HB2 GLN 91 2HB GLN 91 5.587 -4.074 6.373 738 HB3 GLN 91 3HB GLN 91 3.945 -3.532 6.698 739 HG2 GLN 91 2HG GLN 91 4.534 -2.421 8.596 740 HG3 GLN 91 3HG GLN 91 5.892 -3.493 8.936 741 HE21 GLN 91 1HE2 GLN 91 7.278 -1.759 9.283 742 HE22 GLN 91 2HE2 GLN 91 7.881 -0.790 7.986 743 H TRP 92 H TRP 92 5.450 -6.722 5.856 744 HA TRP 92 HA TRP 92 3.119 -7.045 4.287 745 HB2 TRP 92 2HB TRP 92 5.348 -7.223 3.311 746 HB3 TRP 92 3HB TRP 92 5.692 -8.637 4.304 747 HD1 TRP 92 HD1 TRP 92 2.831 -7.742 1.817 748 HE1 TRP 92 HE1 TRP 92 2.463 -9.777 0.285 749 HE3 TRP 92 HE3 TRP 92 6.388 -10.865 3.749 750 HZ2 TRP 92 HZ2 TRP 92 3.538 -12.364 -0.059 751 HZ3 TRP 92 HZ3 TRP 92 6.653 -13.103 2.762 752 HH2 TRP 92 HH2 TRP 92 5.257 -13.836 0.898 753 H LYS 93 H LYS 93 4.649 -9.029 6.763 754 HA LYS 93 HA LYS 93 3.043 -11.330 6.391 755 HB2 LYS 93 2HB LYS 93 4.544 -10.354 8.827 756 HB3 LYS 93 3HB LYS 93 3.817 -11.949 8.678 757 HG2 LYS 93 2HG LYS 93 5.738 -11.077 6.586 758 HG3 LYS 93 3HG LYS 93 6.366 -11.538 8.170 759 HD2 LYS 93 2HD LYS 93 6.293 -13.648 7.446 760 HD3 LYS 93 3HD LYS 93 4.536 -13.530 7.571 761 HE2 LYS 93 2HE LYS 93 4.981 -12.364 5.157 762 HE3 LYS 93 3HE LYS 93 6.270 -13.566 5.200 763 HZ1 LYS 93 3HZ LYS 93 4.816 -15.179 4.824 764 HZ2 LYS 93 1HZ LYS 93 3.638 -13.997 4.540 765 HZ3 LYS 93 2HZ LYS 93 3.805 -14.671 6.082 766 H ASP 94 H ASP 94 2.828 -8.634 8.702 767 HA ASP 94 HA ASP 94 0.504 -9.512 10.012 768 HB2 ASP 94 2HB ASP 94 1.799 -7.819 11.067 769 HB3 ASP 94 3HB ASP 94 1.713 -6.772 9.653 770 H GLN 95 H GLN 95 0.946 -7.382 7.216 771 HA GLN 95 HA GLN 95 -1.738 -6.644 6.883 772 HB2 GLN 95 2HB GLN 95 0.610 -6.799 5.019 773 HB3 GLN 95 3HB GLN 95 -0.984 -6.371 4.413 774 HG2 GLN 95 2HG GLN 95 0.156 -4.907 6.748 775 HG3 GLN 95 3HG GLN 95 0.690 -4.516 5.114 776 HE21 GLN 95 1HE2 GLN 95 -1.312 -4.406 3.552 777 HE22 GLN 95 2HE2 GLN 95 -2.588 -3.385 4.112 778 H THR 96 H THR 96 0.119 -9.221 5.267 779 HA THR 96 HA THR 96 -1.998 -10.272 3.769 780 HB THR 96 HB THR 96 -0.612 -12.434 3.843 781 HG1 THR 96 HG1 THR 96 0.568 -12.113 5.713 782 HG21 THR 96 3HG2 THR 96 0.926 -11.607 2.241 783 HG22 THR 96 1HG2 THR 96 0.899 -9.989 2.942 784 HG23 THR 96 2HG2 THR 96 -0.517 -10.605 2.090 785 H ARG 97 H ARG 97 -0.964 -10.891 7.073 786 HA ARG 97 HA ARG 97 -2.563 -13.173 7.533 787 HB2 ARG 97 2HB ARG 97 -1.215 -11.158 9.293 788 HB3 ARG 97 3HB ARG 97 -2.334 -12.317 9.998 789 HG2 ARG 97 2HG ARG 97 0.071 -13.060 8.347 790 HG3 ARG 97 3HG ARG 97 0.036 -13.017 10.111 791 HD2 ARG 97 2HD ARG 97 -2.129 -14.551 9.614 792 HD3 ARG 97 3HD ARG 97 -1.118 -14.974 8.233 793 HE ARG 97 HE ARG 97 0.202 -16.172 9.650 794 HH11 ARG 97 1HH1 ARG 97 -1.568 -13.821 11.512 795 HH12 ARG 97 2HH1 ARG 97 -0.984 -14.398 13.038 796 HH21 ARG 97 1HH2 ARG 97 0.977 -16.940 11.653 797 HH22 ARG 97 2HH2 ARG 97 0.464 -16.171 13.117 798 H ARG 98 H ARG 98 -3.085 -9.766 8.452 799 HA ARG 98 HA ARG 98 -5.731 -10.199 9.384 800 HB2 ARG 98 2HB ARG 98 -5.895 -7.782 9.506 801 HB3 ARG 98 3HB ARG 98 -4.328 -8.301 10.112 802 HG2 ARG 98 2HG ARG 98 -3.210 -7.201 8.517 803 HG3 ARG 98 3HG ARG 98 -4.355 -7.665 7.257 804 HD2 ARG 98 2HD ARG 98 -4.612 -5.357 7.396 805 HD3 ARG 98 3HD ARG 98 -5.941 -5.975 8.375 806 HE ARG 98 HE ARG 98 -3.615 -5.460 9.940 807 HH11 ARG 98 1HH1 ARG 98 -6.352 -3.948 8.409 808 HH12 ARG 98 2HH1 ARG 98 -6.386 -2.604 9.503 809 HH21 ARG 98 1HH2 ARG 98 -3.649 -3.696 11.385 810 HH22 ARG 98 2HH2 ARG 98 -4.847 -2.461 11.194 811 H TYR 99 H TYR 99 -4.382 -9.808 6.265 812 HA TYR 99 HA TYR 99 -6.852 -8.893 5.046 813 HB2 TYR 99 2HB TYR 99 -4.822 -8.024 4.100 814 HB3 TYR 99 3HB TYR 99 -4.162 -9.643 3.893 815 HD1 TYR 99 HD1 TYR 99 -6.799 -7.328 2.699 816 HD2 TYR 99 HD2 TYR 99 -4.602 -10.890 1.937 817 HE1 TYR 99 HE1 TYR 99 -7.727 -7.406 0.423 818 HE2 TYR 99 HE2 TYR 99 -5.522 -10.978 -0.342 819 HH TYR 99 HH TYR 99 -7.848 -9.948 -1.427 820 H LYS 100 H LYS 100 -5.149 -11.859 5.614 821 HA LYS 100 HA LYS 100 -6.754 -13.360 3.716 822 HB2 LYS 100 2HB LYS 100 -4.467 -13.998 5.537 823 HB3 LYS 100 3HB LYS 100 -5.473 -15.308 4.935 824 HG2 LYS 100 2HG LYS 100 -4.984 -14.019 2.632 825 HG3 LYS 100 3HG LYS 100 -3.516 -13.616 3.526 826 HD2 LYS 100 2HD LYS 100 -2.869 -15.592 2.568 827 HD3 LYS 100 3HD LYS 100 -3.556 -16.196 4.078 828 HE2 LYS 100 2HE LYS 100 -5.331 -15.892 1.703 829 HE3 LYS 100 3HE LYS 100 -4.215 -17.255 1.761 830 HZ1 LYS 100 3HZ LYS 100 -5.186 -17.707 4.035 831 HZ2 LYS 100 1HZ LYS 100 -6.195 -18.020 2.714 832 HZ3 LYS 100 2HZ LYS 100 -6.416 -16.617 3.632 833 H GLU 101 H GLU 101 -6.734 -12.578 7.087 834 HA GLU 101 HA GLU 101 -8.142 -14.661 8.222 835 HB2 GLU 101 2HB GLU 101 -8.723 -13.189 9.974 836 HB3 GLU 101 3HB GLU 101 -7.186 -12.596 9.360 837 HG2 GLU 101 2HG GLU 101 -8.669 -11.047 7.897 838 HG3 GLU 101 3HG GLU 101 -9.911 -11.416 9.092 839 H SER 102 H SER 102 -10.471 -14.541 8.995 840 HA SER 102 HA SER 102 -12.205 -14.776 6.846 841 HB2 SER 102 2HB SER 102 -12.663 -15.774 9.037 842 HB3 SER 102 3HB SER 102 -12.894 -14.170 9.732 843 HG SER 102 HG SER 102 -14.572 -15.668 8.112 844 H SER 103 H SER 103 -12.947 -13.290 5.500 845 HA SER 103 HA SER 103 -13.860 -10.721 6.552 846 HB2 SER 103 2HB SER 103 -12.694 -9.456 4.815 847 HB3 SER 103 3HB SER 103 -11.533 -10.354 5.794 848 HG SER 103 HG SER 103 -11.368 -10.425 3.373 849 H ILE 104 H ILE 104 -14.569 -9.452 4.279 850 HA ILE 104 HA ILE 104 -16.989 -10.590 3.571 851 HB ILE 104 HB ILE 104 -15.377 -8.705 1.849 852 HG12 ILE 104 2HG1 ILE 104 -15.546 -7.783 4.079 853 HG13 ILE 104 3HG1 ILE 104 -16.660 -6.919 3.024 854 HG21 ILE 104 1HG2 ILE 104 -17.584 -7.971 1.043 855 HG22 ILE 104 2HG2 ILE 104 -17.269 -9.668 0.683 856 HG23 ILE 104 3HG2 ILE 104 -18.341 -9.234 2.013 857 HD11 ILE 104 3HD1 ILE 104 -18.214 -8.941 4.036 858 HD12 ILE 104 1HD1 ILE 104 -17.184 -8.503 5.399 859 HD13 ILE 104 2HD1 ILE 104 -18.173 -7.274 4.610 860 H GLN 105 H GLN 105 -17.719 -11.859 1.915 861 HA GLN 105 HA GLN 105 -16.241 -12.571 -0.370 862 HB2 GLN 105 2HB GLN 105 -15.691 -14.899 0.165 863 HB3 GLN 105 3HB GLN 105 -14.829 -13.782 1.213 864 HG2 GLN 105 2HG GLN 105 -15.507 -15.264 2.777 865 HG3 GLN 105 3HG GLN 105 -16.927 -14.219 2.771 866 HE21 GLN 105 1HE2 GLN 105 -18.803 -15.202 2.602 867 HE22 GLN 105 2HE2 GLN 105 -19.079 -16.767 1.924 868 H ILE 106 H ILE 106 -17.333 -14.163 -1.694 869 HA ILE 106 HA ILE 106 -19.969 -15.023 -0.798 870 HB ILE 106 HB ILE 106 -20.926 -14.159 -3.022 871 HG12 ILE 106 2HG1 ILE 106 -18.456 -13.455 -3.659 872 HG13 ILE 106 3HG1 ILE 106 -19.837 -12.507 -4.200 873 HG21 ILE 106 1HG2 ILE 106 -21.364 -11.901 -2.004 874 HG22 ILE 106 2HG2 ILE 106 -21.720 -13.281 -0.966 875 HG23 ILE 106 3HG2 ILE 106 -20.244 -12.349 -0.717 876 HD11 ILE 106 3HD1 ILE 106 -17.749 -11.356 -3.140 877 HD12 ILE 106 1HD1 ILE 106 -19.374 -10.776 -2.781 878 HD13 ILE 106 2HD1 ILE 106 -18.529 -11.804 -1.624 879 H GLY 107 H GLY 107 -19.578 -17.159 -1.075 880 HA2 GLY 107 2HA GLY 107 -19.894 -18.429 -3.470 881 HA3 GLY 107 3HA GLY 107 -18.158 -18.179 -3.357 882 H ASN 108 H ASN 108 -17.583 -20.311 -3.157 883 HA ASN 108 HA ASN 108 -18.590 -21.712 -0.769 884 HB2 ASN 108 2HB ASN 108 -17.893 -23.808 -1.934 885 HB3 ASN 108 3HB ASN 108 -19.166 -22.928 -2.774 886 HD21 ASN 108 1HD2 ASN 108 -16.141 -24.351 -3.033 887 HD22 ASN 108 2HD2 ASN 108 -15.708 -23.749 -4.594 888 H GLY 109 H GLY 109 -17.168 -22.486 0.720 889 HA2 GLY 109 2HA GLY 109 -14.466 -23.036 0.353 890 HA3 GLY 109 3HA GLY 109 -14.575 -21.347 0.827 891 H HIS 110 H HIS 110 -13.403 -21.879 2.740 892 HA HIS 110 HA HIS 110 -15.158 -22.870 4.857 893 HB2 HIS 110 2HB HIS 110 -12.309 -23.831 4.525 894 HB3 HIS 110 3HB HIS 110 -13.426 -24.291 5.806 895 HD1 HIS 110 HD1 HIS 110 -12.325 -25.229 2.457 896 HD2 HIS 110 HD2 HIS 110 -15.666 -25.887 4.839 897 HE1 HIS 110 HE1 HIS 110 -13.524 -27.177 1.411 898 H GLY 111 H GLY 111 -13.829 -22.610 7.057 899 HA2 GLY 111 2HA GLY 111 -12.890 -19.821 7.022 900 HA3 GLY 111 3HA GLY 111 -13.578 -20.647 8.413 901 H GLN 112 H GLN 112 -11.619 -19.677 9.431 902 HA GLN 112 HA GLN 112 -9.369 -21.555 9.194 903 HB2 GLN 112 2HB GLN 112 -9.068 -18.597 9.722 904 HB3 GLN 112 3HB GLN 112 -7.778 -19.770 9.489 905 HG2 GLN 112 2HG GLN 112 -7.832 -18.769 7.438 906 HG3 GLN 112 3HG GLN 112 -8.918 -20.132 7.171 907 HE21 GLN 112 1HE2 GLN 112 -10.379 -19.418 5.775 908 HE22 GLN 112 2HE2 GLN 112 -11.318 -17.978 5.950 909 H SER 113 H SER 113 -7.796 -20.852 11.215 910 HA SER 113 HA SER 113 -9.474 -20.637 13.611 911 HB2 SER 113 2HB SER 113 -7.265 -22.673 13.502 912 HB3 SER 113 3HB SER 113 -8.630 -22.579 14.614 913 HG SER 113 HG SER 113 -9.214 -24.135 13.220 914 H GLN 114 H GLN 114 -7.946 -20.558 15.621 915 HA GLN 114 HA GLN 114 -5.862 -18.586 14.995 916 HB2 GLN 114 2HB GLN 114 -7.356 -19.112 17.569 917 HB3 GLN 114 3HB GLN 114 -6.091 -17.905 17.373 918 HG2 GLN 114 2HG GLN 114 -8.740 -17.956 15.944 919 HG3 GLN 114 3HG GLN 114 -8.283 -16.885 17.267 920 HE21 GLN 114 1HE2 GLN 114 -9.050 -16.499 14.360 921 HE22 GLN 114 2HE2 GLN 114 -7.821 -15.455 13.740 922 H GLY 115 H GLY 115 -4.271 -18.579 17.123 923 HA2 GLY 115 2HA GLY 115 -3.304 -21.355 17.398 924 HA3 GLY 115 3HA GLY 115 -2.208 -20.042 16.998 925 H LEU 116 H LEU 116 -1.630 -18.541 18.587 926 HA LEU 116 HA LEU 116 -0.790 -18.244 20.726 927 HB2 LEU 116 2HB LEU 116 -2.885 -17.749 22.256 928 HB3 LEU 116 3HB LEU 116 -2.391 -16.655 20.965 929 HG LEU 116 HG LEU 116 -4.111 -18.026 19.546 930 HD11 LEU 116 1HD1 LEU 116 -4.399 -19.582 21.609 931 HD12 LEU 116 2HD1 LEU 116 -5.808 -19.117 20.658 932 HD13 LEU 116 3HD1 LEU 116 -5.472 -18.308 22.188 933 HD21 LEU 116 3HD2 LEU 116 -4.251 -15.661 21.160 934 HD22 LEU 116 1HD2 LEU 116 -5.828 -16.450 21.111 935 HD23 LEU 116 2HD2 LEU 116 -5.019 -16.002 19.609 936 H GLU 117 H GLU 117 -0.651 -20.910 20.321 937 HA GLU 117 HA GLU 117 -2.087 -22.588 22.010 938 HB2 GLU 117 2HB GLU 117 -0.626 -23.471 20.291 939 HB3 GLU 117 3HB GLU 117 0.784 -22.789 21.089 940 HG2 GLU 117 2HG GLU 117 -0.909 -24.691 22.614 941 HG3 GLU 117 3HG GLU 117 0.135 -25.326 21.344 942 H1 GLY -9 H GLY -9 5.838 -12.681 10.645 943 HA2 GLY -9 2HA GLY -9 8.252 -13.674 12.006 944 HA3 GLY -9 3HA GLY -9 6.599 -13.957 12.531 945 H LYS -8 H LYS -8 8.028 -14.358 9.312 946 HA LYS -8 HA LYS -8 7.615 -17.257 9.544 947 HB2 LYS -8 2HB LYS -8 5.767 -15.905 8.274 948 HB3 LYS -8 3HB LYS -8 6.958 -15.850 6.981 949 HG2 LYS -8 2HG LYS -8 7.047 -18.287 6.949 950 HG3 LYS -8 3HG LYS -8 5.864 -18.349 8.258 951 HD2 LYS -8 2HD LYS -8 4.131 -17.675 6.903 952 HD3 LYS -8 3HD LYS -8 5.198 -16.835 5.776 953 HE2 LYS -8 2HE LYS -8 5.223 -19.824 6.075 954 HE3 LYS -8 3HE LYS -8 4.113 -19.005 4.978 955 HZ1 LYS -8 3HZ LYS -8 5.845 -19.368 3.579 956 HZ2 LYS -8 1HZ LYS -8 7.015 -19.310 4.800 957 HZ3 LYS -8 2HZ LYS -8 6.343 -17.877 4.203 958 H PHE -7 H PHE -7 9.016 -14.643 7.586 959 HA PHE -7 HA PHE -7 11.013 -16.464 6.507 960 HB2 PHE -7 2HB PHE -7 10.442 -13.540 5.999 961 HB3 PHE -7 3HB PHE -7 11.760 -14.423 5.236 962 HD1 PHE -7 HD2 PHE -7 8.069 -14.490 5.676 963 HD2 PHE -7 HD1 PHE -7 11.400 -15.545 3.246 964 HE1 PHE -7 HE2 PHE -7 6.534 -15.238 3.904 965 HE2 PHE -7 HE1 PHE -7 9.870 -16.293 1.469 966 HZ PHE -7 HZ PHE -7 7.434 -16.141 1.797 967 H ILE -6 H ILE -6 11.317 -13.164 7.808 968 HA ILE -6 HA ILE -6 12.922 -12.184 9.093 969 HB ILE -6 HB ILE -6 13.224 -14.862 10.438 970 HG12 ILE -6 2HG1 ILE -6 10.849 -14.429 10.291 971 HG13 ILE -6 3HG1 ILE -6 11.379 -14.117 11.940 972 HG21 ILE -6 1HG2 ILE -6 14.809 -13.429 11.334 973 HG22 ILE -6 2HG2 ILE -6 13.759 -12.019 11.196 974 HG23 ILE -6 3HG2 ILE -6 13.447 -13.233 12.437 975 HD11 ILE -6 3HD1 ILE -6 11.615 -11.672 10.639 976 HD12 ILE -6 1HD1 ILE -6 10.099 -12.360 10.059 977 HD13 ILE -6 2HD1 ILE -6 10.370 -12.155 11.790 978 HA PRO -5 HA PRO -5 16.333 -13.998 6.548 979 HB2 PRO -5 2HB PRO -5 17.121 -11.617 5.508 980 HB3 PRO -5 3HB PRO -5 15.833 -12.597 4.797 981 HG2 PRO -5 2HG PRO -5 15.626 -10.212 6.594 982 HG3 PRO -5 3HG PRO -5 14.683 -10.606 5.146 983 HD2 PRO -5 2HD PRO -5 13.745 -11.019 7.652 984 HD3 PRO -5 3HD PRO -5 13.307 -12.063 6.284 985 H SER -4 H SER -4 17.361 -14.429 8.598 986 HA SER -4 HA SER -4 18.983 -12.222 9.659 987 HB2 SER -4 2HB SER -4 17.564 -13.426 11.286 988 HB3 SER -4 3HB SER -4 18.395 -14.928 10.884 989 HG SER -4 HG SER -4 19.761 -12.633 11.817 990 H ARG -3 H ARG -3 19.658 -13.522 7.188 991 HA ARG -3 HA ARG -3 21.966 -15.184 7.864 992 HB2 ARG -3 2HB ARG -3 21.443 -14.537 5.034 993 HB3 ARG -3 3HB ARG -3 21.808 -16.082 5.789 994 HG2 ARG -3 2HG ARG -3 19.435 -16.045 6.681 995 HG3 ARG -3 3HG ARG -3 19.153 -14.702 5.570 996 HD2 ARG -3 2HD ARG -3 18.472 -16.572 4.358 997 HD3 ARG -3 3HD ARG -3 20.104 -16.262 3.766 998 HE ARG -3 HE ARG -3 20.728 -18.295 4.589 999 HH11 ARG -3 1HH1 ARG -3 17.793 -17.304 6.178 1000 HH12 ARG -3 2HH1 ARG -3 17.595 -18.800 7.029 1001 HH21 ARG -3 1HH2 ARG -3 20.478 -20.269 5.705 1002 HH22 ARG -3 2HH2 ARG -3 19.123 -20.485 6.760 1003 HA PRO -2 HA PRO -2 25.007 -12.090 7.218 1004 HB2 PRO -2 2HB PRO -2 26.940 -13.431 5.862 1005 HB3 PRO -2 3HB PRO -2 26.599 -13.708 7.575 1006 HG2 PRO -2 2HG PRO -2 25.718 -15.286 5.188 1007 HG3 PRO -2 3HG PRO -2 26.321 -15.865 6.752 1008 HD2 PRO -2 2HD PRO -2 23.685 -15.815 6.135 1009 HD3 PRO -2 3HD PRO -2 24.284 -15.572 7.789 1010 H ALA -1 H ALA -1 24.462 -10.453 5.891 1011 HA ALA -1 HA ALA -1 23.593 -10.554 3.284 1012 HB1 ALA -1 1HB ALA -1 23.336 -8.510 4.382 1013 HB2 ALA -1 2HB ALA -1 25.046 -8.418 4.807 1014 HB3 ALA -1 3HB ALA -1 24.539 -8.178 3.135 1015 HA PRO 0 HA PRO 0 27.385 -12.039 1.365 1016 HB2 PRO 0 2HB PRO 0 26.233 -12.552 -1.039 1017 HB3 PRO 0 3HB PRO 0 26.096 -13.644 0.344 1018 HG2 PRO 0 2HG PRO 0 24.141 -11.616 -0.670 1019 HG3 PRO 0 3HG PRO 0 23.845 -13.269 -0.102 1020 HD2 PRO 0 2HD PRO 0 23.397 -11.095 1.448 1021 HD3 PRO 0 3HD PRO 0 23.917 -12.655 2.118 1022 H LYS 1 H LYS 1 28.858 -11.099 0.007 1023 HA LYS 1 HA LYS 1 28.172 -8.433 -0.986 1024 HB2 LYS 1 2HB LYS 1 30.115 -8.515 0.443 1025 HB3 LYS 1 3HB LYS 1 30.831 -9.794 -0.529 1026 HG2 LYS 1 2HG LYS 1 30.894 -8.176 -2.442 1027 HG3 LYS 1 3HG LYS 1 30.412 -6.918 -1.301 1028 HD2 LYS 1 2HD LYS 1 32.873 -8.647 -1.051 1029 HD3 LYS 1 3HD LYS 1 32.851 -6.988 -1.654 1030 HE2 LYS 1 2HE LYS 1 32.005 -7.882 1.101 1031 HE3 LYS 1 3HE LYS 1 33.527 -7.089 0.698 1032 HZ1 LYS 1 3HZ LYS 1 32.300 -5.306 1.354 1033 HZ2 LYS 1 1HZ LYS 1 30.828 -5.967 0.845 1034 HZ3 LYS 1 2HZ LYS 1 31.896 -5.308 -0.289 1035 HA PRO 2 HA PRO 2 28.034 -9.842 -5.165 1036 HB2 PRO 2 2HB PRO 2 28.328 -7.437 -6.390 1037 HB3 PRO 2 3HB PRO 2 26.827 -7.937 -5.600 1038 HG2 PRO 2 2HG PRO 2 29.008 -6.163 -4.572 1039 HG3 PRO 2 3HG PRO 2 27.251 -5.960 -4.451 1040 HD2 PRO 2 2HD PRO 2 28.753 -6.900 -2.404 1041 HD3 PRO 2 3HD PRO 2 27.078 -7.421 -2.677 1042 HA PRO 3 HA PRO 3 32.128 -10.250 -6.720 1043 HB2 PRO 3 2HB PRO 3 31.742 -10.150 -9.405 1044 HB3 PRO 3 3HB PRO 3 31.254 -11.531 -8.415 1045 HG2 PRO 3 2HG PRO 3 29.596 -9.264 -9.451 1046 HG3 PRO 3 3HG PRO 3 29.215 -10.995 -9.395 1047 HD2 PRO 3 2HD PRO 3 28.252 -9.231 -7.580 1048 HD3 PRO 3 3HD PRO 3 28.618 -10.920 -7.170 1049 H SER 4 H SER 4 33.185 -8.386 -6.036 1050 HA SER 4 HA SER 4 32.893 -5.887 -7.417 1051 HB2 SER 4 2HB SER 4 34.898 -6.814 -5.349 1052 HB3 SER 4 3HB SER 4 34.796 -5.164 -5.963 1053 HG SER 4 HG SER 4 32.749 -6.581 -4.596 1054 H SER 5 H SER 5 35.707 -8.039 -6.980 1055 HA SER 5 HA SER 5 36.613 -7.230 -9.665 1056 HB2 SER 5 2HB SER 5 38.020 -6.228 -7.896 1057 HB3 SER 5 3HB SER 5 38.361 -7.840 -7.268 1058 HG SER 5 HG SER 5 40.017 -7.110 -8.658 1059 H ALA 6 H ALA 6 35.702 -9.041 -10.651 1060 HA ALA 6 HA ALA 6 36.930 -11.619 -9.913 1061 HB1 ALA 6 1HB ALA 6 34.164 -10.896 -10.580 1062 HB2 ALA 6 2HB ALA 6 34.768 -12.347 -11.380 1063 HB3 ALA 6 3HB ALA 6 34.790 -12.236 -9.620 Start of MODEL 18 1 H1 MET -2 H MET -2 -0.955 -3.617 -4.935 2 HA MET -2 HA MET -2 1.898 -4.331 -4.947 3 HB2 MET -2 2HB MET -2 0.858 -4.200 -2.723 4 HB3 MET -2 3HB MET -2 -0.340 -5.391 -3.212 5 HG2 MET -2 2HG MET -2 1.346 -6.451 -1.877 6 HG3 MET -2 3HG MET -2 1.458 -7.035 -3.536 7 HE1 MET -2 3HE MET -2 4.043 -7.631 -1.724 8 HE2 MET -2 1HE MET -2 3.654 -8.022 -3.399 9 HE3 MET -2 2HE MET -2 5.177 -7.221 -3.012 10 H ALA -1 H ALA -1 2.539 -6.432 -5.545 11 HA ALA -1 HA ALA -1 0.605 -8.286 -6.618 12 HB1 ALA -1 1HB ALA -1 2.147 -8.207 -8.825 13 HB2 ALA -1 2HB ALA -1 0.633 -7.317 -8.654 14 HB3 ALA -1 3HB ALA -1 2.172 -6.505 -8.365 15 HA PRO 1 HA PRO 1 3.662 -11.257 -5.579 16 HB2 PRO 1 2HB PRO 1 3.285 -13.163 -7.475 17 HB3 PRO 1 3HB PRO 1 2.142 -12.880 -6.157 18 HG2 PRO 1 2HG PRO 1 2.027 -11.945 -8.999 19 HG3 PRO 1 3HG PRO 1 0.730 -12.605 -7.985 20 HD2 PRO 1 2HD PRO 1 1.023 -9.950 -8.430 21 HD3 PRO 1 3HD PRO 1 0.380 -10.598 -6.907 22 H LEU 2 H LEU 2 5.320 -9.588 -6.283 23 HA LEU 2 HA LEU 2 6.541 -9.877 -8.852 24 HB2 LEU 2 2HB LEU 2 7.902 -8.155 -8.244 25 HB3 LEU 2 3HB LEU 2 6.554 -7.884 -7.143 26 HG LEU 2 HG LEU 2 8.076 -9.398 -5.557 27 HD11 LEU 2 1HD1 LEU 2 10.027 -9.825 -6.580 28 HD12 LEU 2 2HD1 LEU 2 10.433 -8.179 -6.093 29 HD13 LEU 2 3HD1 LEU 2 9.840 -8.495 -7.723 30 HD21 LEU 2 3HD2 LEU 2 7.280 -7.268 -4.879 31 HD22 LEU 2 1HD2 LEU 2 8.282 -6.439 -6.070 32 HD23 LEU 2 2HD2 LEU 2 9.034 -7.237 -4.688 33 H PHE 3 H PHE 3 8.352 -10.990 -9.440 34 HA PHE 3 HA PHE 3 9.464 -12.832 -7.426 35 HB2 PHE 3 2HB PHE 3 9.202 -13.292 -10.405 36 HB3 PHE 3 3HB PHE 3 9.857 -14.432 -9.234 37 HD1 PHE 3 HD2 PHE 3 7.698 -13.673 -7.098 38 HD2 PHE 3 HD1 PHE 3 7.533 -14.850 -11.185 39 HE1 PHE 3 HE2 PHE 3 5.446 -14.594 -6.738 40 HE2 PHE 3 HE1 PHE 3 5.280 -15.772 -10.832 41 HZ PHE 3 HZ PHE 3 4.234 -15.647 -8.605 42 H ALA 4 H ALA 4 11.650 -13.022 -7.251 43 HA ALA 4 HA ALA 4 13.248 -11.163 -8.882 44 HB1 ALA 4 1HB ALA 4 14.898 -11.457 -6.910 45 HB2 ALA 4 2HB ALA 4 13.478 -10.433 -6.695 46 HB3 ALA 4 3HB ALA 4 13.491 -12.071 -6.041 47 H VAL 5 H VAL 5 15.617 -11.857 -9.041 48 HA VAL 5 HA VAL 5 15.824 -14.767 -9.435 49 HB VAL 5 HB VAL 5 15.446 -13.770 -11.623 50 HG11 VAL 5 1HG1 VAL 5 16.748 -11.585 -10.673 51 HG12 VAL 5 2HG1 VAL 5 17.985 -12.299 -11.710 52 HG13 VAL 5 3HG1 VAL 5 16.405 -11.883 -12.377 53 HG21 VAL 5 3HG2 VAL 5 18.332 -14.578 -11.274 54 HG22 VAL 5 1HG2 VAL 5 16.970 -15.688 -11.427 55 HG23 VAL 5 2HG2 VAL 5 17.405 -14.634 -12.773 56 H THR 6 H THR 6 17.540 -15.626 -8.472 57 HA THR 6 HA THR 6 19.428 -14.004 -7.084 58 HB THR 6 HB THR 6 20.488 -16.589 -7.182 59 HG1 THR 6 HG1 THR 6 18.606 -17.395 -8.127 60 HG21 THR 6 3HG2 THR 6 18.703 -16.338 -4.971 61 HG22 THR 6 1HG2 THR 6 19.427 -14.763 -5.292 62 HG23 THR 6 2HG2 THR 6 20.458 -16.163 -4.997 63 H LEU 7 H LEU 7 21.465 -13.428 -7.607 64 HA LEU 7 HA LEU 7 22.415 -14.179 -10.285 65 HB2 LEU 7 2HB LEU 7 23.309 -11.872 -8.566 66 HB3 LEU 7 3HB LEU 7 23.737 -12.166 -10.250 67 HG LEU 7 HG LEU 7 20.947 -11.546 -9.287 68 HD11 LEU 7 1HD1 LEU 7 22.309 -9.550 -10.912 69 HD12 LEU 7 2HD1 LEU 7 23.061 -9.795 -9.336 70 HD13 LEU 7 3HD1 LEU 7 21.355 -9.359 -9.440 71 HD21 LEU 7 3HD2 LEU 7 20.354 -12.235 -11.313 72 HD22 LEU 7 1HD2 LEU 7 22.037 -12.484 -11.779 73 HD23 LEU 7 2HD2 LEU 7 21.292 -10.899 -11.984 74 H TYR 8 H TYR 8 23.023 -14.596 -6.968 75 HA TYR 8 HA TYR 8 25.560 -15.924 -7.596 76 HB2 TYR 8 2HB TYR 8 25.156 -14.071 -5.238 77 HB3 TYR 8 3HB TYR 8 26.605 -15.013 -5.572 78 HD1 TYR 8 HD2 TYR 8 24.466 -12.299 -6.943 79 HD2 TYR 8 HD1 TYR 8 28.302 -14.142 -6.934 80 HE1 TYR 8 HE2 TYR 8 25.356 -10.441 -8.286 81 HE2 TYR 8 HE1 TYR 8 29.202 -12.288 -8.276 82 HH TYR 8 HH TYR 8 27.998 -9.458 -8.544 83 H GLU 9 H GLU 9 26.205 -17.515 -5.991 84 HA GLU 9 HA GLU 9 23.902 -18.924 -4.950 85 HB2 GLU 9 2HB GLU 9 25.565 -20.239 -6.086 86 HB3 GLU 9 3HB GLU 9 26.840 -19.612 -5.050 87 HG2 GLU 9 2HG GLU 9 26.525 -21.258 -3.615 88 HG3 GLU 9 3HG GLU 9 24.836 -20.794 -3.412 89 H PHE 10 H PHE 10 23.113 -18.147 -3.089 90 HA PHE 10 HA PHE 10 24.960 -17.308 -0.980 91 HB2 PHE 10 2HB PHE 10 23.086 -15.803 -1.591 92 HB3 PHE 10 3HB PHE 10 21.948 -17.056 -1.108 93 HD1 PHE 10 HD1 PHE 10 24.532 -14.728 0.111 94 HD2 PHE 10 HD2 PHE 10 21.392 -17.402 1.164 95 HE1 PHE 10 HE1 PHE 10 24.587 -13.878 2.420 96 HE2 PHE 10 HE2 PHE 10 21.441 -16.556 3.473 97 HZ PHE 10 HZ PHE 10 23.039 -14.791 4.104 98 H LYS 11 H LYS 11 25.452 -18.612 0.646 99 HA LYS 11 HA LYS 11 23.855 -21.035 1.049 100 HB2 LYS 11 2HB LYS 11 26.562 -20.361 2.210 101 HB3 LYS 11 3HB LYS 11 25.771 -21.932 2.215 102 HG2 LYS 11 2HG LYS 11 27.155 -22.271 0.465 103 HG3 LYS 11 3HG LYS 11 25.826 -21.513 -0.416 104 HD2 LYS 11 2HD LYS 11 27.419 -20.124 -1.182 105 HD3 LYS 11 3HD LYS 11 27.248 -19.338 0.389 106 HE2 LYS 11 2HE LYS 11 29.005 -21.135 1.132 107 HE3 LYS 11 3HE LYS 11 29.370 -21.194 -0.592 108 HZ1 LYS 11 3HZ LYS 11 29.431 -18.755 1.103 109 HZ2 LYS 11 1HZ LYS 11 29.785 -18.815 -0.550 110 HZ3 LYS 11 2HZ LYS 11 30.784 -19.611 0.558 111 H ALA 12 H ALA 12 22.453 -21.127 2.665 112 HA ALA 12 HA ALA 12 22.114 -19.068 4.555 113 HB1 ALA 12 1HB ALA 12 20.141 -20.132 4.363 114 HB2 ALA 12 2HB ALA 12 20.894 -21.689 4.017 115 HB3 ALA 12 3HB ALA 12 20.767 -21.121 5.682 116 H GLU 13 H GLU 13 22.111 -19.409 6.948 117 HA GLU 13 HA GLU 13 24.495 -20.940 7.760 118 HB2 GLU 13 2HB GLU 13 24.633 -19.236 9.641 119 HB3 GLU 13 3HB GLU 13 25.033 -18.657 8.030 120 HG2 GLU 13 2HG GLU 13 23.200 -17.321 7.897 121 HG3 GLU 13 3HG GLU 13 22.229 -18.360 8.939 122 H ARG 14 H ARG 14 21.177 -20.139 8.450 123 HA ARG 14 HA ARG 14 21.126 -22.279 10.458 124 HB2 ARG 14 2HB ARG 14 19.816 -19.570 10.756 125 HB3 ARG 14 3HB ARG 14 19.569 -20.933 11.838 126 HG2 ARG 14 2HG ARG 14 22.327 -19.901 11.344 127 HG3 ARG 14 3HG ARG 14 21.253 -19.072 12.474 128 HD2 ARG 14 2HD ARG 14 21.775 -22.027 12.635 129 HD3 ARG 14 3HD ARG 14 22.819 -20.847 13.428 130 HE ARG 14 HE ARG 14 20.029 -20.543 14.056 131 HH11 ARG 14 1HH1 ARG 14 23.000 -22.153 14.890 132 HH12 ARG 14 2HH1 ARG 14 22.526 -22.460 16.528 133 HH21 ARG 14 1HH2 ARG 14 19.393 -20.941 16.210 134 HH22 ARG 14 2HH2 ARG 14 20.474 -21.771 17.278 135 H ASP 15 H ASP 15 18.572 -22.472 11.087 136 HA ASP 15 HA ASP 15 17.370 -23.609 8.808 137 HB2 ASP 15 2HB ASP 15 15.377 -23.885 10.253 138 HB3 ASP 15 3HB ASP 15 16.858 -24.421 11.042 139 H ASP 16 H ASP 16 16.794 -20.555 10.505 140 HA ASP 16 HA ASP 16 14.547 -19.689 9.125 141 HB2 ASP 16 2HB ASP 16 15.533 -17.342 9.614 142 HB3 ASP 16 3HB ASP 16 15.131 -18.387 10.975 143 H GLU 17 H GLU 17 17.965 -19.002 8.380 144 HA GLU 17 HA GLU 17 17.411 -17.634 5.963 145 HB2 GLU 17 2HB GLU 17 19.590 -17.792 7.490 146 HB3 GLU 17 3HB GLU 17 20.015 -19.032 6.320 147 HG2 GLU 17 2HG GLU 17 20.934 -17.256 5.274 148 HG3 GLU 17 3HG GLU 17 19.303 -17.126 4.618 149 H LEU 18 H LEU 18 17.680 -18.312 3.812 150 HA LEU 18 HA LEU 18 17.557 -21.229 3.416 151 HB2 LEU 18 2HB LEU 18 15.419 -19.876 3.052 152 HB3 LEU 18 3HB LEU 18 16.223 -19.219 1.628 153 HG LEU 18 HG LEU 18 16.514 -21.839 1.128 154 HD11 LEU 18 1HD1 LEU 18 15.376 -22.987 2.694 155 HD12 LEU 18 2HD1 LEU 18 13.983 -22.567 1.699 156 HD13 LEU 18 3HD1 LEU 18 14.367 -21.608 3.129 157 HD21 LEU 18 3HD2 LEU 18 15.512 -20.942 -0.648 158 HD22 LEU 18 1HD2 LEU 18 14.686 -19.730 0.332 159 HD23 LEU 18 2HD2 LEU 18 13.982 -21.336 0.138 160 H ASP 19 H ASP 19 18.423 -22.038 1.432 161 HA ASP 19 HA ASP 19 20.670 -20.433 0.479 162 HB2 ASP 19 2HB ASP 19 21.309 -22.626 1.156 163 HB3 ASP 19 3HB ASP 19 19.993 -23.364 0.247 164 H VAL 20 H VAL 20 21.073 -20.044 -1.712 165 HA VAL 20 HA VAL 20 18.982 -20.726 -3.634 166 HB VAL 20 HB VAL 20 19.265 -18.227 -4.444 167 HG11 VAL 20 1HG1 VAL 20 17.087 -18.361 -4.041 168 HG12 VAL 20 2HG1 VAL 20 17.354 -19.653 -2.869 169 HG13 VAL 20 3HG1 VAL 20 17.397 -17.967 -2.351 170 HG21 VAL 20 3HG2 VAL 20 20.887 -17.644 -2.691 171 HG22 VAL 20 1HG2 VAL 20 19.428 -16.658 -2.595 172 HG23 VAL 20 2HG2 VAL 20 19.670 -17.988 -1.463 173 H SER 21 H SER 21 19.621 -20.322 -5.865 174 HA SER 21 HA SER 21 22.546 -20.209 -6.207 175 HB2 SER 21 2HB SER 21 21.542 -21.705 -8.349 176 HB3 SER 21 3HB SER 21 22.454 -22.317 -6.970 177 HG SER 21 HG SER 21 20.147 -23.109 -7.543 178 HA PRO 22 HA PRO 22 21.961 -17.086 -9.232 179 HB2 PRO 22 2HB PRO 22 23.932 -17.660 -11.008 180 HB3 PRO 22 3HB PRO 22 24.249 -16.981 -9.407 181 HG2 PRO 22 2HG PRO 22 24.441 -19.822 -10.331 182 HG3 PRO 22 3HG PRO 22 25.551 -18.904 -9.296 183 HD2 PRO 22 2HD PRO 22 23.743 -20.657 -8.299 184 HD3 PRO 22 3HD PRO 22 24.245 -19.199 -7.419 185 H GLY 23 H GLY 23 20.246 -17.055 -10.547 186 HA2 GLY 23 2HA GLY 23 19.466 -17.357 -12.818 187 HA3 GLY 23 3HA GLY 23 20.204 -18.952 -12.805 188 H GLU 24 H GLU 24 18.747 -18.431 -9.861 189 HA GLU 24 HA GLU 24 16.514 -20.149 -10.609 190 HB2 GLU 24 2HB GLU 24 17.880 -19.437 -8.057 191 HB3 GLU 24 3HB GLU 24 16.201 -19.951 -7.979 192 HG2 GLU 24 2HG GLU 24 18.463 -21.518 -9.199 193 HG3 GLU 24 3HG GLU 24 17.738 -21.807 -7.618 194 H ASN 25 H ASN 25 14.344 -19.683 -10.050 195 HA ASN 25 HA ASN 25 13.769 -16.808 -10.017 196 HB2 ASN 25 2HB ASN 25 11.893 -19.096 -10.647 197 HB3 ASN 25 3HB ASN 25 11.582 -17.380 -10.892 198 HD21 ASN 25 1HD2 ASN 25 12.098 -16.505 -12.781 199 HD22 ASN 25 2HD2 ASN 25 13.029 -17.272 -14.018 200 H LEU 26 H LEU 26 13.361 -15.967 -8.087 201 HA LEU 26 HA LEU 26 11.954 -17.620 -6.096 202 HB2 LEU 26 2HB LEU 26 13.946 -15.392 -5.795 203 HB3 LEU 26 3HB LEU 26 12.922 -15.919 -4.461 204 HG LEU 26 HG LEU 26 14.010 -18.280 -5.201 205 HD11 LEU 26 1HD1 LEU 26 16.215 -18.104 -5.892 206 HD12 LEU 26 2HD1 LEU 26 16.323 -16.399 -5.456 207 HD13 LEU 26 3HD1 LEU 26 15.399 -16.888 -6.876 208 HD21 LEU 26 3HD2 LEU 26 15.676 -16.614 -3.409 209 HD22 LEU 26 1HD2 LEU 26 14.989 -18.219 -3.158 210 HD23 LEU 26 2HD2 LEU 26 13.972 -16.789 -2.988 211 H SER 27 H SER 27 10.653 -16.283 -4.503 212 HA SER 27 HA SER 27 9.250 -14.118 -5.930 213 HB2 SER 27 2HB SER 27 7.647 -15.800 -5.933 214 HB3 SER 27 3HB SER 27 8.182 -16.454 -4.385 215 HG SER 27 HG SER 27 7.146 -14.829 -3.333 216 H ILE 28 H ILE 28 9.549 -12.233 -4.964 217 HA ILE 28 HA ILE 28 10.581 -11.968 -2.335 218 HB ILE 28 HB ILE 28 9.286 -9.853 -4.060 219 HG12 ILE 28 2HG1 ILE 28 11.225 -11.034 -5.114 220 HG13 ILE 28 3HG1 ILE 28 11.502 -9.318 -4.841 221 HG21 ILE 28 1HG2 ILE 28 10.743 -9.794 -1.473 222 HG22 ILE 28 2HG2 ILE 28 11.021 -8.478 -2.612 223 HG23 ILE 28 3HG2 ILE 28 9.389 -8.813 -2.032 224 HD11 ILE 28 3HD1 ILE 28 13.405 -10.887 -4.298 225 HD12 ILE 28 1HD1 ILE 28 12.951 -9.735 -3.043 226 HD13 ILE 28 2HD1 ILE 28 12.442 -11.419 -2.920 227 H CYS 29 H CYS 29 9.606 -11.177 -0.463 228 HA CYS 29 HA CYS 29 6.661 -11.206 -0.453 229 HB2 CYS 29 2HB CYS 29 8.405 -12.218 1.796 230 HB3 CYS 29 3HB CYS 29 6.655 -12.339 1.667 231 HG CYS 29 HG CYS 29 8.576 -14.688 1.073 232 H ALA 30 H ALA 30 9.618 -9.948 0.977 233 HA ALA 30 HA ALA 30 8.474 -7.393 1.429 234 HB1 ALA 30 1HB ALA 30 7.521 -7.732 3.413 235 HB2 ALA 30 2HB ALA 30 8.265 -9.323 3.584 236 HB3 ALA 30 3HB ALA 30 9.154 -7.878 4.065 237 H HIS 31 H HIS 31 10.028 -6.001 2.792 238 HA HIS 31 HA HIS 31 12.799 -6.897 2.355 239 HB2 HIS 31 2HB HIS 31 13.429 -4.786 1.495 240 HB3 HIS 31 3HB HIS 31 11.929 -5.192 0.666 241 HD1 HIS 31 HD1 HIS 31 13.492 -2.428 2.189 242 HD2 HIS 31 HD2 HIS 31 9.623 -3.940 2.252 243 HE1 HIS 31 HE1 HIS 31 12.034 -0.513 2.919 244 H TYR 32 H TYR 32 14.343 -5.269 3.540 245 HA TYR 32 HA TYR 32 13.241 -4.351 6.076 246 HB2 TYR 32 2HB TYR 32 13.960 -6.794 6.287 247 HB3 TYR 32 3HB TYR 32 15.610 -6.217 6.078 248 HD1 TYR 32 HD1 TYR 32 12.594 -5.763 8.215 249 HD2 TYR 32 HD2 TYR 32 16.828 -5.470 7.922 250 HE1 TYR 32 HE1 TYR 32 12.721 -5.277 10.623 251 HE2 TYR 32 HE2 TYR 32 16.967 -4.985 10.329 252 HH TYR 32 HH TYR 32 14.043 -4.819 12.342 253 H ASP 33 H ASP 33 13.840 -2.273 5.840 254 HA ASP 33 HA ASP 33 15.162 -0.424 5.744 255 HB2 ASP 33 2HB ASP 33 16.938 -2.514 6.872 256 HB3 ASP 33 3HB ASP 33 17.729 -1.068 6.251 257 H TYR 34 H TYR 34 14.908 -2.406 3.420 258 HA TYR 34 HA TYR 34 15.554 -2.501 1.242 259 HB2 TYR 34 2HB TYR 34 17.066 0.051 1.829 260 HB3 TYR 34 3HB TYR 34 16.566 -0.538 0.247 261 HD1 TYR 34 HD2 TYR 34 15.376 0.900 3.427 262 HD2 TYR 34 HD1 TYR 34 14.339 -0.197 -0.551 263 HE1 TYR 34 HE2 TYR 34 13.262 2.139 3.642 264 HE2 TYR 34 HE1 TYR 34 12.223 1.040 -0.348 265 HH TYR 34 HH TYR 34 10.700 1.738 1.813 266 H GLU 35 H GLU 35 17.304 -3.479 3.537 267 HA GLU 35 HA GLU 35 19.789 -3.771 1.979 268 HB2 GLU 35 2HB GLU 35 20.681 -4.372 4.404 269 HB3 GLU 35 3HB GLU 35 20.608 -2.711 3.832 270 HG2 GLU 35 2HG GLU 35 18.450 -2.434 4.972 271 HG3 GLU 35 3HG GLU 35 18.580 -4.082 5.583 272 H TRP 36 H TRP 36 17.064 -5.335 2.977 273 HA TRP 36 HA TRP 36 18.255 -7.932 2.448 274 HB2 TRP 36 2HB TRP 36 16.685 -7.421 4.985 275 HB3 TRP 36 3HB TRP 36 17.306 -8.979 4.444 276 HD1 TRP 36 HD1 TRP 36 18.298 -5.885 6.333 277 HE1 TRP 36 HE1 TRP 36 20.728 -6.113 7.149 278 HE3 TRP 36 HE3 TRP 36 19.655 -10.046 3.690 279 HZ2 TRP 36 HZ2 TRP 36 22.930 -7.829 6.727 280 HZ3 TRP 36 HZ3 TRP 36 21.942 -10.916 3.953 281 HH2 TRP 36 HH2 TRP 36 23.544 -9.829 5.440 282 H PHE 37 H PHE 37 16.900 -9.263 1.374 283 HA PHE 37 HA PHE 37 14.079 -8.438 1.162 284 HB2 PHE 37 2HB PHE 37 16.084 -8.852 -0.907 285 HB3 PHE 37 3HB PHE 37 14.656 -9.849 -1.166 286 HD1 PHE 37 HD2 PHE 37 12.428 -8.296 -0.402 287 HD2 PHE 37 HD1 PHE 37 16.040 -6.993 -2.237 288 HE1 PHE 37 HE2 PHE 37 11.245 -6.355 -1.344 289 HE2 PHE 37 HE1 PHE 37 14.863 -5.049 -3.181 290 HZ PHE 37 HZ PHE 37 12.462 -4.729 -2.736 291 H ILE 38 H ILE 38 12.523 -10.043 1.103 292 HA ILE 38 HA ILE 38 13.452 -12.687 1.983 293 HB ILE 38 HB ILE 38 10.615 -11.704 2.150 294 HG12 ILE 38 2HG1 ILE 38 12.016 -10.054 3.294 295 HG13 ILE 38 3HG1 ILE 38 11.090 -10.993 4.460 296 HG21 ILE 38 1HG2 ILE 38 10.235 -13.683 3.076 297 HG22 ILE 38 2HG2 ILE 38 11.908 -14.132 2.750 298 HG23 ILE 38 3HG2 ILE 38 11.479 -13.388 4.290 299 HD11 ILE 38 3HD1 ILE 38 13.957 -11.551 3.748 300 HD12 ILE 38 1HD1 ILE 38 13.444 -10.563 5.116 301 HD13 ILE 38 2HD1 ILE 38 13.014 -12.272 5.052 302 H ALA 39 H ALA 39 13.850 -13.727 0.062 303 HA ALA 39 HA ALA 39 11.591 -13.964 -1.813 304 HB1 ALA 39 1HB ALA 39 14.000 -13.117 -2.483 305 HB2 ALA 39 2HB ALA 39 14.324 -14.848 -2.579 306 HB3 ALA 39 3HB ALA 39 13.047 -14.134 -3.564 307 H LYS 40 H LYS 40 10.786 -15.942 -2.347 308 HA LYS 40 HA LYS 40 11.912 -18.251 -0.902 309 HB2 LYS 40 2HB LYS 40 9.522 -19.165 -1.144 310 HB3 LYS 40 3HB LYS 40 9.798 -17.895 0.041 311 HG2 LYS 40 2HG LYS 40 8.851 -16.246 -1.405 312 HG3 LYS 40 3HG LYS 40 8.755 -17.399 -2.738 313 HD2 LYS 40 2HD LYS 40 7.069 -18.660 -1.635 314 HD3 LYS 40 3HD LYS 40 7.309 -17.781 -0.124 315 HE2 LYS 40 2HE LYS 40 5.426 -16.744 -0.930 316 HE3 LYS 40 3HE LYS 40 6.684 -15.704 -1.595 317 HZ1 LYS 40 3HZ LYS 40 5.088 -17.766 -2.987 318 HZ2 LYS 40 1HZ LYS 40 6.540 -17.184 -3.633 319 HZ3 LYS 40 2HZ LYS 40 5.248 -16.125 -3.366 320 HA PRO 41 HA PRO 41 12.506 -20.396 -4.684 321 HB2 PRO 41 2HB PRO 41 11.912 -22.948 -3.973 322 HB3 PRO 41 3HB PRO 41 13.382 -22.120 -3.444 323 HG2 PRO 41 2HG PRO 41 10.810 -22.541 -1.970 324 HG3 PRO 41 3HG PRO 41 12.476 -22.695 -1.381 325 HD2 PRO 41 2HD PRO 41 10.954 -20.509 -0.892 326 HD3 PRO 41 3HD PRO 41 12.716 -20.421 -1.089 327 H ILE 42 H ILE 42 11.065 -19.871 -6.244 328 HA ILE 42 HA ILE 42 8.277 -20.375 -6.085 329 HB ILE 42 HB ILE 42 10.032 -19.692 -8.442 330 HG12 ILE 42 2HG1 ILE 42 8.099 -18.046 -6.796 331 HG13 ILE 42 3HG1 ILE 42 9.855 -17.943 -6.733 332 HG21 ILE 42 1HG2 ILE 42 7.908 -19.139 -9.605 333 HG22 ILE 42 2HG2 ILE 42 8.114 -20.861 -9.287 334 HG23 ILE 42 3HG2 ILE 42 7.031 -19.902 -8.279 335 HD11 ILE 42 3HD1 ILE 42 9.195 -16.134 -8.043 336 HD12 ILE 42 1HD1 ILE 42 9.731 -17.345 -9.207 337 HD13 ILE 42 2HD1 ILE 42 8.008 -17.092 -8.929 338 H ASN 43 H ASN 43 10.991 -22.226 -7.206 339 HA ASN 43 HA ASN 43 9.336 -24.132 -8.638 340 HB2 ASN 43 2HB ASN 43 12.289 -23.845 -8.158 341 HB3 ASN 43 3HB ASN 43 11.628 -25.355 -8.778 342 HD21 ASN 43 1HD2 ASN 43 13.152 -24.655 -10.538 343 HD22 ASN 43 2HD2 ASN 43 12.484 -23.691 -11.807 344 H ARG 43 H ARG 43 11.678 -24.382 -5.953 345 HA ARG 43 HA ARG 43 10.902 -26.948 -5.138 346 HB2 ARG 43 2HB ARG 43 12.027 -24.828 -3.312 347 HB3 ARG 43 3HB ARG 43 12.201 -26.572 -3.174 348 HG2 ARG 43 2HG ARG 43 13.387 -26.370 -5.478 349 HG3 ARG 43 3HG ARG 43 13.571 -24.675 -5.022 350 HD2 ARG 43 2HD ARG 43 15.522 -25.621 -4.215 351 HD3 ARG 43 3HD ARG 43 14.480 -25.631 -2.793 352 HE ARG 43 HE ARG 43 14.347 -28.056 -4.324 353 HH11 ARG 43 1HH1 ARG 43 16.080 -26.339 -1.840 354 HH12 ARG 43 2HH1 ARG 43 16.709 -27.776 -1.104 355 HH21 ARG 43 1HH2 ARG 43 15.170 -29.955 -3.364 356 HH22 ARG 43 2HH2 ARG 43 16.192 -29.832 -1.973 357 H LEU 44 H LEU 44 10.350 -26.909 -2.475 358 HA LEU 44 HA LEU 44 7.551 -26.181 -2.484 359 HB2 LEU 44 2HB LEU 44 9.274 -27.577 -0.445 360 HB3 LEU 44 3HB LEU 44 7.547 -27.289 -0.248 361 HG LEU 44 HG LEU 44 8.682 -28.894 -2.527 362 HD11 LEU 44 1HD1 LEU 44 9.260 -30.412 -0.990 363 HD12 LEU 44 2HD1 LEU 44 7.527 -30.702 -0.843 364 HD13 LEU 44 3HD1 LEU 44 8.337 -29.616 0.285 365 HD21 LEU 44 3HD2 LEU 44 6.038 -29.559 -1.588 366 HD22 LEU 44 1HD2 LEU 44 6.573 -29.089 -3.201 367 HD23 LEU 44 2HD2 LEU 44 6.147 -27.852 -2.019 368 H GLY 45 H GLY 45 6.891 -25.508 0.006 369 HA2 GLY 45 2HA GLY 45 7.531 -22.770 0.164 370 HA3 GLY 45 3HA GLY 45 6.704 -23.699 1.406 371 H GLY 46 H GLY 46 9.475 -21.980 0.655 372 HA2 GLY 46 2HA GLY 46 10.694 -22.780 3.177 373 HA3 GLY 46 3HA GLY 46 11.659 -23.051 1.733 374 HA PRO 47 HA PRO 47 11.084 -18.261 2.034 375 HB2 PRO 47 2HB PRO 47 9.886 -17.310 4.278 376 HB3 PRO 47 3HB PRO 47 8.988 -17.732 2.815 377 HG2 PRO 47 2HG PRO 47 9.379 -19.320 5.323 378 HG3 PRO 47 3HG PRO 47 7.907 -19.091 4.361 379 HD2 PRO 47 2HD PRO 47 9.425 -21.326 4.190 380 HD3 PRO 47 3HD PRO 47 8.525 -20.675 2.806 381 H GLY 48 H GLY 48 13.032 -17.451 2.474 382 HA2 GLY 48 2HA GLY 48 14.102 -17.794 5.205 383 HA3 GLY 48 3HA GLY 48 15.107 -18.051 3.786 384 H LEU 49 H LEU 49 16.575 -16.453 3.931 385 HA LEU 49 HA LEU 49 15.591 -13.721 3.657 386 HB2 LEU 49 2HB LEU 49 16.258 -14.486 6.113 387 HB3 LEU 49 3HB LEU 49 17.873 -14.112 5.515 388 HG LEU 49 HG LEU 49 15.709 -12.078 5.223 389 HD11 LEU 49 1HD1 LEU 49 17.344 -12.157 7.717 390 HD12 LEU 49 2HD1 LEU 49 15.847 -13.085 7.621 391 HD13 LEU 49 3HD1 LEU 49 15.816 -11.336 7.398 392 HD21 LEU 49 3HD2 LEU 49 17.655 -10.570 5.587 393 HD22 LEU 49 1HD2 LEU 49 17.809 -11.607 4.169 394 HD23 LEU 49 2HD2 LEU 49 18.693 -11.995 5.645 395 H VAL 50 H VAL 50 16.646 -12.696 2.090 396 HA VAL 50 HA VAL 50 19.435 -13.395 1.527 397 HB VAL 50 HB VAL 50 18.149 -14.753 -0.028 398 HG11 VAL 50 1HG1 VAL 50 16.933 -12.170 -1.000 399 HG12 VAL 50 2HG1 VAL 50 16.640 -13.782 -1.654 400 HG13 VAL 50 3HG1 VAL 50 16.102 -13.380 -0.023 401 HG21 VAL 50 3HG2 VAL 50 19.065 -13.856 -2.159 402 HG22 VAL 50 1HG2 VAL 50 19.483 -12.370 -1.306 403 HG23 VAL 50 2HG2 VAL 50 20.242 -13.894 -0.845 404 HA PRO 51 HA PRO 51 19.734 -8.984 1.355 405 HB2 PRO 51 2HB PRO 51 22.263 -8.848 0.378 406 HB3 PRO 51 3HB PRO 51 21.903 -9.267 2.057 407 HG2 PRO 51 2HG PRO 51 22.552 -11.065 -0.248 408 HG3 PRO 51 3HG PRO 51 23.133 -11.138 1.426 409 HD2 PRO 51 2HD PRO 51 21.150 -12.734 0.502 410 HD3 PRO 51 3HD PRO 51 21.212 -12.162 2.182 411 H VAL 52 H VAL 52 19.677 -7.323 -0.160 412 HA VAL 52 HA VAL 52 18.677 -7.939 -2.711 413 HB VAL 52 HB VAL 52 19.921 -5.305 -1.929 414 HG11 VAL 52 1HG1 VAL 52 18.662 -6.218 -4.275 415 HG12 VAL 52 2HG1 VAL 52 17.522 -5.133 -3.477 416 HG13 VAL 52 3HG1 VAL 52 19.146 -4.571 -3.875 417 HG21 VAL 52 3HG2 VAL 52 17.245 -5.007 -1.492 418 HG22 VAL 52 1HG2 VAL 52 17.528 -6.646 -0.907 419 HG23 VAL 52 2HG2 VAL 52 18.448 -5.300 -0.236 420 H SER 53 H SER 53 21.896 -7.630 -1.542 421 HA SER 53 HA SER 53 23.110 -7.046 -4.078 422 HB2 SER 53 2HB SER 53 24.395 -6.318 -2.259 423 HB3 SER 53 3HB SER 53 24.155 -7.820 -1.367 424 HG SER 53 HG SER 53 26.123 -8.125 -2.147 425 H TYR 54 H TYR 54 21.629 -9.744 -2.902 426 HA TYR 54 HA TYR 54 23.272 -11.516 -4.590 427 HB2 TYR 54 2HB TYR 54 22.033 -11.982 -1.906 428 HB3 TYR 54 3HB TYR 54 22.208 -13.337 -3.015 429 HD1 TYR 54 HD2 TYR 54 24.148 -10.630 -1.355 430 HD2 TYR 54 HD1 TYR 54 24.240 -14.479 -3.166 431 HE1 TYR 54 HE2 TYR 54 26.487 -10.903 -0.644 432 HE2 TYR 54 HE1 TYR 54 26.578 -14.763 -2.459 433 HH TYR 54 HH TYR 54 28.228 -13.931 -1.174 434 H VAL 55 H VAL 55 20.682 -9.840 -4.889 435 HA VAL 55 HA VAL 55 19.293 -11.844 -6.465 436 HB VAL 55 HB VAL 55 17.073 -11.236 -5.515 437 HG11 VAL 55 1HG1 VAL 55 17.293 -12.622 -3.483 438 HG12 VAL 55 2HG1 VAL 55 18.120 -13.320 -4.876 439 HG13 VAL 55 3HG1 VAL 55 19.047 -12.502 -3.617 440 HG21 VAL 55 3HG2 VAL 55 18.799 -9.783 -3.530 441 HG22 VAL 55 1HG2 VAL 55 17.436 -9.166 -4.464 442 HG23 VAL 55 2HG2 VAL 55 17.158 -10.302 -3.145 443 H ARG 56 H ARG 56 17.764 -10.926 -7.963 444 HA ARG 56 HA ARG 56 18.110 -8.030 -8.373 445 HB2 ARG 56 2HB ARG 56 19.459 -9.070 -10.034 446 HB3 ARG 56 3HB ARG 56 18.215 -10.259 -10.400 447 HG2 ARG 56 2HG ARG 56 16.798 -8.465 -11.309 448 HG3 ARG 56 3HG ARG 56 18.094 -7.310 -10.993 449 HD2 ARG 56 2HD ARG 56 18.774 -9.729 -12.567 450 HD3 ARG 56 3HD ARG 56 17.776 -8.506 -13.353 451 HE ARG 56 HE ARG 56 19.795 -7.044 -12.344 452 HH11 ARG 56 1HH1 ARG 56 19.728 -9.955 -14.252 453 HH12 ARG 56 2HH1 ARG 56 21.233 -9.626 -15.044 454 HH21 ARG 56 1HH2 ARG 56 21.777 -6.599 -13.381 455 HH22 ARG 56 2HH2 ARG 56 22.399 -7.717 -14.547 456 H ILE 57 H ILE 57 16.266 -6.935 -8.435 457 HA ILE 57 HA ILE 57 13.745 -8.284 -8.329 458 HB ILE 57 HB ILE 57 14.242 -5.325 -8.665 459 HG12 ILE 57 2HG1 ILE 57 15.430 -6.128 -6.699 460 HG13 ILE 57 3HG1 ILE 57 14.011 -5.213 -6.200 461 HG21 ILE 57 1HG2 ILE 57 12.004 -5.487 -9.021 462 HG22 ILE 57 2HG2 ILE 57 11.858 -6.998 -8.126 463 HG23 ILE 57 3HG2 ILE 57 11.987 -5.469 -7.258 464 HD11 ILE 57 3HD1 ILE 57 12.819 -7.259 -5.732 465 HD12 ILE 57 1HD1 ILE 57 14.179 -8.215 -6.321 466 HD13 ILE 57 2HD1 ILE 57 14.354 -7.237 -4.863 467 H ILE 58 H ILE 58 12.908 -9.176 -10.102 468 HA ILE 58 HA ILE 58 12.861 -7.564 -12.567 469 HB ILE 58 HB ILE 58 12.819 -9.794 -13.796 470 HG12 ILE 58 2HG1 ILE 58 14.392 -11.081 -11.695 471 HG13 ILE 58 3HG1 ILE 58 12.715 -10.822 -11.228 472 HG21 ILE 58 1HG2 ILE 58 15.444 -9.421 -12.427 473 HG22 ILE 58 2HG2 ILE 58 15.095 -9.709 -14.131 474 HG23 ILE 58 3HG2 ILE 58 14.788 -8.123 -13.425 475 HD11 ILE 58 3HD1 ILE 58 12.535 -11.830 -13.790 476 HD12 ILE 58 1HD1 ILE 58 13.855 -12.744 -13.061 477 HD13 ILE 58 2HD1 ILE 58 12.270 -12.716 -12.289 478 H ASP 59 H ASP 59 11.110 -8.327 -14.099 479 HA ASP 59 HA ASP 59 8.678 -8.891 -12.542 480 HB2 ASP 59 2HB ASP 59 8.566 -6.735 -13.603 481 HB3 ASP 59 3HB ASP 59 9.065 -7.414 -15.150 482 H LEU 60 H LEU 60 7.820 -10.837 -12.776 483 HA LEU 60 HA LEU 60 8.734 -12.842 -14.425 484 HB2 LEU 60 2HB LEU 60 6.340 -13.788 -14.099 485 HB3 LEU 60 3HB LEU 60 7.406 -13.595 -12.709 486 HG LEU 60 HG LEU 60 5.629 -11.312 -13.265 487 HD11 LEU 60 1HD1 LEU 60 3.639 -12.319 -12.463 488 HD12 LEU 60 2HD1 LEU 60 4.467 -13.835 -12.110 489 HD13 LEU 60 3HD1 LEU 60 4.225 -13.332 -13.782 490 HD21 LEU 60 3HD2 LEU 60 7.244 -12.063 -11.223 491 HD22 LEU 60 1HD2 LEU 60 5.682 -12.647 -10.649 492 HD23 LEU 60 2HD2 LEU 60 5.888 -10.945 -11.062 493 H MET 61 H MET 61 6.427 -10.317 -15.124 494 HA MET 61 HA MET 61 5.547 -11.512 -17.598 495 HB2 MET 61 2HB MET 61 4.951 -9.014 -16.094 496 HB3 MET 61 3HB MET 61 4.642 -9.014 -17.825 497 HG2 MET 61 2HG MET 61 2.838 -10.310 -17.624 498 HG3 MET 61 3HG MET 61 3.613 -11.372 -16.451 499 HE1 MET 61 3HE MET 61 4.551 -10.028 -14.362 500 HE2 MET 61 1HE MET 61 3.596 -8.877 -13.428 501 HE3 MET 61 2HE MET 61 3.204 -10.595 -13.374 502 H ASP 62 H ASP 62 7.852 -9.073 -16.571 503 HA ASP 62 HA ASP 62 8.995 -9.090 -19.265 504 HB2 ASP 62 2HB ASP 62 7.417 -7.041 -18.697 505 HB3 ASP 62 3HB ASP 62 8.850 -6.462 -17.853 506 HA PRO 63 HA PRO 63 12.160 -9.616 -15.926 507 HB2 PRO 63 2HB PRO 63 13.472 -11.637 -17.176 508 HB3 PRO 63 3HB PRO 63 12.073 -11.903 -16.128 509 HG2 PRO 63 2HG PRO 63 12.204 -11.774 -19.116 510 HG3 PRO 63 3HG PRO 63 11.311 -12.905 -18.083 511 HD2 PRO 63 2HD PRO 63 10.129 -10.788 -19.287 512 HD3 PRO 63 3HD PRO 63 9.598 -11.409 -17.711 513 H ALA 64 H ALA 64 12.084 -8.719 -19.186 514 HA ALA 64 HA ALA 64 14.962 -8.227 -19.340 515 HB1 ALA 64 1HB ALA 64 12.835 -7.789 -21.433 516 HB2 ALA 64 2HB ALA 64 14.580 -7.688 -21.671 517 HB3 ALA 64 3HB ALA 64 13.832 -9.236 -21.280 518 H LYS 65 H LYS 65 12.133 -6.645 -18.414 519 HA LYS 65 HA LYS 65 12.974 -3.986 -19.187 520 HB2 LYS 65 2HB LYS 65 10.547 -4.869 -18.962 521 HB3 LYS 65 3HB LYS 65 10.769 -4.597 -17.239 522 HG2 LYS 65 2HG LYS 65 11.455 -2.218 -17.899 523 HG3 LYS 65 3HG LYS 65 10.734 -2.594 -19.466 524 HD2 LYS 65 2HD LYS 65 9.332 -2.766 -16.797 525 HD3 LYS 65 3HD LYS 65 9.146 -1.463 -17.973 526 HE2 LYS 65 2HE LYS 65 8.578 -3.501 -19.573 527 HE3 LYS 65 3HE LYS 65 8.134 -4.256 -18.043 528 HZ1 LYS 65 3HZ LYS 65 6.730 -2.250 -17.622 529 HZ2 LYS 65 1HZ LYS 65 6.206 -3.223 -18.903 530 HZ3 LYS 65 2HZ LYS 65 7.019 -1.775 -19.220 531 H TYR 66 H TYR 66 12.500 -5.745 -16.127 532 HA TYR 66 HA TYR 66 13.987 -3.666 -14.711 533 HB2 TYR 66 2HB TYR 66 12.302 -5.993 -13.809 534 HB3 TYR 66 3HB TYR 66 13.340 -5.120 -12.688 535 HD1 TYR 66 HD1 TYR 66 10.541 -4.647 -15.091 536 HD2 TYR 66 HD2 TYR 66 12.600 -3.139 -11.686 537 HE1 TYR 66 HE1 TYR 66 8.774 -2.966 -14.774 538 HE2 TYR 66 HE2 TYR 66 10.837 -1.454 -11.359 539 HH TYR 66 HH TYR 66 8.437 -0.824 -13.722 540 H ALA 67 H ALA 67 15.185 -5.680 -16.594 541 HA ALA 67 HA ALA 67 16.820 -7.339 -14.865 542 HB1 ALA 67 1HB ALA 67 16.003 -7.436 -17.573 543 HB2 ALA 67 2HB ALA 67 17.766 -7.357 -17.548 544 HB3 ALA 67 3HB ALA 67 16.927 -8.631 -16.662 545 H SER 68 H SER 68 16.961 -4.233 -16.275 546 HA SER 68 HA SER 68 19.873 -4.099 -16.157 547 HB2 SER 68 2HB SER 68 19.734 -2.131 -17.401 548 HB3 SER 68 3HB SER 68 18.354 -3.049 -18.002 549 HG SER 68 HG SER 68 17.799 -0.885 -17.490 550 H VAL 69 H VAL 69 17.172 -3.443 -14.207 551 HA VAL 69 HA VAL 69 17.853 -1.207 -12.749 552 HB VAL 69 HB VAL 69 15.756 -2.538 -12.474 553 HG11 VAL 69 1HG1 VAL 69 15.661 -4.552 -11.399 554 HG12 VAL 69 2HG1 VAL 69 17.249 -4.693 -12.156 555 HG13 VAL 69 3HG1 VAL 69 17.119 -4.243 -10.455 556 HG21 VAL 69 3HG2 VAL 69 15.432 -1.365 -10.611 557 HG22 VAL 69 1HG2 VAL 69 16.539 -2.396 -9.704 558 HG23 VAL 69 2HG2 VAL 69 17.160 -1.011 -10.603 559 H ASP 70 H ASP 70 19.107 -0.784 -10.954 560 HA ASP 70 HA ASP 70 21.229 -2.747 -10.431 561 HB2 ASP 70 2HB ASP 70 21.229 0.193 -9.729 562 HB3 ASP 70 3HB ASP 70 22.602 -0.910 -9.710 563 H THR 71 H THR 71 20.048 -4.008 -8.947 564 HA THR 71 HA THR 71 18.597 -3.154 -6.764 565 HB THR 71 HB THR 71 19.879 -5.392 -5.778 566 HG1 THR 71 HG1 THR 71 19.704 -6.697 -7.885 567 HG21 THR 71 3HG2 THR 71 17.418 -4.883 -6.023 568 HG22 THR 71 1HG2 THR 71 17.879 -6.556 -6.337 569 HG23 THR 71 2HG2 THR 71 17.543 -5.466 -7.683 570 H TYR 72 H TYR 72 22.056 -3.252 -7.196 571 HA TYR 72 HA TYR 72 22.886 -3.096 -4.531 572 HB2 TYR 72 2HB TYR 72 24.525 -3.529 -6.203 573 HB3 TYR 72 3HB TYR 72 24.122 -2.056 -7.080 574 HD1 TYR 72 HD2 TYR 72 25.324 -3.109 -3.699 575 HD2 TYR 72 HD1 TYR 72 25.526 -0.242 -6.835 576 HE1 TYR 72 HE2 TYR 72 27.090 -1.908 -2.479 577 HE2 TYR 72 HE1 TYR 72 27.293 0.967 -5.625 578 HH TYR 72 HH TYR 72 29.143 0.048 -3.670 579 H ASP 73 H ASP 73 22.153 -0.501 -6.847 580 HA ASP 73 HA ASP 73 22.700 1.639 -5.097 581 HB2 ASP 73 2HB ASP 73 21.194 1.333 -7.660 582 HB3 ASP 73 3HB ASP 73 20.996 2.821 -6.738 583 H ARG 74 H ARG 74 21.711 1.992 -3.227 584 HA ARG 74 HA ARG 74 19.306 0.898 -2.384 585 HB2 ARG 74 2HB ARG 74 19.444 2.320 -0.501 586 HB3 ARG 74 3HB ARG 74 21.108 2.012 -0.977 587 HG2 ARG 74 2HG ARG 74 19.584 4.469 -1.797 588 HG3 ARG 74 3HG ARG 74 20.585 4.377 -0.346 589 HD2 ARG 74 2HD ARG 74 21.460 4.073 -3.212 590 HD3 ARG 74 3HD ARG 74 21.897 5.357 -2.085 591 HE ARG 74 HE ARG 74 22.810 3.133 -0.855 592 HH11 ARG 74 1HH1 ARG 74 23.210 4.411 -4.069 593 HH12 ARG 74 2HH1 ARG 74 24.788 3.728 -4.284 594 HH21 ARG 74 1HH2 ARG 74 24.886 2.228 -1.127 595 HH22 ARG 74 2HH2 ARG 74 25.740 2.486 -2.611 596 H GLU 75 H GLU 75 19.907 3.705 -4.330 597 HA GLU 75 HA GLU 75 17.436 5.024 -3.946 598 HB2 GLU 75 2HB GLU 75 19.710 5.219 -5.798 599 HB3 GLU 75 3HB GLU 75 18.173 5.720 -6.489 600 HG2 GLU 75 2HG GLU 75 17.904 7.172 -4.415 601 HG3 GLU 75 3HG GLU 75 19.613 6.858 -4.120 602 H GLN 76 H GLN 76 18.552 2.786 -6.477 603 HA GLN 76 HA GLN 76 16.155 2.722 -7.936 604 HB2 GLN 76 2HB GLN 76 18.181 0.495 -7.682 605 HB3 GLN 76 3HB GLN 76 17.031 0.727 -8.992 606 HG2 GLN 76 2HG GLN 76 18.705 3.055 -8.596 607 HG3 GLN 76 3HG GLN 76 19.650 1.601 -8.913 608 HE21 GLN 76 1HE2 GLN 76 19.876 0.971 -10.947 609 HE22 GLN 76 2HE2 GLN 76 18.965 1.561 -12.291 610 H VAL 77 H VAL 77 17.411 0.358 -5.578 611 HA VAL 77 HA VAL 77 15.194 -1.316 -5.509 612 HB VAL 77 HB VAL 77 17.566 -1.453 -4.327 613 HG11 VAL 77 1HG1 VAL 77 16.941 0.404 -2.756 614 HG12 VAL 77 2HG1 VAL 77 15.789 -0.707 -2.013 615 HG13 VAL 77 3HG1 VAL 77 17.514 -1.072 -1.980 616 HG21 VAL 77 3HG2 VAL 77 14.988 -2.801 -3.835 617 HG22 VAL 77 1HG2 VAL 77 16.540 -3.466 -4.342 618 HG23 VAL 77 2HG2 VAL 77 16.254 -3.091 -2.642 619 H MET 78 H MET 78 15.741 1.764 -3.954 620 HA MET 78 HA MET 78 13.636 1.604 -2.064 621 HB2 MET 78 2HB MET 78 15.438 3.695 -3.105 622 HB3 MET 78 3HB MET 78 13.891 4.276 -2.503 623 HG2 MET 78 2HG MET 78 14.369 2.966 -0.396 624 HG3 MET 78 3HG MET 78 16.006 2.757 -1.013 625 HE1 MET 78 3HE MET 78 17.633 5.174 -1.570 626 HE2 MET 78 1HE MET 78 17.817 5.700 0.104 627 HE3 MET 78 2HE MET 78 17.731 3.979 -0.275 628 H LYS 79 H LYS 79 13.840 3.356 -5.166 629 HA LYS 79 HA LYS 79 11.185 4.198 -5.261 630 HB2 LYS 79 2HB LYS 79 12.980 3.501 -7.593 631 HB3 LYS 79 3HB LYS 79 11.535 4.500 -7.668 632 HG2 LYS 79 2HG LYS 79 12.560 6.302 -6.740 633 HG3 LYS 79 3HG LYS 79 13.664 5.318 -5.776 634 HD2 LYS 79 2HD LYS 79 14.983 4.810 -7.738 635 HD3 LYS 79 3HD LYS 79 13.836 5.670 -8.768 636 HE2 LYS 79 2HE LYS 79 14.343 7.732 -7.412 637 HE3 LYS 79 3HE LYS 79 15.654 6.823 -6.662 638 HZ1 LYS 79 3HZ LYS 79 16.931 7.319 -8.383 639 HZ2 LYS 79 1HZ LYS 79 15.671 8.188 -9.103 640 HZ3 LYS 79 2HZ LYS 79 15.862 6.542 -9.439 641 H ILE 80 H ILE 80 12.658 1.162 -6.250 642 HA ILE 80 HA ILE 80 10.432 0.113 -7.637 643 HB ILE 80 HB ILE 80 12.650 -1.356 -6.207 644 HG12 ILE 80 2HG1 ILE 80 12.459 -1.018 -9.174 645 HG13 ILE 80 3HG1 ILE 80 13.076 0.313 -8.202 646 HG21 ILE 80 1HG2 ILE 80 10.269 -2.290 -7.557 647 HG22 ILE 80 2HG2 ILE 80 11.734 -2.906 -8.318 648 HG23 ILE 80 3HG2 ILE 80 11.448 -3.188 -6.601 649 HD11 ILE 80 3HD1 ILE 80 14.369 -2.128 -9.025 650 HD12 ILE 80 1HD1 ILE 80 15.062 -0.650 -8.360 651 HD13 ILE 80 2HD1 ILE 80 14.453 -1.903 -7.278 652 H ILE 81 H ILE 81 11.573 -0.417 -4.304 653 HA ILE 81 HA ILE 81 9.478 -2.100 -3.503 654 HB ILE 81 HB ILE 81 11.223 -0.249 -1.882 655 HG12 ILE 81 2HG1 ILE 81 11.283 -3.261 -2.087 656 HG13 ILE 81 3HG1 ILE 81 12.245 -2.212 -3.122 657 HG21 ILE 81 1HG2 ILE 81 9.729 -0.518 -0.243 658 HG22 ILE 81 2HG2 ILE 81 8.881 -1.800 -1.106 659 HG23 ILE 81 3HG2 ILE 81 10.317 -2.178 -0.156 660 HD11 ILE 81 3HD1 ILE 81 12.521 -1.631 -0.277 661 HD12 ILE 81 1HD1 ILE 81 13.047 -3.250 -0.737 662 HD13 ILE 81 2HD1 ILE 81 13.752 -1.837 -1.524 663 H ASP 82 H ASP 82 9.754 1.399 -3.598 664 HA ASP 82 HA ASP 82 7.401 1.929 -2.082 665 HB2 ASP 82 2HB ASP 82 9.242 3.572 -2.403 666 HB3 ASP 82 3HB ASP 82 8.783 3.713 -4.098 667 H GLU 83 H GLU 83 8.100 1.861 -5.566 668 HA GLU 83 HA GLU 83 5.477 2.520 -6.392 669 HB2 GLU 83 2HB GLU 83 7.801 1.202 -7.779 670 HB3 GLU 83 3HB GLU 83 6.260 1.449 -8.589 671 HG2 GLU 83 2HG GLU 83 6.749 3.927 -7.582 672 HG3 GLU 83 3HG GLU 83 8.378 3.358 -7.943 673 H PHE 84 H PHE 84 7.156 -0.584 -6.020 674 HA PHE 84 HA PHE 84 4.903 -2.137 -6.843 675 HB2 PHE 84 2HB PHE 84 7.553 -2.770 -5.581 676 HB3 PHE 84 3HB PHE 84 6.313 -4.012 -5.715 677 HD1 PHE 84 HD1 PHE 84 7.896 -1.405 -7.868 678 HD2 PHE 84 HD2 PHE 84 6.429 -5.387 -7.541 679 HE1 PHE 84 HE1 PHE 84 8.603 -1.852 -10.182 680 HE2 PHE 84 HE2 PHE 84 7.134 -5.840 -9.854 681 HZ PHE 84 HZ PHE 84 8.223 -4.072 -11.178 682 H LYS 85 H LYS 85 5.608 -0.454 -4.036 683 HA LYS 85 HA LYS 85 4.686 -0.373 -1.958 684 HB2 LYS 85 2HB LYS 85 2.553 -1.780 -3.534 685 HB3 LYS 85 3HB LYS 85 2.362 -1.535 -1.803 686 HG2 LYS 85 2HG LYS 85 1.350 0.355 -2.498 687 HG3 LYS 85 3HG LYS 85 3.010 0.958 -2.512 688 HD2 LYS 85 2HD LYS 85 3.039 1.151 -4.747 689 HD3 LYS 85 3HD LYS 85 2.227 -0.398 -4.982 690 HE2 LYS 85 2HE LYS 85 0.778 2.069 -4.054 691 HE3 LYS 85 3HE LYS 85 0.987 1.679 -5.761 692 HZ1 LYS 85 3HZ LYS 85 -0.451 -0.053 -5.638 693 HZ2 LYS 85 1HZ LYS 85 -1.110 0.892 -4.399 694 HZ3 LYS 85 2HZ LYS 85 -0.093 -0.406 -4.023 695 H ILE 86 H ILE 86 6.647 -2.276 -2.244 696 HA ILE 86 HA ILE 86 5.786 -4.818 -1.224 697 HB ILE 86 HB ILE 86 8.611 -3.774 -1.205 698 HG12 ILE 86 2HG1 ILE 86 7.149 -5.134 -3.480 699 HG13 ILE 86 3HG1 ILE 86 7.640 -3.444 -3.447 700 HG21 ILE 86 1HG2 ILE 86 7.420 -6.196 -0.406 701 HG22 ILE 86 2HG2 ILE 86 8.308 -6.532 -1.892 702 HG23 ILE 86 3HG2 ILE 86 9.139 -5.814 -0.512 703 HD11 ILE 86 3HD1 ILE 86 9.561 -5.748 -3.266 704 HD12 ILE 86 1HD1 ILE 86 9.122 -4.939 -4.770 705 HD13 ILE 86 2HD1 ILE 86 9.944 -4.042 -3.493 706 HA PRO 87 HA PRO 87 5.613 -3.432 3.011 707 HB2 PRO 87 2HB PRO 87 4.956 -5.849 4.059 708 HB3 PRO 87 3HB PRO 87 3.789 -4.813 3.226 709 HG2 PRO 87 2HG PRO 87 5.297 -7.183 2.189 710 HG3 PRO 87 3HG PRO 87 3.594 -6.749 1.953 711 HD2 PRO 87 2HD PRO 87 5.489 -6.289 0.074 712 HD3 PRO 87 3HD PRO 87 4.081 -5.229 0.291 713 H THR 88 H THR 88 6.639 -4.057 5.068 714 HA THR 88 HA THR 88 9.361 -4.975 4.596 715 HB THR 88 HB THR 88 8.923 -4.330 7.344 716 HG1 THR 88 HG1 THR 88 8.154 -2.184 7.070 717 HG21 THR 88 3HG2 THR 88 10.418 -2.354 6.633 718 HG22 THR 88 1HG2 THR 88 10.434 -3.123 5.047 719 HG23 THR 88 2HG2 THR 88 11.057 -3.987 6.453 720 H VAL 89 H VAL 89 10.362 -6.307 6.421 721 HA VAL 89 HA VAL 89 9.304 -8.853 6.452 722 HB VAL 89 HB VAL 89 11.101 -7.613 8.541 723 HG11 VAL 89 1HG1 VAL 89 9.942 -10.256 8.296 724 HG12 VAL 89 2HG1 VAL 89 11.706 -10.307 8.302 725 HG13 VAL 89 3HG1 VAL 89 10.840 -9.537 9.633 726 HG21 VAL 89 3HG2 VAL 89 11.740 -9.128 6.011 727 HG22 VAL 89 1HG2 VAL 89 12.039 -7.417 6.317 728 HG23 VAL 89 2HG2 VAL 89 12.919 -8.643 7.229 729 H GLU 90 H GLU 90 9.241 -6.546 9.177 730 HA GLU 90 HA GLU 90 7.690 -8.009 10.923 731 HB2 GLU 90 2HB GLU 90 7.881 -5.034 10.483 732 HB3 GLU 90 3HB GLU 90 6.920 -5.729 11.781 733 HG2 GLU 90 2HG GLU 90 8.932 -6.818 12.668 734 HG3 GLU 90 3HG GLU 90 9.885 -6.068 11.388 735 H GLN 91 H GLN 91 6.616 -5.826 8.346 736 HA GLN 91 HA GLN 91 3.862 -5.984 8.875 737 HB2 GLN 91 2HB GLN 91 5.142 -5.588 6.169 738 HB3 GLN 91 3HB GLN 91 3.536 -5.074 6.668 739 HG2 GLN 91 2HG GLN 91 6.188 -3.972 7.540 740 HG3 GLN 91 3HG GLN 91 4.896 -3.150 6.667 741 HE21 GLN 91 1HE2 GLN 91 6.351 -2.920 9.400 742 HE22 GLN 91 2HE2 GLN 91 5.051 -2.613 10.496 743 H TRP 92 H TRP 92 5.926 -7.873 6.690 744 HA TRP 92 HA TRP 92 3.901 -9.469 5.586 745 HB2 TRP 92 2HB TRP 92 6.168 -9.314 4.640 746 HB3 TRP 92 3HB TRP 92 6.811 -10.166 6.041 747 HD1 TRP 92 HD1 TRP 92 3.934 -10.962 3.538 748 HE1 TRP 92 HE1 TRP 92 4.205 -13.410 2.789 749 HE3 TRP 92 HE3 TRP 92 8.129 -12.165 6.201 750 HZ2 TRP 92 HZ2 TRP 92 5.964 -15.565 3.265 751 HZ3 TRP 92 HZ3 TRP 92 9.041 -14.442 5.999 752 HH2 TRP 92 HH2 TRP 92 7.980 -16.105 4.562 753 H LYS 93 H LYS 93 5.873 -9.874 8.487 754 HA LYS 93 HA LYS 93 5.034 -12.488 9.127 755 HB2 LYS 93 2HB LYS 93 5.926 -10.309 11.024 756 HB3 LYS 93 3HB LYS 93 5.911 -12.036 11.355 757 HG2 LYS 93 2HG LYS 93 7.458 -11.144 9.000 758 HG3 LYS 93 3HG LYS 93 8.097 -10.721 10.590 759 HD2 LYS 93 2HD LYS 93 8.930 -12.776 10.754 760 HD3 LYS 93 3HD LYS 93 7.282 -13.410 10.748 761 HE2 LYS 93 2HE LYS 93 7.522 -13.109 8.150 762 HE3 LYS 93 3HE LYS 93 9.245 -13.183 8.515 763 HZ1 LYS 93 3HZ LYS 93 8.330 -15.364 7.986 764 HZ2 LYS 93 1HZ LYS 93 7.243 -15.240 9.277 765 HZ3 LYS 93 2HZ LYS 93 8.906 -15.315 9.576 766 H ASP 94 H ASP 94 3.910 -9.331 10.334 767 HA ASP 94 HA ASP 94 1.884 -10.294 12.001 768 HB2 ASP 94 2HB ASP 94 2.712 -7.967 12.038 769 HB3 ASP 94 3HB ASP 94 1.944 -7.679 10.479 770 H GLN 95 H GLN 95 1.861 -9.507 8.561 771 HA GLN 95 HA GLN 95 -0.909 -9.739 8.141 772 HB2 GLN 95 2HB GLN 95 1.455 -10.091 6.305 773 HB3 GLN 95 3HB GLN 95 -0.204 -10.229 5.739 774 HG2 GLN 95 2HG GLN 95 -0.603 -8.002 5.922 775 HG3 GLN 95 3HG GLN 95 0.521 -7.797 7.264 776 HE21 GLN 95 1HE2 GLN 95 1.277 -5.925 6.130 777 HE22 GLN 95 2HE2 GLN 95 2.411 -6.094 4.838 778 H THR 96 H THR 96 1.689 -12.116 7.591 779 HA THR 96 HA THR 96 0.003 -14.240 6.854 780 HB THR 96 HB THR 96 2.053 -15.633 7.780 781 HG1 THR 96 HG1 THR 96 3.777 -14.465 8.275 782 HG21 THR 96 3HG2 THR 96 1.317 -14.951 5.357 783 HG22 THR 96 1HG2 THR 96 2.931 -15.600 5.646 784 HG23 THR 96 2HG2 THR 96 2.699 -13.861 5.463 785 H ARG 97 H ARG 97 1.233 -13.192 9.991 786 HA ARG 97 HA ARG 97 0.390 -15.411 11.495 787 HB2 ARG 97 2HB ARG 97 0.963 -12.543 12.184 788 HB3 ARG 97 3HB ARG 97 0.361 -13.659 13.402 789 HG2 ARG 97 2HG ARG 97 2.745 -14.412 11.778 790 HG3 ARG 97 3HG ARG 97 2.919 -13.271 13.113 791 HD2 ARG 97 2HD ARG 97 1.845 -14.934 14.607 792 HD3 ARG 97 3HD ARG 97 1.823 -16.076 13.263 793 HE ARG 97 HE ARG 97 4.439 -15.275 13.497 794 HH11 ARG 97 1HH1 ARG 97 2.083 -16.786 15.567 795 HH12 ARG 97 2HH1 ARG 97 3.260 -17.671 16.480 796 HH21 ARG 97 1HH2 ARG 97 5.998 -16.435 14.691 797 HH22 ARG 97 2HH2 ARG 97 5.487 -17.470 15.981 798 H ARG 98 H ARG 98 -1.158 -12.205 11.215 799 HA ARG 98 HA ARG 98 -3.523 -12.903 12.540 800 HB2 ARG 98 2HB ARG 98 -4.427 -10.855 11.734 801 HB3 ARG 98 3HB ARG 98 -2.712 -10.574 12.006 802 HG2 ARG 98 2HG ARG 98 -2.290 -10.841 9.612 803 HG3 ARG 98 3HG ARG 98 -4.013 -11.109 9.344 804 HD2 ARG 98 2HD ARG 98 -4.313 -8.828 10.517 805 HD3 ARG 98 3HD ARG 98 -2.597 -8.605 10.180 806 HE ARG 98 HE ARG 98 -3.804 -9.372 7.801 807 HH11 ARG 98 1HH1 ARG 98 -3.955 -6.718 10.049 808 HH12 ARG 98 2HH1 ARG 98 -4.403 -5.554 8.846 809 HH21 ARG 98 1HH2 ARG 98 -4.393 -7.849 6.208 810 HH22 ARG 98 2HH2 ARG 98 -4.653 -6.198 6.662 811 H TYR 99 H TYR 99 -2.534 -13.285 9.207 812 HA TYR 99 HA TYR 99 -5.075 -13.808 8.097 813 HB2 TYR 99 2HB TYR 99 -3.263 -13.272 6.626 814 HB3 TYR 99 3HB TYR 99 -2.295 -14.611 7.231 815 HD1 TYR 99 HD2 TYR 99 -5.505 -13.907 5.467 816 HD2 TYR 99 HD1 TYR 99 -2.297 -16.633 6.088 817 HE1 TYR 99 HE2 TYR 99 -6.389 -15.346 3.679 818 HE2 TYR 99 HE1 TYR 99 -3.172 -18.079 4.301 819 HH TYR 99 HH TYR 99 -6.279 -17.503 2.828 820 H LYS 100 H LYS 100 -2.549 -15.969 9.346 821 HA LYS 100 HA LYS 100 -3.891 -18.385 8.813 822 HB2 LYS 100 2HB LYS 100 -1.628 -17.547 10.556 823 HB3 LYS 100 3HB LYS 100 -2.377 -19.103 10.889 824 HG2 LYS 100 2HG LYS 100 -1.662 -18.539 8.076 825 HG3 LYS 100 3HG LYS 100 -0.335 -18.808 9.208 826 HD2 LYS 100 2HD LYS 100 -0.815 -20.940 8.374 827 HD3 LYS 100 3HD LYS 100 -1.638 -20.896 9.935 828 HE2 LYS 100 2HE LYS 100 -3.173 -20.008 7.560 829 HE3 LYS 100 3HE LYS 100 -2.827 -21.731 7.697 830 HZ1 LYS 100 3HZ LYS 100 -4.909 -20.488 8.859 831 HZ2 LYS 100 1HZ LYS 100 -3.792 -20.516 10.130 832 HZ3 LYS 100 2HZ LYS 100 -4.258 -21.960 9.382 833 H GLU 101 H GLU 101 -4.254 -16.031 11.326 834 HA GLU 101 HA GLU 101 -5.992 -17.849 12.844 835 HB2 GLU 101 2HB GLU 101 -4.649 -15.254 13.596 836 HB3 GLU 101 3HB GLU 101 -5.864 -16.029 14.603 837 HG2 GLU 101 2HG GLU 101 -3.551 -17.664 13.736 838 HG3 GLU 101 3HG GLU 101 -3.273 -16.422 14.954 839 H SER 102 H SER 102 -7.727 -16.303 14.082 840 HA SER 102 HA SER 102 -9.072 -14.710 12.005 841 HB2 SER 102 2HB SER 102 -10.403 -16.601 11.914 842 HB3 SER 102 3HB SER 102 -10.137 -16.998 13.612 843 HG SER 102 HG SER 102 -11.634 -15.540 14.205 844 H SER 103 H SER 103 -10.430 -13.034 12.756 845 HA SER 103 HA SER 103 -10.053 -12.327 15.592 846 HB2 SER 103 2HB SER 103 -9.976 -9.940 14.871 847 HB3 SER 103 3HB SER 103 -8.624 -10.892 14.258 848 HG SER 103 HG SER 103 -10.952 -10.592 12.710 849 H ILE 104 H ILE 104 -11.621 -10.196 15.879 850 HA ILE 104 HA ILE 104 -14.235 -11.292 15.896 851 HB ILE 104 HB ILE 104 -13.548 -8.382 16.276 852 HG12 ILE 104 2HG1 ILE 104 -12.061 -9.660 17.698 853 HG13 ILE 104 3HG1 ILE 104 -13.324 -8.941 18.692 854 HG21 ILE 104 1HG2 ILE 104 -15.500 -8.913 18.035 855 HG22 ILE 104 2HG2 ILE 104 -15.805 -8.377 16.384 856 HG23 ILE 104 3HG2 ILE 104 -15.900 -10.091 16.785 857 HD11 ILE 104 3HD1 ILE 104 -12.667 -11.738 18.221 858 HD12 ILE 104 1HD1 ILE 104 -13.524 -10.980 19.562 859 HD13 ILE 104 2HD1 ILE 104 -14.388 -11.379 18.077 860 H GLN 105 H GLN 105 -12.481 -9.434 13.594 861 HA GLN 105 HA GLN 105 -14.890 -8.587 12.188 862 HB2 GLN 105 2HB GLN 105 -12.143 -8.171 11.092 863 HB3 GLN 105 3HB GLN 105 -13.561 -7.136 10.976 864 HG2 GLN 105 2HG GLN 105 -13.148 -7.023 13.618 865 HG3 GLN 105 3HG GLN 105 -11.495 -7.299 13.072 866 HE21 GLN 105 1HE2 GLN 105 -10.635 -5.817 11.471 867 HE22 GLN 105 2HE2 GLN 105 -11.170 -4.175 11.467 868 H ILE 106 H ILE 106 -14.697 -8.834 9.687 869 HA ILE 106 HA ILE 106 -13.561 -11.396 8.895 870 HB ILE 106 HB ILE 106 -15.764 -12.037 7.811 871 HG12 ILE 106 2HG1 ILE 106 -16.650 -9.617 8.405 872 HG13 ILE 106 3HG1 ILE 106 -17.742 -10.997 8.372 873 HG21 ILE 106 1HG2 ILE 106 -14.967 -13.292 9.667 874 HG22 ILE 106 2HG2 ILE 106 -15.449 -12.034 10.804 875 HG23 ILE 106 3HG2 ILE 106 -16.677 -12.971 9.954 876 HD11 ILE 106 3HD1 ILE 106 -16.409 -10.286 10.932 877 HD12 ILE 106 1HD1 ILE 106 -17.760 -9.305 10.364 878 HD13 ILE 106 2HD1 ILE 106 -17.980 -11.033 10.644 879 H GLY 107 H GLY 107 -13.676 -11.750 6.549 880 HA2 GLY 107 2HA GLY 107 -13.745 -11.040 4.335 881 HA3 GLY 107 3HA GLY 107 -14.406 -9.504 4.877 882 H ASN 108 H ASN 108 -12.532 -9.515 2.905 883 HA ASN 108 HA ASN 108 -10.077 -8.621 4.267 884 HB2 ASN 108 2HB ASN 108 -10.426 -9.634 1.436 885 HB3 ASN 108 3HB ASN 108 -8.914 -9.049 2.123 886 HD21 ASN 108 1HD2 ASN 108 -10.257 -11.741 1.203 887 HD22 ASN 108 2HD2 ASN 108 -9.684 -12.851 2.397 888 H GLY 109 H GLY 109 -9.242 -6.617 3.816 889 HA2 GLY 109 2HA GLY 109 -11.079 -4.679 2.756 890 HA3 GLY 109 3HA GLY 109 -9.470 -4.357 3.386 891 H HIS 110 H HIS 110 -11.387 -4.815 0.587 892 HA HIS 110 HA HIS 110 -9.160 -4.011 -1.088 893 HB2 HIS 110 2HB HIS 110 -9.350 -6.615 -0.949 894 HB3 HIS 110 3HB HIS 110 -10.731 -6.390 -2.018 895 HD1 HIS 110 HD1 HIS 110 -7.151 -6.826 -2.068 896 HD2 HIS 110 HD2 HIS 110 -9.954 -4.940 -4.487 897 HE1 HIS 110 HE1 HIS 110 -6.010 -6.492 -4.284 898 H GLY 111 H GLY 111 -9.790 -2.738 -2.754 899 HA2 GLY 111 2HA GLY 111 -12.657 -2.679 -3.432 900 HA3 GLY 111 3HA GLY 111 -11.823 -1.189 -3.014 901 H GLN 112 H GLN 112 -13.044 -1.225 -5.384 902 HA GLN 112 HA GLN 112 -10.922 -1.755 -7.353 903 HB2 GLN 112 2HB GLN 112 -12.763 -1.658 -9.043 904 HB3 GLN 112 3HB GLN 112 -12.905 -2.984 -7.897 905 HG2 GLN 112 2HG GLN 112 -14.752 -2.108 -6.891 906 HG3 GLN 112 3HG GLN 112 -14.311 -0.445 -7.278 907 HE21 GLN 112 1HE2 GLN 112 -16.873 -1.466 -7.634 908 HE22 GLN 112 2HE2 GLN 112 -17.227 -1.502 -9.324 909 H SER 113 H SER 113 -11.378 -0.204 -9.384 910 HA SER 113 HA SER 113 -11.766 2.536 -8.403 911 HB2 SER 113 2HB SER 113 -9.759 3.050 -10.055 912 HB3 SER 113 3HB SER 113 -9.459 2.580 -8.382 913 HG SER 113 HG SER 113 -8.275 1.431 -10.142 914 H GLN 114 H GLN 114 -11.886 4.116 -10.264 915 HA GLN 114 HA GLN 114 -12.550 3.140 -12.861 916 HB2 GLN 114 2HB GLN 114 -14.926 3.812 -12.843 917 HB3 GLN 114 3HB GLN 114 -14.602 2.468 -11.756 918 HG2 GLN 114 2HG GLN 114 -14.411 4.253 -9.926 919 HG3 GLN 114 3HG GLN 114 -15.201 5.321 -11.085 920 HE21 GLN 114 1HE2 GLN 114 -15.944 3.907 -8.453 921 HE22 GLN 114 2HE2 GLN 114 -17.513 3.264 -8.783 922 H GLY 115 H GLY 115 -12.483 4.748 -14.366 923 HA2 GLY 115 2HA GLY 115 -12.449 7.525 -13.372 924 HA3 GLY 115 3HA GLY 115 -11.163 6.934 -14.414 925 H LEU 116 H LEU 116 -14.360 5.772 -14.977 926 HA LEU 116 HA LEU 116 -15.728 5.944 -16.790 927 HB2 LEU 116 2HB LEU 116 -15.033 8.866 -16.786 928 HB3 LEU 116 3HB LEU 116 -16.542 8.103 -17.283 929 HG LEU 116 HG LEU 116 -16.587 7.393 -14.725 930 HD11 LEU 116 1HD1 LEU 116 -15.738 9.892 -13.834 931 HD12 LEU 116 2HD1 LEU 116 -14.441 9.310 -14.878 932 HD13 LEU 116 3HD1 LEU 116 -14.981 8.331 -13.514 933 HD21 LEU 116 3HD2 LEU 116 -18.081 8.966 -16.222 934 HD22 LEU 116 1HD2 LEU 116 -17.317 10.228 -15.254 935 HD23 LEU 116 2HD2 LEU 116 -18.241 8.949 -14.465 936 H GLU 117 H GLU 117 -13.036 5.274 -17.382 937 HA GLU 117 HA GLU 117 -12.931 6.204 -20.153 938 HB2 GLU 117 2HB GLU 117 -10.817 6.570 -18.091 939 HB3 GLU 117 3HB GLU 117 -10.301 6.129 -19.713 940 HG2 GLU 117 2HG GLU 117 -12.152 8.433 -19.218 941 HG3 GLU 117 3HG GLU 117 -10.400 8.605 -19.126 942 H1 GLY -9 H GLY -9 9.119 -10.082 12.253 943 HA2 GLY -9 2HA GLY -9 8.508 -11.423 14.125 944 HA3 GLY -9 3HA GLY -9 8.398 -12.510 12.748 945 H LYS -8 H LYS -8 10.497 -13.644 12.186 946 HA LYS -8 HA LYS -8 12.023 -14.273 14.623 947 HB2 LYS -8 2HB LYS -8 12.096 -16.665 13.557 948 HB3 LYS -8 3HB LYS -8 10.710 -16.168 14.520 949 HG2 LYS -8 2HG LYS -8 9.969 -17.310 12.532 950 HG3 LYS -8 3HG LYS -8 9.497 -15.611 12.457 951 HD2 LYS -8 2HD LYS -8 10.361 -16.387 10.306 952 HD3 LYS -8 3HD LYS -8 11.403 -15.142 11.000 953 HE2 LYS -8 2HE LYS -8 13.147 -16.520 10.997 954 HE3 LYS -8 3HE LYS -8 12.240 -17.747 11.880 955 HZ1 LYS -8 3HZ LYS -8 11.368 -17.674 9.201 956 HZ2 LYS -8 1HZ LYS -8 12.092 -18.949 10.045 957 HZ3 LYS -8 2HZ LYS -8 13.053 -17.823 9.228 958 H PHE -7 H PHE -7 12.246 -12.911 11.738 959 HA PHE -7 HA PHE -7 14.713 -14.221 10.879 960 HB2 PHE -7 2HB PHE -7 12.862 -12.216 9.624 961 HB3 PHE -7 3HB PHE -7 14.497 -12.426 9.006 962 HD1 PHE -7 HD2 PHE -7 15.197 -14.817 8.360 963 HD2 PHE -7 HD1 PHE -7 11.154 -13.596 8.896 964 HE1 PHE -7 HE2 PHE -7 14.443 -16.736 7.019 965 HE2 PHE -7 HE1 PHE -7 10.394 -15.515 7.557 966 HZ PHE -7 HZ PHE -7 12.039 -17.087 6.615 967 H ILE -6 H ILE -6 13.840 -10.781 10.877 968 HA ILE -6 HA ILE -6 15.071 -8.926 11.385 969 HB ILE -6 HB ILE -6 16.085 -10.490 13.748 970 HG12 ILE -6 2HG1 ILE -6 13.723 -10.953 13.655 971 HG13 ILE -6 3HG1 ILE -6 13.994 -9.749 14.910 972 HG21 ILE -6 1HG2 ILE -6 16.017 -7.698 12.944 973 HG22 ILE -6 2HG2 ILE -6 15.330 -7.961 14.546 974 HG23 ILE -6 3HG2 ILE -6 16.974 -8.493 14.194 975 HD11 ILE -6 3HD1 ILE -6 13.517 -8.278 12.601 976 HD12 ILE -6 1HD1 ILE -6 12.359 -9.607 12.550 977 HD13 ILE -6 2HD1 ILE -6 12.413 -8.536 13.951 978 HA PRO -5 HA PRO -5 18.988 -10.651 9.633 979 HB2 PRO -5 2HB PRO -5 19.124 -8.858 7.599 980 HB3 PRO -5 3HB PRO -5 18.205 -10.363 7.492 981 HG2 PRO -5 2HG PRO -5 17.238 -7.591 8.078 982 HG3 PRO -5 3HG PRO -5 16.523 -8.827 7.026 983 HD2 PRO -5 2HD PRO -5 15.608 -8.334 9.527 984 HD3 PRO -5 3HD PRO -5 15.557 -9.949 8.793 985 H SER -4 H SER -4 19.852 -9.763 11.667 986 HA SER -4 HA SER -4 20.671 -6.970 11.605 987 HB2 SER -4 2HB SER -4 21.613 -8.744 13.787 988 HB3 SER -4 3HB SER -4 20.937 -7.118 13.867 989 HG SER -4 HG SER -4 19.699 -9.521 14.140 990 H ARG -3 H ARG -3 21.844 -8.272 9.548 991 HA ARG -3 HA ARG -3 24.578 -8.879 10.438 992 HB2 ARG -3 2HB ARG -3 23.961 -9.293 7.602 993 HB3 ARG -3 3HB ARG -3 24.740 -10.368 8.755 994 HG2 ARG -3 2HG ARG -3 21.770 -9.908 8.575 995 HG3 ARG -3 3HG ARG -3 22.631 -11.266 7.848 996 HD2 ARG -3 2HD ARG -3 23.532 -11.459 10.367 997 HD3 ARG -3 3HD ARG -3 21.957 -10.730 10.676 998 HE ARG -3 HE ARG -3 21.729 -12.931 8.900 999 HH11 ARG -3 1HH1 ARG -3 22.195 -12.122 12.254 1000 HH12 ARG -3 2HH1 ARG -3 21.496 -13.594 12.841 1001 HH21 ARG -3 1HH2 ARG -3 20.806 -14.873 9.661 1002 HH22 ARG -3 2HH2 ARG -3 20.707 -15.159 11.366 1003 HA PRO -2 HA PRO -2 26.299 -5.250 8.676 1004 HB2 PRO -2 2HB PRO -2 28.551 -6.162 7.465 1005 HB3 PRO -2 3HB PRO -2 28.376 -6.066 9.222 1006 HG2 PRO -2 2HG PRO -2 28.066 -8.431 7.413 1007 HG3 PRO -2 3HG PRO -2 28.877 -8.325 8.986 1008 HD2 PRO -2 2HD PRO -2 26.386 -9.347 8.697 1009 HD3 PRO -2 3HD PRO -2 26.898 -8.477 10.158 1010 H ALA -1 H ALA -1 25.126 -7.708 6.696 1011 HA ALA -1 HA ALA -1 24.564 -7.865 4.490 1012 HB1 ALA -1 1HB ALA -1 24.268 -5.222 3.668 1013 HB2 ALA -1 2HB ALA -1 23.018 -6.277 4.329 1014 HB3 ALA -1 3HB ALA -1 23.921 -5.203 5.397 1015 HA PRO 0 HA PRO 0 28.800 -7.111 2.929 1016 HB2 PRO 0 2HB PRO 0 28.918 -9.436 1.532 1017 HB3 PRO 0 3HB PRO 0 29.284 -9.333 3.259 1018 HG2 PRO 0 2HG PRO 0 26.764 -10.218 1.906 1019 HG3 PRO 0 3HG PRO 0 27.599 -10.935 3.296 1020 HD2 PRO 0 2HD PRO 0 25.424 -9.346 3.565 1021 HD3 PRO 0 3HD PRO 0 26.721 -9.401 4.775 1022 H LYS 1 H LYS 1 29.144 -5.932 1.160 1023 HA LYS 1 HA LYS 1 27.135 -5.578 -0.824 1024 HB2 LYS 1 2HB LYS 1 29.897 -4.538 -0.373 1025 HB3 LYS 1 3HB LYS 1 29.185 -4.353 -1.970 1026 HG2 LYS 1 2HG LYS 1 27.269 -3.188 -0.956 1027 HG3 LYS 1 3HG LYS 1 28.048 -3.326 0.623 1028 HD2 LYS 1 2HD LYS 1 30.020 -2.106 -0.388 1029 HD3 LYS 1 3HD LYS 1 28.988 -1.775 -1.781 1030 HE2 LYS 1 2HE LYS 1 27.565 -0.407 -0.559 1031 HE3 LYS 1 3HE LYS 1 28.061 -1.102 0.984 1032 HZ1 LYS 1 3HZ LYS 1 28.925 1.169 0.560 1033 HZ2 LYS 1 1HZ LYS 1 29.834 0.552 -0.726 1034 HZ3 LYS 1 2HZ LYS 1 30.137 0.026 0.852 1035 HA PRO 2 HA PRO 2 28.189 -8.532 -3.892 1036 HB2 PRO 2 2HB PRO 2 27.870 -7.126 -6.193 1037 HB3 PRO 2 3HB PRO 2 26.512 -7.646 -5.188 1038 HG2 PRO 2 2HG PRO 2 27.852 -4.973 -5.327 1039 HG3 PRO 2 3HG PRO 2 26.122 -5.354 -5.244 1040 HD2 PRO 2 2HD PRO 2 27.546 -4.566 -3.080 1041 HD3 PRO 2 3HD PRO 2 26.178 -5.692 -2.965 1042 HA PRO 3 HA PRO 3 32.370 -8.229 -5.222 1043 HB2 PRO 3 2HB PRO 3 32.340 -9.593 -7.569 1044 HB3 PRO 3 3HB PRO 3 32.183 -10.384 -5.996 1045 HG2 PRO 3 2HG PRO 3 30.052 -9.633 -7.960 1046 HG3 PRO 3 3HG PRO 3 30.231 -11.126 -7.020 1047 HD2 PRO 3 2HD PRO 3 28.525 -9.149 -6.304 1048 HD3 PRO 3 3HD PRO 3 29.345 -10.181 -5.114 1049 H SER 4 H SER 4 33.197 -6.329 -5.835 1050 HA SER 4 HA SER 4 32.407 -5.245 -8.460 1051 HB2 SER 4 2HB SER 4 31.637 -3.818 -6.608 1052 HB3 SER 4 3HB SER 4 33.290 -3.706 -6.005 1053 HG SER 4 HG SER 4 32.081 -2.365 -8.060 1054 H SER 5 H SER 5 34.287 -6.974 -8.777 1055 HA SER 5 HA SER 5 36.929 -6.390 -8.189 1056 HB2 SER 5 2HB SER 5 35.912 -7.638 -10.753 1057 HB3 SER 5 3HB SER 5 37.527 -7.816 -10.068 1058 HG SER 5 HG SER 5 35.939 -9.554 -9.647 1059 H ALA 6 H ALA 6 38.404 -4.979 -8.916 1060 HA ALA 6 HA ALA 6 37.715 -2.649 -10.240 1061 HB1 ALA 6 1HB ALA 6 39.869 -2.032 -9.958 1062 HB2 ALA 6 2HB ALA 6 39.910 -3.466 -8.931 1063 HB3 ALA 6 3HB ALA 6 40.503 -3.552 -10.589 Start of MODEL 19 1 H1 MET -2 H MET -2 0.181 -4.693 -3.328 2 HA MET -2 HA MET -2 2.084 -3.050 -4.784 3 HB2 MET -2 2HB MET -2 4.026 -4.330 -3.958 4 HB3 MET -2 3HB MET -2 3.245 -3.407 -2.682 5 HG2 MET -2 2HG MET -2 3.492 -5.351 -1.570 6 HG3 MET -2 3HG MET -2 1.954 -5.705 -2.354 7 HE1 MET -2 3HE MET -2 6.053 -7.009 -3.876 8 HE2 MET -2 1HE MET -2 5.644 -5.569 -2.943 9 HE3 MET -2 2HE MET -2 5.798 -7.128 -2.134 10 H ALA -1 H ALA -1 2.934 -4.051 -6.601 11 HA ALA -1 HA ALA -1 1.436 -6.317 -7.563 12 HB1 ALA -1 1HB ALA -1 3.216 -4.285 -8.722 13 HB2 ALA -1 2HB ALA -1 3.262 -5.865 -9.505 14 HB3 ALA -1 3HB ALA -1 1.734 -4.997 -9.360 15 HA PRO 1 HA PRO 1 4.283 -9.565 -6.791 16 HB2 PRO 1 2HB PRO 1 4.115 -11.040 -9.064 17 HB3 PRO 1 3HB PRO 1 2.819 -10.974 -7.864 18 HG2 PRO 1 2HG PRO 1 3.081 -9.490 -10.450 19 HG3 PRO 1 3HG PRO 1 1.655 -10.281 -9.754 20 HD2 PRO 1 2HD PRO 1 2.050 -7.606 -9.615 21 HD3 PRO 1 3HD PRO 1 1.208 -8.515 -8.343 22 H LEU 2 H LEU 2 6.289 -8.545 -6.692 23 HA LEU 2 HA LEU 2 7.770 -8.220 -9.200 24 HB2 LEU 2 2HB LEU 2 9.249 -6.802 -8.040 25 HB3 LEU 2 3HB LEU 2 7.626 -6.356 -7.517 26 HG LEU 2 HG LEU 2 8.411 -8.183 -5.611 27 HD11 LEU 2 1HD1 LEU 2 10.666 -8.330 -6.196 28 HD12 LEU 2 2HD1 LEU 2 10.637 -7.147 -4.890 29 HD13 LEU 2 3HD1 LEU 2 10.779 -6.608 -6.563 30 HD21 LEU 2 3HD2 LEU 2 7.216 -6.040 -5.304 31 HD22 LEU 2 1HD2 LEU 2 8.747 -5.188 -5.506 32 HD23 LEU 2 2HD2 LEU 2 8.518 -6.277 -4.138 33 H PHE 3 H PHE 3 9.600 -9.349 -9.662 34 HA PHE 3 HA PHE 3 10.429 -11.397 -7.713 35 HB2 PHE 3 2HB PHE 3 10.027 -11.610 -10.687 36 HB3 PHE 3 3HB PHE 3 11.076 -12.731 -9.824 37 HD1 PHE 3 HD1 PHE 3 7.665 -11.269 -9.391 38 HD2 PHE 3 HD2 PHE 3 10.130 -14.737 -9.272 39 HE1 PHE 3 HE1 PHE 3 5.707 -12.636 -8.800 40 HE2 PHE 3 HE2 PHE 3 8.176 -16.110 -8.682 41 HZ PHE 3 HZ PHE 3 5.961 -15.060 -8.446 42 H ALA 4 H ALA 4 12.670 -12.186 -8.043 43 HA ALA 4 HA ALA 4 14.435 -10.175 -9.256 44 HB1 ALA 4 1HB ALA 4 14.743 -9.459 -7.121 45 HB2 ALA 4 2HB ALA 4 14.343 -11.026 -6.417 46 HB3 ALA 4 3HB ALA 4 15.929 -10.763 -7.142 47 H VAL 5 H VAL 5 16.682 -10.977 -9.522 48 HA VAL 5 HA VAL 5 16.779 -13.903 -9.845 49 HB VAL 5 HB VAL 5 16.462 -12.925 -12.044 50 HG11 VAL 5 1HG1 VAL 5 17.398 -10.685 -11.434 51 HG12 VAL 5 2HG1 VAL 5 19.011 -11.380 -11.607 52 HG13 VAL 5 3HG1 VAL 5 17.929 -11.304 -12.998 53 HG21 VAL 5 3HG2 VAL 5 18.538 -14.628 -11.301 54 HG22 VAL 5 1HG2 VAL 5 17.853 -14.429 -12.915 55 HG23 VAL 5 2HG2 VAL 5 19.267 -13.491 -12.435 56 H THR 6 H THR 6 18.433 -14.823 -8.836 57 HA THR 6 HA THR 6 20.371 -13.301 -7.429 58 HB THR 6 HB THR 6 21.404 -15.857 -7.499 59 HG1 THR 6 HG1 THR 6 19.856 -17.078 -8.268 60 HG21 THR 6 3HG2 THR 6 19.612 -15.941 -5.412 61 HG22 THR 6 1HG2 THR 6 19.819 -14.211 -5.683 62 HG23 THR 6 2HG2 THR 6 21.223 -15.226 -5.355 63 H LEU 7 H LEU 7 22.573 -13.064 -7.777 64 HA LEU 7 HA LEU 7 23.476 -13.658 -10.518 65 HB2 LEU 7 2HB LEU 7 24.383 -11.444 -8.684 66 HB3 LEU 7 3HB LEU 7 24.956 -11.730 -10.325 67 HG LEU 7 HG LEU 7 22.062 -11.160 -9.785 68 HD11 LEU 7 1HD1 LEU 7 22.941 -8.763 -10.568 69 HD12 LEU 7 2HD1 LEU 7 24.350 -9.293 -9.651 70 HD13 LEU 7 3HD1 LEU 7 22.770 -9.215 -8.872 71 HD21 LEU 7 3HD2 LEU 7 23.090 -12.010 -12.013 72 HD22 LEU 7 1HD2 LEU 7 23.664 -10.350 -12.176 73 HD23 LEU 7 2HD2 LEU 7 21.936 -10.676 -12.042 74 H TYR 8 H TYR 8 23.965 -14.303 -7.238 75 HA TYR 8 HA TYR 8 26.477 -15.677 -7.865 76 HB2 TYR 8 2HB TYR 8 26.039 -13.973 -5.404 77 HB3 TYR 8 3HB TYR 8 27.461 -14.958 -5.729 78 HD1 TYR 8 HD1 TYR 8 25.519 -12.056 -6.996 79 HD2 TYR 8 HD2 TYR 8 29.253 -14.095 -6.975 80 HE1 TYR 8 HE1 TYR 8 26.554 -10.159 -8.170 81 HE2 TYR 8 HE2 TYR 8 30.299 -12.203 -8.148 82 HH TYR 8 HH TYR 8 28.662 -9.901 -9.749 83 H GLU 9 H GLU 9 27.081 -17.197 -6.007 84 HA GLU 9 HA GLU 9 24.681 -18.702 -5.312 85 HB2 GLU 9 2HB GLU 9 26.554 -19.877 -6.397 86 HB3 GLU 9 3HB GLU 9 27.599 -19.448 -5.050 87 HG2 GLU 9 2HG GLU 9 27.041 -21.525 -4.377 88 HG3 GLU 9 3HG GLU 9 25.669 -20.662 -3.683 89 H PHE 10 H PHE 10 23.746 -18.000 -3.490 90 HA PHE 10 HA PHE 10 25.347 -17.078 -1.253 91 HB2 PHE 10 2HB PHE 10 23.169 -15.998 -2.005 92 HB3 PHE 10 3HB PHE 10 22.348 -17.399 -1.326 93 HD1 PHE 10 HD1 PHE 10 24.949 -14.919 -0.317 94 HD2 PHE 10 HD2 PHE 10 21.524 -17.186 0.798 95 HE1 PHE 10 HE1 PHE 10 24.965 -13.847 1.898 96 HE2 PHE 10 HE2 PHE 10 21.534 -16.118 3.015 97 HZ PHE 10 HZ PHE 10 23.255 -14.445 3.567 98 H LYS 11 H LYS 11 26.307 -18.663 -0.131 99 HA LYS 11 HA LYS 11 25.037 -21.218 0.290 100 HB2 LYS 11 2HB LYS 11 27.650 -20.025 1.205 101 HB3 LYS 11 3HB LYS 11 27.108 -21.613 1.729 102 HG2 LYS 11 2HG LYS 11 27.457 -22.562 -0.308 103 HG3 LYS 11 3HG LYS 11 27.149 -21.061 -1.185 104 HD2 LYS 11 2HD LYS 11 29.299 -20.231 -0.739 105 HD3 LYS 11 3HD LYS 11 29.578 -21.405 0.550 106 HE2 LYS 11 2HE LYS 11 30.815 -22.339 -1.137 107 HE3 LYS 11 3HE LYS 11 29.265 -23.135 -1.403 108 HZ1 LYS 11 3HZ LYS 11 28.884 -21.969 -3.295 109 HZ2 LYS 11 1HZ LYS 11 30.575 -21.961 -3.344 110 HZ3 LYS 11 2HZ LYS 11 29.740 -20.603 -2.781 111 H ALA 12 H ALA 12 23.300 -21.119 1.610 112 HA ALA 12 HA ALA 12 22.852 -19.421 3.741 113 HB1 ALA 12 1HB ALA 12 21.354 -21.323 4.596 114 HB2 ALA 12 2HB ALA 12 21.009 -20.645 3.005 115 HB3 ALA 12 3HB ALA 12 21.857 -22.185 3.141 116 H GLU 13 H GLU 13 23.270 -19.447 5.917 117 HA GLU 13 HA GLU 13 25.276 -21.410 6.810 118 HB2 GLU 13 2HB GLU 13 25.890 -19.649 8.506 119 HB3 GLU 13 3HB GLU 13 26.246 -19.238 6.834 120 HG2 GLU 13 2HG GLU 13 24.214 -17.879 6.739 121 HG3 GLU 13 3HG GLU 13 23.876 -18.279 8.422 122 H ARG 14 H ARG 14 22.216 -19.911 7.509 123 HA ARG 14 HA ARG 14 21.909 -21.718 9.814 124 HB2 ARG 14 2HB ARG 14 20.918 -18.876 9.549 125 HB3 ARG 14 3HB ARG 14 20.425 -19.977 10.829 126 HG2 ARG 14 2HG ARG 14 23.300 -19.268 10.334 127 HG3 ARG 14 3HG ARG 14 22.250 -18.319 11.389 128 HD2 ARG 14 2HD ARG 14 21.917 -20.165 12.851 129 HD3 ARG 14 3HD ARG 14 22.677 -21.280 11.717 130 HE ARG 14 HE ARG 14 24.530 -19.295 12.410 131 HH11 ARG 14 1HH1 ARG 14 22.858 -21.999 13.828 132 HH12 ARG 14 2HH1 ARG 14 24.111 -22.340 14.975 133 HH21 ARG 14 1HH2 ARG 14 26.187 -19.733 13.916 134 HH22 ARG 14 2HH2 ARG 14 26.003 -21.050 15.025 135 H ASP 15 H ASP 15 19.363 -21.620 10.398 136 HA ASP 15 HA ASP 15 18.086 -22.979 8.268 137 HB2 ASP 15 2HB ASP 15 16.647 -21.819 10.647 138 HB3 ASP 15 3HB ASP 15 16.261 -23.278 9.737 139 H ASP 16 H ASP 16 17.874 -19.693 9.508 140 HA ASP 16 HA ASP 16 15.620 -18.911 7.977 141 HB2 ASP 16 2HB ASP 16 16.480 -16.570 8.459 142 HB3 ASP 16 3HB ASP 16 16.155 -17.577 9.868 143 H GLU 17 H GLU 17 19.039 -19.088 7.317 144 HA GLU 17 HA GLU 17 18.876 -17.517 4.902 145 HB2 GLU 17 2HB GLU 17 21.134 -19.310 5.799 146 HB3 GLU 17 3HB GLU 17 21.216 -18.002 4.628 147 HG2 GLU 17 2HG GLU 17 20.610 -17.660 7.556 148 HG3 GLU 17 3HG GLU 17 22.188 -17.413 6.809 149 H LEU 18 H LEU 18 18.648 -18.230 2.856 150 HA LEU 18 HA LEU 18 18.242 -21.120 2.487 151 HB2 LEU 18 2HB LEU 18 16.332 -19.542 2.053 152 HB3 LEU 18 3HB LEU 18 17.268 -18.897 0.706 153 HG LEU 18 HG LEU 18 17.280 -21.453 -0.016 154 HD11 LEU 18 1HD1 LEU 18 14.517 -21.520 0.897 155 HD12 LEU 18 2HD1 LEU 18 15.685 -21.608 2.215 156 HD13 LEU 18 3HD1 LEU 18 15.746 -22.785 0.903 157 HD21 LEU 18 3HD2 LEU 18 15.266 -19.293 -0.455 158 HD22 LEU 18 1HD2 LEU 18 15.015 -20.882 -1.178 159 HD23 LEU 18 2HD2 LEU 18 16.466 -19.957 -1.566 160 H ASP 19 H ASP 19 19.087 -22.153 0.645 161 HA ASP 19 HA ASP 19 21.545 -20.933 -0.338 162 HB2 ASP 19 2HB ASP 19 21.486 -23.285 0.562 163 HB3 ASP 19 3HB ASP 19 20.525 -23.731 -0.846 164 H VAL 20 H VAL 20 21.676 -19.980 -2.252 165 HA VAL 20 HA VAL 20 19.833 -20.811 -4.388 166 HB VAL 20 HB VAL 20 19.072 -18.673 -3.294 167 HG11 VAL 20 1HG1 VAL 20 21.560 -17.918 -3.089 168 HG12 VAL 20 2HG1 VAL 20 21.305 -17.294 -4.720 169 HG13 VAL 20 3HG1 VAL 20 20.299 -16.723 -3.389 170 HG21 VAL 20 3HG2 VAL 20 19.766 -17.898 -6.054 171 HG22 VAL 20 1HG2 VAL 20 18.950 -19.451 -5.868 172 HG23 VAL 20 2HG2 VAL 20 18.195 -17.978 -5.257 173 H SER 21 H SER 21 20.574 -20.330 -6.544 174 HA SER 21 HA SER 21 23.509 -20.107 -6.698 175 HB2 SER 21 2HB SER 21 22.774 -21.272 -9.069 176 HB3 SER 21 3HB SER 21 23.328 -22.152 -7.644 177 HG SER 21 HG SER 21 21.439 -23.056 -7.697 178 HA PRO 22 HA PRO 22 23.190 -16.591 -9.302 179 HB2 PRO 22 2HB PRO 22 25.217 -17.002 -11.060 180 HB3 PRO 22 3HB PRO 22 25.486 -16.562 -9.369 181 HG2 PRO 22 2HG PRO 22 25.614 -19.256 -10.668 182 HG3 PRO 22 3HG PRO 22 26.709 -18.537 -9.473 183 HD2 PRO 22 2HD PRO 22 24.794 -20.330 -8.802 184 HD3 PRO 22 3HD PRO 22 25.310 -19.029 -7.709 185 H GLY 23 H GLY 23 21.560 -16.284 -10.685 186 HA2 GLY 23 2HA GLY 23 20.855 -16.244 -12.991 187 HA3 GLY 23 3HA GLY 23 21.550 -17.847 -13.183 188 H GLU 24 H GLU 24 20.074 -17.924 -10.271 189 HA GLU 24 HA GLU 24 17.819 -19.391 -11.334 190 HB2 GLU 24 2HB GLU 24 18.984 -18.979 -8.604 191 HB3 GLU 24 3HB GLU 24 17.353 -19.615 -8.770 192 HG2 GLU 24 2HG GLU 24 19.857 -20.824 -9.923 193 HG3 GLU 24 3HG GLU 24 18.964 -21.407 -8.519 194 H ASN 25 H ASN 25 15.621 -19.041 -10.463 195 HA ASN 25 HA ASN 25 15.032 -16.170 -10.386 196 HB2 ASN 25 2HB ASN 25 13.191 -18.512 -10.925 197 HB3 ASN 25 3HB ASN 25 12.744 -16.811 -11.017 198 HD21 ASN 25 1HD2 ASN 25 12.766 -15.964 -12.961 199 HD22 ASN 25 2HD2 ASN 25 13.707 -16.512 -14.303 200 H LEU 26 H LEU 26 14.160 -15.213 -8.647 201 HA LEU 26 HA LEU 26 13.151 -16.919 -6.473 202 HB2 LEU 26 2HB LEU 26 14.923 -14.496 -6.190 203 HB3 LEU 26 3HB LEU 26 14.176 -15.371 -4.855 204 HG LEU 26 HG LEU 26 16.026 -16.785 -6.736 205 HD11 LEU 26 1HD1 LEU 26 17.616 -16.166 -4.617 206 HD12 LEU 26 2HD1 LEU 26 16.721 -14.663 -4.842 207 HD13 LEU 26 3HD1 LEU 26 17.648 -15.345 -6.178 208 HD21 LEU 26 3HD2 LEU 26 16.467 -17.768 -4.271 209 HD22 LEU 26 1HD2 LEU 26 15.233 -18.392 -5.366 210 HD23 LEU 26 2HD2 LEU 26 14.790 -17.248 -4.099 211 H SER 27 H SER 27 11.559 -15.976 -5.124 212 HA SER 27 HA SER 27 10.162 -13.713 -6.386 213 HB2 SER 27 2HB SER 27 9.124 -16.139 -6.049 214 HB3 SER 27 3HB SER 27 8.773 -15.501 -4.443 215 HG SER 27 HG SER 27 7.806 -13.672 -5.600 216 H ILE 28 H ILE 28 10.474 -11.864 -5.349 217 HA ILE 28 HA ILE 28 11.229 -11.793 -2.568 218 HB ILE 28 HB ILE 28 10.657 -9.542 -4.500 219 HG12 ILE 28 2HG1 ILE 28 13.254 -10.745 -3.517 220 HG13 ILE 28 3HG1 ILE 28 12.598 -10.873 -5.145 221 HG21 ILE 28 1HG2 ILE 28 10.304 -8.848 -2.190 222 HG22 ILE 28 2HG2 ILE 28 11.896 -9.465 -1.752 223 HG23 ILE 28 3HG2 ILE 28 11.754 -8.098 -2.858 224 HD11 ILE 28 3HD1 ILE 28 12.846 -8.469 -5.438 225 HD12 ILE 28 1HD1 ILE 28 13.490 -8.333 -3.802 226 HD13 ILE 28 2HD1 ILE 28 14.383 -9.231 -5.030 227 H CYS 29 H CYS 29 10.057 -10.960 -0.862 228 HA CYS 29 HA CYS 29 7.180 -10.571 -1.367 229 HB2 CYS 29 2HB CYS 29 8.399 -11.586 1.202 230 HB3 CYS 29 3HB CYS 29 6.697 -11.568 0.757 231 HG CYS 29 HG CYS 29 7.464 -14.207 0.677 232 H ALA 30 H ALA 30 9.958 -9.567 0.563 233 HA ALA 30 HA ALA 30 8.987 -6.876 0.699 234 HB1 ALA 30 1HB ALA 30 7.790 -7.094 2.570 235 HB2 ALA 30 2HB ALA 30 8.462 -8.688 2.917 236 HB3 ALA 30 3HB ALA 30 9.340 -7.237 3.400 237 H HIS 31 H HIS 31 10.486 -5.555 2.226 238 HA HIS 31 HA HIS 31 13.228 -6.602 1.954 239 HB2 HIS 31 2HB HIS 31 14.016 -4.435 1.376 240 HB3 HIS 31 3HB HIS 31 12.589 -4.714 0.383 241 HD1 HIS 31 HD1 HIS 31 14.077 -2.157 2.303 242 HD2 HIS 31 HD2 HIS 31 10.179 -3.521 1.845 243 HE1 HIS 31 HE1 HIS 31 12.608 -0.264 3.065 244 H TYR 32 H TYR 32 14.756 -5.100 3.367 245 HA TYR 32 HA TYR 32 13.540 -4.414 5.920 246 HB2 TYR 32 2HB TYR 32 14.051 -6.811 6.133 247 HB3 TYR 32 3HB TYR 32 15.726 -6.495 5.696 248 HD1 TYR 32 HD1 TYR 32 17.201 -5.266 7.256 249 HD2 TYR 32 HD2 TYR 32 13.244 -6.388 8.345 250 HE1 TYR 32 HE1 TYR 32 17.751 -4.885 9.623 251 HE2 TYR 32 HE2 TYR 32 13.783 -6.009 10.715 252 HH TYR 32 HH TYR 32 17.052 -5.297 11.765 253 H ASP 33 H ASP 33 14.210 -2.339 5.892 254 HA ASP 33 HA ASP 33 15.588 -0.535 6.034 255 HB2 ASP 33 2HB ASP 33 17.218 -2.766 7.116 256 HB3 ASP 33 3HB ASP 33 18.083 -1.293 6.689 257 H TYR 34 H TYR 34 15.463 -2.326 3.548 258 HA TYR 34 HA TYR 34 16.281 -2.285 1.427 259 HB2 TYR 34 2HB TYR 34 17.799 0.176 2.308 260 HB3 TYR 34 3HB TYR 34 17.392 -0.280 0.658 261 HD1 TYR 34 HD1 TYR 34 16.019 0.940 3.857 262 HD2 TYR 34 HD2 TYR 34 15.238 0.190 -0.258 263 HE1 TYR 34 HE1 TYR 34 13.926 2.221 4.027 264 HE2 TYR 34 HE2 TYR 34 13.143 1.470 -0.100 265 HH TYR 34 HH TYR 34 11.982 2.718 2.987 266 H GLU 35 H GLU 35 17.814 -3.492 3.755 267 HA GLU 35 HA GLU 35 20.423 -3.702 2.399 268 HB2 GLU 35 2HB GLU 35 21.048 -4.575 4.841 269 HB3 GLU 35 3HB GLU 35 21.114 -2.873 4.406 270 HG2 GLU 35 2HG GLU 35 18.854 -2.576 5.340 271 HG3 GLU 35 3HG GLU 35 18.864 -4.266 5.839 272 H TRP 36 H TRP 36 17.591 -5.301 3.165 273 HA TRP 36 HA TRP 36 18.744 -7.847 2.365 274 HB2 TRP 36 2HB TRP 36 17.154 -7.571 4.925 275 HB3 TRP 36 3HB TRP 36 17.726 -9.082 4.223 276 HD1 TRP 36 HD1 TRP 36 18.852 -6.164 6.347 277 HE1 TRP 36 HE1 TRP 36 21.247 -6.598 7.186 278 HE3 TRP 36 HE3 TRP 36 19.979 -10.261 3.504 279 HZ2 TRP 36 HZ2 TRP 36 23.337 -8.433 6.706 280 HZ3 TRP 36 HZ3 TRP 36 22.197 -11.296 3.754 281 HH2 TRP 36 HH2 TRP 36 23.840 -10.399 5.322 282 H PHE 37 H PHE 37 17.383 -9.031 1.135 283 HA PHE 37 HA PHE 37 14.608 -8.067 0.904 284 HB2 PHE 37 2HB PHE 37 16.655 -8.517 -1.098 285 HB3 PHE 37 3HB PHE 37 15.216 -9.472 -1.437 286 HD1 PHE 37 HD1 PHE 37 13.006 -7.857 -0.689 287 HD2 PHE 37 HD2 PHE 37 16.700 -6.655 -2.431 288 HE1 PHE 37 HE1 PHE 37 11.909 -5.868 -1.636 289 HE2 PHE 37 HE2 PHE 37 15.609 -4.664 -3.379 290 HZ PHE 37 HZ PHE 37 13.211 -4.268 -2.981 291 H ILE 38 H ILE 38 13.015 -9.483 1.245 292 HA ILE 38 HA ILE 38 13.694 -12.189 2.008 293 HB ILE 38 HB ILE 38 10.922 -11.022 1.841 294 HG12 ILE 38 2HG1 ILE 38 12.254 -9.494 3.176 295 HG13 ILE 38 3HG1 ILE 38 11.201 -10.424 4.236 296 HG21 ILE 38 1HG2 ILE 38 10.741 -13.311 2.194 297 HG22 ILE 38 2HG2 ILE 38 12.172 -13.364 3.222 298 HG23 ILE 38 3HG2 ILE 38 10.678 -12.649 3.827 299 HD11 ILE 38 3HD1 ILE 38 13.080 -11.881 4.806 300 HD12 ILE 38 1HD1 ILE 38 14.130 -10.923 3.761 301 HD13 ILE 38 2HD1 ILE 38 13.409 -10.193 5.196 302 H ALA 39 H ALA 39 14.250 -13.316 0.180 303 HA ALA 39 HA ALA 39 12.201 -13.524 -1.927 304 HB1 ALA 39 1HB ALA 39 14.693 -12.781 -2.363 305 HB2 ALA 39 2HB ALA 39 14.969 -14.523 -2.361 306 HB3 ALA 39 3HB ALA 39 13.829 -13.812 -3.504 307 H LYS 40 H LYS 40 11.629 -15.572 -2.725 308 HA LYS 40 HA LYS 40 12.419 -17.843 -1.023 309 HB2 LYS 40 2HB LYS 40 10.045 -18.702 -1.531 310 HB3 LYS 40 3HB LYS 40 10.223 -17.427 -0.332 311 HG2 LYS 40 2HG LYS 40 9.418 -15.783 -1.808 312 HG3 LYS 40 3HG LYS 40 9.586 -16.846 -3.207 313 HD2 LYS 40 2HD LYS 40 7.855 -18.333 -2.170 314 HD3 LYS 40 3HD LYS 40 7.605 -17.086 -0.947 315 HE2 LYS 40 2HE LYS 40 5.974 -16.519 -2.450 316 HE3 LYS 40 3HE LYS 40 7.310 -15.541 -3.053 317 HZ1 LYS 40 3HZ LYS 40 7.682 -17.833 -4.383 318 HZ2 LYS 40 1HZ LYS 40 6.803 -16.520 -4.988 319 HZ3 LYS 40 2HZ LYS 40 5.994 -17.816 -4.262 320 HA PRO 41 HA PRO 41 13.383 -20.080 -4.673 321 HB2 PRO 41 2HB PRO 41 12.640 -22.601 -3.991 322 HB3 PRO 41 3HB PRO 41 14.062 -21.801 -3.311 323 HG2 PRO 41 2HG PRO 41 11.327 -22.125 -2.137 324 HG3 PRO 41 3HG PRO 41 12.909 -22.310 -1.356 325 HD2 PRO 41 2HD PRO 41 11.403 -20.077 -1.085 326 HD3 PRO 41 3HD PRO 41 13.178 -20.038 -1.078 327 H ILE 42 H ILE 42 12.448 -20.432 -6.600 328 HA ILE 42 HA ILE 42 9.527 -20.625 -6.695 329 HB ILE 42 HB ILE 42 11.454 -20.040 -8.945 330 HG12 ILE 42 2HG1 ILE 42 9.725 -18.147 -7.338 331 HG13 ILE 42 3HG1 ILE 42 11.474 -18.290 -7.202 332 HG21 ILE 42 1HG2 ILE 42 9.376 -20.984 -9.741 333 HG22 ILE 42 2HG2 ILE 42 8.452 -19.836 -8.774 334 HG23 ILE 42 3HG2 ILE 42 9.431 -19.264 -10.124 335 HD11 ILE 42 3HD1 ILE 42 11.351 -17.786 -9.791 336 HD12 ILE 42 1HD1 ILE 42 9.828 -17.032 -9.318 337 HD13 ILE 42 2HD1 ILE 42 11.342 -16.499 -8.585 338 H ASN 43 H ASN 43 12.391 -22.437 -7.323 339 HA ASN 43 HA ASN 43 11.034 -24.382 -9.001 340 HB2 ASN 43 2HB ASN 43 13.835 -23.835 -8.202 341 HB3 ASN 43 3HB ASN 43 13.431 -25.524 -8.497 342 HD21 ASN 43 1HD2 ASN 43 12.983 -26.204 -10.551 343 HD22 ASN 43 2HD2 ASN 43 13.217 -25.214 -11.948 344 H ARG 43 H ARG 43 13.067 -24.771 -6.098 345 HA ARG 43 HA ARG 43 11.901 -27.244 -5.383 346 HB2 ARG 43 2HB ARG 43 13.093 -26.893 -3.208 347 HB3 ARG 43 3HB ARG 43 14.119 -26.746 -4.629 348 HG2 ARG 43 2HG ARG 43 14.086 -24.346 -4.467 349 HG3 ARG 43 3HG ARG 43 12.926 -24.419 -3.139 350 HD2 ARG 43 2HD ARG 43 14.899 -24.138 -1.993 351 HD3 ARG 43 3HD ARG 43 14.760 -25.895 -2.007 352 HE ARG 43 HE ARG 43 16.210 -25.088 -4.265 353 HH11 ARG 43 1HH1 ARG 43 16.518 -25.212 -0.800 354 HH12 ARG 43 2HH1 ARG 43 18.243 -25.365 -0.828 355 HH21 ARG 43 1HH2 ARG 43 18.482 -25.289 -4.316 356 HH22 ARG 43 2HH2 ARG 43 19.359 -25.408 -2.828 357 H LEU 44 H LEU 44 10.775 -27.669 -3.313 358 HA LEU 44 HA LEU 44 8.722 -25.617 -2.851 359 HB2 LEU 44 2HB LEU 44 7.550 -27.663 -1.755 360 HB3 LEU 44 3HB LEU 44 7.571 -27.488 -3.508 361 HG LEU 44 HG LEU 44 9.301 -29.152 -3.704 362 HD11 LEU 44 1HD1 LEU 44 10.513 -28.570 -1.634 363 HD12 LEU 44 2HD1 LEU 44 10.236 -30.304 -1.803 364 HD13 LEU 44 3HD1 LEU 44 9.242 -29.356 -0.697 365 HD21 LEU 44 3HD2 LEU 44 6.705 -29.638 -2.810 366 HD22 LEU 44 1HD2 LEU 44 7.728 -30.713 -1.858 367 HD23 LEU 44 2HD2 LEU 44 7.784 -30.775 -3.620 368 H GLY 45 H GLY 45 11.513 -26.161 -1.573 369 HA2 GLY 45 2HA GLY 45 11.291 -26.928 1.067 370 HA3 GLY 45 3HA GLY 45 12.428 -25.719 0.488 371 H GLY 46 H GLY 46 11.866 -23.506 0.597 372 HA2 GLY 46 2HA GLY 46 9.421 -22.483 1.479 373 HA3 GLY 46 3HA GLY 46 10.403 -22.790 2.904 374 HA PRO 47 HA PRO 47 11.367 -18.599 0.915 375 HB2 PRO 47 2HB PRO 47 10.321 -17.033 2.871 376 HB3 PRO 47 3HB PRO 47 9.385 -17.580 1.475 377 HG2 PRO 47 2HG PRO 47 9.454 -18.680 4.258 378 HG3 PRO 47 3HG PRO 47 8.059 -18.401 3.200 379 HD2 PRO 47 2HD PRO 47 9.165 -20.850 3.539 380 HD3 PRO 47 3HD PRO 47 8.414 -20.345 2.012 381 H GLY 48 H GLY 48 13.106 -17.333 1.528 382 HA2 GLY 48 2HA GLY 48 14.253 -17.847 4.195 383 HA3 GLY 48 3HA GLY 48 15.247 -18.016 2.756 384 H LEU 49 H LEU 49 16.697 -16.405 3.136 385 HA LEU 49 HA LEU 49 15.688 -13.687 2.838 386 HB2 LEU 49 2HB LEU 49 16.040 -14.398 5.323 387 HB3 LEU 49 3HB LEU 49 17.748 -14.188 4.944 388 HG LEU 49 HG LEU 49 16.084 -11.907 4.178 389 HD11 LEU 49 1HD1 LEU 49 15.268 -11.245 6.184 390 HD12 LEU 49 2HD1 LEU 49 16.531 -12.068 7.098 391 HD13 LEU 49 3HD1 LEU 49 15.178 -12.987 6.441 392 HD21 LEU 49 3HD2 LEU 49 18.645 -12.360 5.686 393 HD22 LEU 49 1HD2 LEU 49 17.915 -10.763 5.516 394 HD23 LEU 49 2HD2 LEU 49 18.423 -11.658 4.083 395 H VAL 50 H VAL 50 16.926 -12.513 1.509 396 HA VAL 50 HA VAL 50 19.743 -13.218 1.155 397 HB VAL 50 HB VAL 50 18.590 -14.475 -0.588 398 HG11 VAL 50 1HG1 VAL 50 16.598 -12.956 -0.676 399 HG12 VAL 50 2HG1 VAL 50 17.570 -11.841 -1.638 400 HG13 VAL 50 3HG1 VAL 50 17.216 -13.458 -2.249 401 HG21 VAL 50 3HG2 VAL 50 20.768 -13.639 -1.149 402 HG22 VAL 50 1HG2 VAL 50 19.731 -13.475 -2.566 403 HG23 VAL 50 2HG2 VAL 50 20.104 -12.062 -1.579 404 HA PRO 51 HA PRO 51 20.080 -8.809 1.253 405 HB2 PRO 51 2HB PRO 51 22.681 -8.640 0.494 406 HB3 PRO 51 3HB PRO 51 22.184 -9.152 2.110 407 HG2 PRO 51 2HG PRO 51 23.010 -10.819 -0.235 408 HG3 PRO 51 3HG PRO 51 23.453 -10.994 1.474 409 HD2 PRO 51 2HD PRO 51 21.546 -12.516 0.300 410 HD3 PRO 51 3HD PRO 51 21.472 -12.043 2.009 411 H VAL 52 H VAL 52 20.210 -7.051 -0.162 412 HA VAL 52 HA VAL 52 19.418 -7.527 -2.828 413 HB VAL 52 HB VAL 52 20.548 -4.931 -1.791 414 HG11 VAL 52 1HG1 VAL 52 19.859 -4.054 -3.714 415 HG12 VAL 52 2HG1 VAL 52 19.551 -5.696 -4.284 416 HG13 VAL 52 3HG1 VAL 52 18.256 -4.765 -3.529 417 HG21 VAL 52 3HG2 VAL 52 18.949 -5.041 -0.219 418 HG22 VAL 52 1HG2 VAL 52 17.842 -4.689 -1.546 419 HG23 VAL 52 2HG2 VAL 52 18.103 -6.356 -1.034 420 H SER 53 H SER 53 22.510 -7.259 -1.348 421 HA SER 53 HA SER 53 23.946 -6.501 -3.714 422 HB2 SER 53 2HB SER 53 24.990 -5.903 -1.674 423 HB3 SER 53 3HB SER 53 24.789 -7.521 -1.003 424 HG SER 53 HG SER 53 26.861 -7.485 -1.649 425 H TYR 54 H TYR 54 22.380 -9.272 -2.897 426 HA TYR 54 HA TYR 54 24.185 -10.909 -4.554 427 HB2 TYR 54 2HB TYR 54 22.740 -11.606 -2.019 428 HB3 TYR 54 3HB TYR 54 23.106 -12.862 -3.197 429 HD1 TYR 54 HD1 TYR 54 24.685 -10.210 -1.123 430 HD2 TYR 54 HD2 TYR 54 25.227 -13.852 -3.255 431 HE1 TYR 54 HE1 TYR 54 26.954 -10.409 -0.195 432 HE2 TYR 54 HE2 TYR 54 27.497 -14.062 -2.332 433 HH TYR 54 HH TYR 54 28.626 -12.986 0.039 434 H VAL 55 H VAL 55 21.647 -9.248 -4.999 435 HA VAL 55 HA VAL 55 20.350 -11.220 -6.701 436 HB VAL 55 HB VAL 55 18.117 -10.768 -5.940 437 HG11 VAL 55 1HG1 VAL 55 18.132 -11.896 -3.861 438 HG12 VAL 55 2HG1 VAL 55 19.546 -12.477 -4.743 439 HG13 VAL 55 3HG1 VAL 55 19.736 -11.283 -3.457 440 HG21 VAL 55 3HG2 VAL 55 19.415 -8.536 -4.581 441 HG22 VAL 55 1HG2 VAL 55 17.743 -8.725 -5.110 442 HG23 VAL 55 2HG2 VAL 55 18.260 -9.399 -3.564 443 H ARG 56 H ARG 56 18.881 -10.234 -8.269 444 HA ARG 56 HA ARG 56 19.422 -7.373 -8.704 445 HB2 ARG 56 2HB ARG 56 20.812 -8.517 -10.267 446 HB3 ARG 56 3HB ARG 56 19.521 -9.628 -10.703 447 HG2 ARG 56 2HG ARG 56 18.278 -7.753 -11.703 448 HG3 ARG 56 3HG ARG 56 19.629 -6.684 -11.320 449 HD2 ARG 56 2HD ARG 56 20.275 -9.151 -12.815 450 HD3 ARG 56 3HD ARG 56 19.348 -7.927 -13.682 451 HE ARG 56 HE ARG 56 21.355 -6.485 -12.627 452 HH11 ARG 56 1HH1 ARG 56 21.304 -9.459 -14.438 453 HH12 ARG 56 2HH1 ARG 56 22.853 -9.194 -15.166 454 HH21 ARG 56 1HH2 ARG 56 23.396 -6.126 -13.579 455 HH22 ARG 56 2HH2 ARG 56 24.043 -7.298 -14.676 456 H ILE 57 H ILE 57 17.562 -6.325 -8.493 457 HA ILE 57 HA ILE 57 15.015 -7.521 -8.680 458 HB ILE 57 HB ILE 57 15.671 -4.581 -8.887 459 HG12 ILE 57 2HG1 ILE 57 16.643 -5.642 -6.869 460 HG13 ILE 57 3HG1 ILE 57 15.369 -4.493 -6.474 461 HG21 ILE 57 1HG2 ILE 57 13.437 -4.836 -9.525 462 HG22 ILE 57 2HG2 ILE 57 13.148 -6.106 -8.338 463 HG23 ILE 57 3HG2 ILE 57 13.353 -4.436 -7.810 464 HD11 ILE 57 3HD1 ILE 57 13.833 -6.236 -6.004 465 HD12 ILE 57 1HD1 ILE 57 14.922 -7.457 -6.661 466 HD13 ILE 57 2HD1 ILE 57 15.337 -6.618 -5.166 467 H ILE 58 H ILE 58 14.083 -8.237 -10.472 468 HA ILE 58 HA ILE 58 14.233 -6.578 -12.894 469 HB ILE 58 HB ILE 58 14.271 -8.698 -14.246 470 HG12 ILE 58 2HG1 ILE 58 15.551 -10.200 -12.073 471 HG13 ILE 58 3HG1 ILE 58 13.829 -9.929 -11.830 472 HG21 ILE 58 1HG2 ILE 58 16.822 -9.024 -13.070 473 HG22 ILE 58 2HG2 ILE 58 16.392 -8.112 -14.516 474 HG23 ILE 58 3HG2 ILE 58 16.390 -7.319 -12.941 475 HD11 ILE 58 3HD1 ILE 58 15.133 -11.824 -13.505 476 HD12 ILE 58 1HD1 ILE 58 13.412 -11.631 -13.171 477 HD13 ILE 58 2HD1 ILE 58 14.158 -10.745 -14.502 478 H ASP 59 H ASP 59 12.361 -6.367 -14.010 479 HA ASP 59 HA ASP 59 9.938 -7.203 -12.734 480 HB2 ASP 59 2HB ASP 59 10.281 -5.020 -13.973 481 HB3 ASP 59 3HB ASP 59 10.205 -5.949 -15.468 482 H LEU 60 H LEU 60 8.900 -9.055 -13.023 483 HA LEU 60 HA LEU 60 9.745 -11.137 -14.624 484 HB2 LEU 60 2HB LEU 60 7.439 -10.532 -12.989 485 HB3 LEU 60 3HB LEU 60 6.991 -11.489 -14.399 486 HG LEU 60 HG LEU 60 9.016 -12.242 -12.293 487 HD11 LEU 60 1HD1 LEU 60 7.465 -13.823 -11.530 488 HD12 LEU 60 2HD1 LEU 60 6.441 -13.636 -12.953 489 HD13 LEU 60 3HD1 LEU 60 6.527 -12.346 -11.753 490 HD21 LEU 60 3HD2 LEU 60 9.918 -13.475 -13.925 491 HD22 LEU 60 1HD2 LEU 60 8.547 -13.217 -15.004 492 HD23 LEU 60 2HD2 LEU 60 8.476 -14.482 -13.776 493 H MET 61 H MET 61 7.596 -8.485 -15.398 494 HA MET 61 HA MET 61 6.797 -9.626 -17.930 495 HB2 MET 61 2HB MET 61 6.400 -6.758 -17.122 496 HB3 MET 61 3HB MET 61 5.412 -7.743 -18.192 497 HG2 MET 61 2HG MET 61 5.642 -8.014 -15.205 498 HG3 MET 61 3HG MET 61 4.268 -7.379 -16.106 499 HE1 MET 61 3HE MET 61 3.770 -10.199 -13.995 500 HE2 MET 61 1HE MET 61 4.896 -11.408 -14.613 501 HE3 MET 61 2HE MET 61 5.486 -9.816 -14.134 502 H ASP 62 H ASP 62 9.204 -7.416 -16.730 503 HA ASP 62 HA ASP 62 10.426 -7.347 -19.378 504 HB2 ASP 62 2HB ASP 62 10.275 -4.764 -17.869 505 HB3 ASP 62 3HB ASP 62 10.524 -5.037 -19.591 506 HA PRO 63 HA PRO 63 13.446 -8.124 -15.970 507 HB2 PRO 63 2HB PRO 63 14.782 -10.074 -17.305 508 HB3 PRO 63 3HB PRO 63 13.334 -10.389 -16.341 509 HG2 PRO 63 2HG PRO 63 13.601 -10.049 -19.303 510 HG3 PRO 63 3HG PRO 63 12.646 -11.236 -18.394 511 HD2 PRO 63 2HD PRO 63 11.550 -9.016 -19.492 512 HD3 PRO 63 3HD PRO 63 10.940 -9.740 -17.990 513 H ALA 64 H ALA 64 13.528 -6.994 -19.157 514 HA ALA 64 HA ALA 64 16.417 -6.552 -19.160 515 HB1 ALA 64 1HB ALA 64 14.835 -5.453 -21.374 516 HB2 ALA 64 2HB ALA 64 16.300 -6.436 -21.400 517 HB3 ALA 64 3HB ALA 64 14.728 -7.203 -21.178 518 H LYS 65 H LYS 65 13.664 -5.013 -18.080 519 HA LYS 65 HA LYS 65 14.492 -2.306 -18.682 520 HB2 LYS 65 2HB LYS 65 12.193 -3.544 -17.209 521 HB3 LYS 65 3HB LYS 65 12.546 -1.833 -17.001 522 HG2 LYS 65 2HG LYS 65 12.577 -2.048 -19.705 523 HG3 LYS 65 3HG LYS 65 11.364 -3.256 -19.274 524 HD2 LYS 65 2HD LYS 65 10.181 -1.235 -19.568 525 HD3 LYS 65 3HD LYS 65 10.303 -1.468 -17.822 526 HE2 LYS 65 2HE LYS 65 11.717 0.292 -17.550 527 HE3 LYS 65 3HE LYS 65 12.462 0.079 -19.134 528 HZ1 LYS 65 3HZ LYS 65 9.691 1.070 -18.828 529 HZ2 LYS 65 1HZ LYS 65 10.702 1.180 -20.180 530 HZ3 LYS 65 2HZ LYS 65 11.021 2.115 -18.808 531 H TYR 66 H TYR 66 14.104 -4.270 -15.735 532 HA TYR 66 HA TYR 66 15.726 -2.330 -14.262 533 HB2 TYR 66 2HB TYR 66 14.021 -4.652 -13.353 534 HB3 TYR 66 3HB TYR 66 15.034 -3.711 -12.264 535 HD1 TYR 66 HD1 TYR 66 12.419 -3.141 -14.879 536 HD2 TYR 66 HD2 TYR 66 14.027 -1.988 -11.113 537 HE1 TYR 66 HE1 TYR 66 10.599 -1.508 -14.609 538 HE2 TYR 66 HE2 TYR 66 12.211 -0.353 -10.831 539 HH TYR 66 HH TYR 66 10.614 0.859 -12.096 540 H ALA 67 H ALA 67 16.753 -4.309 -16.270 541 HA ALA 67 HA ALA 67 18.309 -6.173 -14.691 542 HB1 ALA 67 1HB ALA 67 17.463 -6.020 -17.382 543 HB2 ALA 67 2HB ALA 67 19.228 -6.027 -17.384 544 HB3 ALA 67 3HB ALA 67 18.342 -7.325 -16.584 545 H SER 68 H SER 68 18.624 -2.974 -15.821 546 HA SER 68 HA SER 68 21.547 -3.040 -15.671 547 HB2 SER 68 2HB SER 68 19.591 -0.964 -16.658 548 HB3 SER 68 3HB SER 68 21.308 -0.621 -16.448 549 HG SER 68 HG SER 68 20.767 -1.296 -18.589 550 H VAL 69 H VAL 69 18.804 -2.206 -13.823 551 HA VAL 69 HA VAL 69 19.623 -0.087 -12.263 552 HB VAL 69 HB VAL 69 17.393 -1.235 -12.150 553 HG11 VAL 69 1HG1 VAL 69 18.363 -3.033 -10.022 554 HG12 VAL 69 2HG1 VAL 69 17.084 -3.268 -11.214 555 HG13 VAL 69 3HG1 VAL 69 18.772 -3.495 -11.674 556 HG21 VAL 69 3HG2 VAL 69 17.850 -1.168 -9.355 557 HG22 VAL 69 1HG2 VAL 69 18.885 0.052 -10.097 558 HG23 VAL 69 2HG2 VAL 69 17.145 0.083 -10.380 559 H ASP 70 H ASP 70 20.800 0.154 -10.379 560 HA ASP 70 HA ASP 70 22.747 -1.975 -9.865 561 HB2 ASP 70 2HB ASP 70 22.758 0.950 -9.093 562 HB3 ASP 70 3HB ASP 70 24.028 -0.199 -8.684 563 H THR 71 H THR 71 21.432 -3.319 -8.589 564 HA THR 71 HA THR 71 19.851 -2.613 -6.442 565 HB THR 71 HB THR 71 20.911 -4.974 -5.559 566 HG1 THR 71 HG1 THR 71 21.697 -6.107 -7.220 567 HG21 THR 71 3HG2 THR 71 18.961 -5.971 -6.383 568 HG22 THR 71 1HG2 THR 71 18.912 -4.924 -7.800 569 HG23 THR 71 2HG2 THR 71 18.521 -4.272 -6.209 570 H TYR 72 H TYR 72 23.341 -2.967 -6.591 571 HA TYR 72 HA TYR 72 23.925 -3.007 -3.863 572 HB2 TYR 72 2HB TYR 72 25.668 -3.487 -5.423 573 HB3 TYR 72 3HB TYR 72 25.479 -1.926 -6.215 574 HD1 TYR 72 HD2 TYR 72 25.665 -2.635 -2.570 575 HD2 TYR 72 HD1 TYR 72 27.595 -0.953 -5.968 576 HE1 TYR 72 HE2 TYR 72 27.400 -1.687 -1.108 577 HE2 TYR 72 HE1 TYR 72 29.337 -0.002 -4.516 578 HH TYR 72 HH TYR 72 29.106 -0.178 -1.014 579 H ASP 73 H ASP 73 23.518 -0.260 -6.068 580 HA ASP 73 HA ASP 73 24.128 1.758 -4.201 581 HB2 ASP 73 2HB ASP 73 22.722 1.659 -6.831 582 HB3 ASP 73 3HB ASP 73 22.544 3.108 -5.846 583 H ARG 74 H ARG 74 23.103 1.987 -2.322 584 HA ARG 74 HA ARG 74 20.574 1.058 -1.667 585 HB2 ARG 74 2HB ARG 74 20.759 2.291 0.341 586 HB3 ARG 74 3HB ARG 74 22.406 1.864 -0.102 587 HG2 ARG 74 2HG ARG 74 21.162 4.521 -0.757 588 HG3 ARG 74 3HG ARG 74 22.072 4.209 0.722 589 HD2 ARG 74 2HD ARG 74 23.065 4.060 -2.118 590 HD3 ARG 74 3HD ARG 74 23.559 5.199 -0.865 591 HE ARG 74 HE ARG 74 24.155 2.735 0.159 592 HH11 ARG 74 1HH1 ARG 74 24.992 4.482 -2.733 593 HH12 ARG 74 2HH1 ARG 74 26.544 3.730 -2.895 594 HH21 ARG 74 1HH2 ARG 74 26.197 1.738 -0.042 595 HH22 ARG 74 2HH2 ARG 74 27.228 2.169 -1.364 596 H GLU 75 H GLU 75 21.510 3.945 -3.339 597 HA GLU 75 HA GLU 75 19.153 5.454 -2.919 598 HB2 GLU 75 2HB GLU 75 21.391 5.540 -4.904 599 HB3 GLU 75 3HB GLU 75 19.952 6.509 -5.190 600 HG2 GLU 75 2HG GLU 75 20.264 7.686 -3.123 601 HG3 GLU 75 3HG GLU 75 21.606 6.632 -2.680 602 H GLN 76 H GLN 76 20.195 3.447 -5.673 603 HA GLN 76 HA GLN 76 17.839 3.710 -7.169 604 HB2 GLN 76 2HB GLN 76 19.713 1.340 -7.145 605 HB3 GLN 76 3HB GLN 76 18.613 1.797 -8.439 606 HG2 GLN 76 2HG GLN 76 20.058 4.059 -8.216 607 HG3 GLN 76 3HG GLN 76 21.260 2.862 -7.737 608 HE21 GLN 76 1HE2 GLN 76 22.467 3.275 -9.602 609 HE22 GLN 76 2HE2 GLN 76 21.976 2.688 -11.151 610 H VAL 77 H VAL 77 18.875 0.992 -5.102 611 HA VAL 77 HA VAL 77 16.576 -0.540 -5.275 612 HB VAL 77 HB VAL 77 18.850 -1.007 -4.073 613 HG11 VAL 77 1HG1 VAL 77 18.837 -0.759 -1.696 614 HG12 VAL 77 2HG1 VAL 77 18.482 0.818 -2.404 615 HG13 VAL 77 3HG1 VAL 77 17.181 -0.153 -1.714 616 HG21 VAL 77 3HG2 VAL 77 17.641 -2.906 -4.131 617 HG22 VAL 77 1HG2 VAL 77 17.331 -2.542 -2.434 618 HG23 VAL 77 2HG2 VAL 77 16.149 -2.092 -3.663 619 H MET 78 H MET 78 17.212 2.316 -3.359 620 HA MET 78 HA MET 78 15.002 2.071 -1.600 621 HB2 MET 78 2HB MET 78 16.977 4.146 -2.297 622 HB3 MET 78 3HB MET 78 15.435 4.756 -1.714 623 HG2 MET 78 2HG MET 78 15.702 3.208 0.255 624 HG3 MET 78 3HG MET 78 17.351 2.929 -0.299 625 HE1 MET 78 3HE MET 78 18.924 5.477 -0.882 626 HE2 MET 78 1HE MET 78 19.332 5.839 0.796 627 HE3 MET 78 2HE MET 78 19.225 4.164 0.257 628 H LYS 79 H LYS 79 15.474 4.141 -4.468 629 HA LYS 79 HA LYS 79 12.909 5.195 -4.598 630 HB2 LYS 79 2HB LYS 79 14.760 4.535 -6.898 631 HB3 LYS 79 3HB LYS 79 13.379 5.622 -6.979 632 HG2 LYS 79 2HG LYS 79 14.444 7.288 -5.846 633 HG3 LYS 79 3HG LYS 79 15.468 6.171 -4.942 634 HD2 LYS 79 2HD LYS 79 16.887 5.822 -6.816 635 HD3 LYS 79 3HD LYS 79 15.763 6.641 -7.902 636 HE2 LYS 79 2HE LYS 79 16.149 8.679 -6.338 637 HE3 LYS 79 3HE LYS 79 17.595 7.801 -5.839 638 HZ1 LYS 79 3HZ LYS 79 16.926 8.881 -8.504 639 HZ2 LYS 79 1HZ LYS 79 18.074 7.651 -8.327 640 HZ3 LYS 79 2HZ LYS 79 18.313 9.145 -7.572 641 H ILE 80 H ILE 80 14.157 2.138 -5.823 642 HA ILE 80 HA ILE 80 11.880 1.414 -7.335 643 HB ILE 80 HB ILE 80 13.953 -0.359 -6.038 644 HG12 ILE 80 2HG1 ILE 80 13.797 0.373 -8.949 645 HG13 ILE 80 3HG1 ILE 80 14.619 1.425 -7.802 646 HG21 ILE 80 1HG2 ILE 80 13.167 -1.885 -7.994 647 HG22 ILE 80 2HG2 ILE 80 12.236 -1.829 -6.498 648 HG23 ILE 80 3HG2 ILE 80 11.693 -0.920 -7.908 649 HD11 ILE 80 3HD1 ILE 80 15.732 -0.970 -7.204 650 HD12 ILE 80 1HD1 ILE 80 15.444 -1.143 -8.936 651 HD13 ILE 80 2HD1 ILE 80 16.412 0.203 -8.332 652 H ILE 81 H ILE 81 12.929 0.429 -4.073 653 HA ILE 81 HA ILE 81 10.663 -1.115 -3.472 654 HB ILE 81 HB ILE 81 12.565 0.338 -1.634 655 HG12 ILE 81 2HG1 ILE 81 12.369 -2.609 -2.273 656 HG13 ILE 81 3HG1 ILE 81 13.449 -1.506 -3.120 657 HG21 ILE 81 1HG2 ILE 81 11.445 -1.765 -0.226 658 HG22 ILE 81 2HG2 ILE 81 11.094 -0.052 -0.009 659 HG23 ILE 81 3HG2 ILE 81 10.077 -1.032 -1.064 660 HD11 ILE 81 3HD1 ILE 81 13.662 -1.439 -0.198 661 HD12 ILE 81 1HD1 ILE 81 14.131 -2.963 -0.952 662 HD13 ILE 81 2HD1 ILE 81 14.919 -1.460 -1.434 663 H ASP 82 H ASP 82 11.324 2.318 -3.112 664 HA ASP 82 HA ASP 82 9.033 2.914 -1.537 665 HB2 ASP 82 2HB ASP 82 11.178 4.321 -1.909 666 HB3 ASP 82 3HB ASP 82 10.366 4.897 -3.362 667 H GLU 83 H GLU 83 9.727 3.198 -5.012 668 HA GLU 83 HA GLU 83 7.212 4.239 -5.741 669 HB2 GLU 83 2HB GLU 83 9.391 2.821 -7.246 670 HB3 GLU 83 3HB GLU 83 7.873 3.221 -8.037 671 HG2 GLU 83 2HG GLU 83 9.533 5.277 -6.617 672 HG3 GLU 83 3HG GLU 83 9.782 4.860 -8.311 673 H PHE 84 H PHE 84 8.479 0.916 -5.816 674 HA PHE 84 HA PHE 84 6.071 -0.253 -6.747 675 HB2 PHE 84 2HB PHE 84 8.587 -1.305 -5.506 676 HB3 PHE 84 3HB PHE 84 7.201 -2.374 -5.695 677 HD1 PHE 84 HD2 PHE 84 9.170 0.083 -7.699 678 HD2 PHE 84 HD1 PHE 84 7.077 -3.623 -7.612 679 HE1 PHE 84 HE2 PHE 84 9.817 -0.334 -10.036 680 HE2 PHE 84 HE1 PHE 84 7.722 -4.046 -9.948 681 HZ PHE 84 HZ PHE 84 9.092 -2.400 -11.164 682 H LYS 85 H LYS 85 6.976 0.988 -3.732 683 HA LYS 85 HA LYS 85 5.982 1.026 -1.687 684 HB2 LYS 85 2HB LYS 85 3.607 -0.128 -3.160 685 HB3 LYS 85 3HB LYS 85 3.570 0.639 -1.578 686 HG2 LYS 85 2HG LYS 85 4.662 2.203 -3.850 687 HG3 LYS 85 3HG LYS 85 2.918 1.938 -3.782 688 HD2 LYS 85 2HD LYS 85 3.012 2.779 -1.399 689 HD3 LYS 85 3HD LYS 85 4.672 3.278 -1.733 690 HE2 LYS 85 2HE LYS 85 3.356 5.192 -2.108 691 HE3 LYS 85 3HE LYS 85 3.729 4.561 -3.711 692 HZ1 LYS 85 3HZ LYS 85 1.399 3.318 -3.021 693 HZ2 LYS 85 1HZ LYS 85 1.553 4.633 -4.074 694 HZ3 LYS 85 2HZ LYS 85 1.193 4.894 -2.442 695 H ILE 86 H ILE 86 7.665 -0.962 -1.781 696 HA ILE 86 HA ILE 86 6.361 -3.486 -1.170 697 HB ILE 86 HB ILE 86 9.309 -2.864 -1.030 698 HG12 ILE 86 2HG1 ILE 86 7.742 -3.986 -3.362 699 HG13 ILE 86 3HG1 ILE 86 8.375 -2.346 -3.272 700 HG21 ILE 86 1HG2 ILE 86 9.662 -5.066 -0.699 701 HG22 ILE 86 2HG2 ILE 86 8.011 -5.026 -0.083 702 HG23 ILE 86 3HG2 ILE 86 8.321 -5.546 -1.739 703 HD11 ILE 86 3HD1 ILE 86 9.978 -4.890 -3.318 704 HD12 ILE 86 1HD1 ILE 86 9.821 -3.711 -4.620 705 HD13 ILE 86 2HD1 ILE 86 10.652 -3.272 -3.127 706 HA PRO 87 HA PRO 87 6.224 -2.575 3.175 707 HB2 PRO 87 2HB PRO 87 5.406 -5.038 3.973 708 HB3 PRO 87 3HB PRO 87 4.321 -3.863 3.220 709 HG2 PRO 87 2HG PRO 87 5.721 -6.207 1.992 710 HG3 PRO 87 3HG PRO 87 4.052 -5.655 1.763 711 HD2 PRO 87 2HD PRO 87 6.017 -5.130 -0.023 712 HD3 PRO 87 3HD PRO 87 4.666 -4.015 0.265 713 H THR 88 H THR 88 7.206 -3.367 5.163 714 HA THR 88 HA THR 88 9.827 -4.554 4.641 715 HB THR 88 HB THR 88 9.253 -3.668 7.384 716 HG1 THR 88 HG1 THR 88 8.090 -2.049 6.383 717 HG21 THR 88 3HG2 THR 88 11.403 -2.330 6.769 718 HG22 THR 88 1HG2 THR 88 11.431 -3.378 5.352 719 HG23 THR 88 2HG2 THR 88 11.496 -4.079 6.969 720 H VAL 89 H VAL 89 10.689 -5.923 6.540 721 HA VAL 89 HA VAL 89 9.370 -8.342 6.626 722 HB VAL 89 HB VAL 89 11.292 -7.214 8.665 723 HG11 VAL 89 1HG1 VAL 89 9.778 -9.660 8.664 724 HG12 VAL 89 2HG1 VAL 89 11.507 -10.001 8.578 725 HG13 VAL 89 3HG1 VAL 89 10.866 -9.016 9.893 726 HG21 VAL 89 3HG2 VAL 89 13.003 -8.365 7.447 727 HG22 VAL 89 1HG2 VAL 89 11.813 -9.109 6.380 728 HG23 VAL 89 2HG2 VAL 89 12.098 -7.370 6.307 729 H GLU 90 H GLU 90 9.454 -5.888 9.214 730 HA GLU 90 HA GLU 90 7.809 -7.119 11.046 731 HB2 GLU 90 2HB GLU 90 8.202 -4.212 10.372 732 HB3 GLU 90 3HB GLU 90 7.135 -4.718 11.675 733 HG2 GLU 90 2HG GLU 90 9.235 -6.068 12.459 734 HG3 GLU 90 3HG GLU 90 10.098 -4.886 11.476 735 H GLN 91 H GLN 91 6.847 -5.010 8.353 736 HA GLN 91 HA GLN 91 4.082 -5.079 8.859 737 HB2 GLN 91 2HB GLN 91 5.329 -4.796 6.129 738 HB3 GLN 91 3HB GLN 91 3.800 -4.134 6.693 739 HG2 GLN 91 2HG GLN 91 6.577 -3.259 7.416 740 HG3 GLN 91 3HG GLN 91 5.319 -2.337 6.596 741 HE21 GLN 91 1HE2 GLN 91 6.880 -1.878 9.099 742 HE22 GLN 91 2HE2 GLN 91 5.689 -1.571 10.312 743 H TRP 92 H TRP 92 6.162 -7.125 6.860 744 HA TRP 92 HA TRP 92 4.097 -8.669 5.712 745 HB2 TRP 92 2HB TRP 92 6.412 -8.573 4.829 746 HB3 TRP 92 3HB TRP 92 6.966 -9.475 6.237 747 HD1 TRP 92 HD1 TRP 92 4.172 -10.072 3.588 748 HE1 TRP 92 HE1 TRP 92 4.325 -12.528 2.833 749 HE3 TRP 92 HE3 TRP 92 8.119 -11.565 6.475 750 HZ2 TRP 92 HZ2 TRP 92 5.909 -14.798 3.388 751 HZ3 TRP 92 HZ3 TRP 92 8.890 -13.896 6.304 752 HH2 TRP 92 HH2 TRP 92 7.807 -15.477 4.792 753 H LYS 93 H LYS 93 6.012 -9.050 8.654 754 HA LYS 93 HA LYS 93 5.088 -11.625 9.341 755 HB2 LYS 93 2HB LYS 93 6.030 -9.436 11.200 756 HB3 LYS 93 3HB LYS 93 5.963 -11.155 11.563 757 HG2 LYS 93 2HG LYS 93 7.542 -10.422 9.192 758 HG3 LYS 93 3HG LYS 93 8.179 -9.870 10.742 759 HD2 LYS 93 2HD LYS 93 9.138 -11.928 10.710 760 HD3 LYS 93 3HD LYS 93 7.584 -12.387 11.410 761 HE2 LYS 93 2HE LYS 93 7.362 -12.362 8.562 762 HE3 LYS 93 3HE LYS 93 8.772 -13.316 9.021 763 HZ1 LYS 93 3HZ LYS 93 6.588 -13.934 10.706 764 HZ2 LYS 93 1HZ LYS 93 7.458 -14.955 9.674 765 HZ3 LYS 93 2HZ LYS 93 6.121 -14.101 9.088 766 H ASP 94 H ASP 94 4.029 -8.396 10.394 767 HA ASP 94 HA ASP 94 1.948 -9.284 12.068 768 HB2 ASP 94 2HB ASP 94 2.978 -6.965 11.992 769 HB3 ASP 94 3HB ASP 94 1.984 -6.664 10.569 770 H GLN 95 H GLN 95 2.059 -8.526 8.631 771 HA GLN 95 HA GLN 95 -0.712 -8.588 8.140 772 HB2 GLN 95 2HB GLN 95 1.697 -9.030 6.393 773 HB3 GLN 95 3HB GLN 95 0.064 -9.179 5.757 774 HG2 GLN 95 2HG GLN 95 -0.346 -6.946 5.888 775 HG3 GLN 95 3HG GLN 95 0.744 -6.713 7.254 776 HE21 GLN 95 1HE2 GLN 95 1.629 -4.904 6.184 777 HE22 GLN 95 2HE2 GLN 95 2.760 -5.095 4.892 778 H THR 96 H THR 96 1.763 -11.115 7.718 779 HA THR 96 HA THR 96 0.019 -13.149 6.894 780 HB THR 96 HB THR 96 1.902 -14.646 7.993 781 HG1 THR 96 HG1 THR 96 3.342 -13.447 8.970 782 HG21 THR 96 3HG2 THR 96 1.497 -14.312 5.573 783 HG22 THR 96 1HG2 THR 96 3.212 -14.424 5.966 784 HG23 THR 96 2HG2 THR 96 2.484 -12.852 5.633 785 H ARG 97 H ARG 97 1.179 -12.255 10.124 786 HA ARG 97 HA ARG 97 0.039 -14.360 11.559 787 HB2 ARG 97 2HB ARG 97 0.887 -11.578 12.235 788 HB3 ARG 97 3HB ARG 97 -0.056 -12.477 13.415 789 HG2 ARG 97 2HG ARG 97 2.284 -13.846 12.226 790 HG3 ARG 97 3HG ARG 97 2.596 -12.530 13.360 791 HD2 ARG 97 2HD ARG 97 0.870 -13.741 14.862 792 HD3 ARG 97 3HD ARG 97 1.178 -15.128 13.818 793 HE ARG 97 HE ARG 97 2.899 -14.089 15.848 794 HH11 ARG 97 1HH1 ARG 97 2.833 -15.760 12.795 795 HH12 ARG 97 2HH1 ARG 97 4.355 -16.549 13.046 796 HH21 ARG 97 1HH2 ARG 97 4.904 -15.121 16.190 797 HH22 ARG 97 2HH2 ARG 97 5.532 -16.186 14.977 798 H ARG 98 H ARG 98 -1.264 -11.065 11.118 799 HA ARG 98 HA ARG 98 -3.763 -11.601 12.288 800 HB2 ARG 98 2HB ARG 98 -4.458 -9.487 11.447 801 HB3 ARG 98 3HB ARG 98 -2.752 -9.331 11.847 802 HG2 ARG 98 2HG ARG 98 -2.150 -9.538 9.515 803 HG3 ARG 98 3HG ARG 98 -3.838 -9.809 9.080 804 HD2 ARG 98 2HD ARG 98 -4.311 -7.544 10.132 805 HD3 ARG 98 3HD ARG 98 -2.564 -7.301 10.141 806 HE ARG 98 HE ARG 98 -3.200 -8.023 7.564 807 HH11 ARG 98 1HH1 ARG 98 -4.095 -5.476 9.762 808 HH12 ARG 98 2HH1 ARG 98 -4.377 -4.315 8.508 809 HH21 ARG 98 1HH2 ARG 98 -3.568 -6.504 5.904 810 HH22 ARG 98 2HH2 ARG 98 -4.078 -4.901 6.313 811 H TYR 99 H TYR 99 -2.520 -12.143 9.086 812 HA TYR 99 HA TYR 99 -4.986 -12.416 7.730 813 HB2 TYR 99 2HB TYR 99 -2.861 -12.086 6.547 814 HB3 TYR 99 3HB TYR 99 -2.300 -13.659 7.102 815 HD1 TYR 99 HD1 TYR 99 -5.435 -12.390 5.495 816 HD2 TYR 99 HD2 TYR 99 -2.261 -15.223 5.416 817 HE1 TYR 99 HE1 TYR 99 -6.429 -13.440 3.506 818 HE2 TYR 99 HE2 TYR 99 -3.246 -16.280 3.426 819 HH TYR 99 HH TYR 99 -6.163 -14.962 1.899 820 H LYS 100 H LYS 100 -2.834 -14.779 9.271 821 HA LYS 100 HA LYS 100 -4.230 -17.098 8.609 822 HB2 LYS 100 2HB LYS 100 -2.413 -16.354 10.875 823 HB3 LYS 100 3HB LYS 100 -3.219 -17.917 10.877 824 HG2 LYS 100 2HG LYS 100 -1.942 -18.733 9.205 825 HG3 LYS 100 3HG LYS 100 -1.822 -17.173 8.387 826 HD2 LYS 100 2HD LYS 100 0.352 -17.658 9.171 827 HD3 LYS 100 3HD LYS 100 -0.301 -16.454 10.284 828 HE2 LYS 100 2HE LYS 100 0.467 -17.909 11.836 829 HE3 LYS 100 3HE LYS 100 -1.087 -18.687 11.539 830 HZ1 LYS 100 3HZ LYS 100 1.368 -19.852 11.301 831 HZ2 LYS 100 1HZ LYS 100 0.922 -19.545 9.698 832 HZ3 LYS 100 2HZ LYS 100 -0.087 -20.466 10.695 833 H GLU 101 H GLU 101 -4.946 -14.627 10.927 834 HA GLU 101 HA GLU 101 -6.674 -16.096 12.611 835 HB2 GLU 101 2HB GLU 101 -6.744 -13.141 11.976 836 HB3 GLU 101 3HB GLU 101 -7.497 -13.922 13.359 837 HG2 GLU 101 2HG GLU 101 -4.539 -13.829 12.813 838 HG3 GLU 101 3HG GLU 101 -5.406 -12.788 13.941 839 H SER 102 H SER 102 -9.069 -14.895 12.731 840 HA SER 102 HA SER 102 -11.181 -15.029 11.892 841 HB2 SER 102 2HB SER 102 -9.827 -13.293 10.298 842 HB3 SER 102 3HB SER 102 -10.368 -14.474 9.105 843 HG SER 102 HG SER 102 -11.813 -12.610 9.722 844 H SER 103 H SER 103 -9.671 -17.444 11.960 845 HA SER 103 HA SER 103 -9.847 -18.960 9.607 846 HB2 SER 103 2HB SER 103 -9.874 -19.799 12.512 847 HB3 SER 103 3HB SER 103 -9.780 -20.940 11.171 848 HG SER 103 HG SER 103 -7.918 -19.367 10.571 849 H ILE 104 H ILE 104 -11.489 -19.920 8.591 850 HA ILE 104 HA ILE 104 -13.560 -20.750 8.124 851 HB ILE 104 HB ILE 104 -14.187 -20.644 11.069 852 HG12 ILE 104 2HG1 ILE 104 -12.939 -22.977 9.616 853 HG13 ILE 104 3HG1 ILE 104 -11.992 -21.808 10.530 854 HG21 ILE 104 1HG2 ILE 104 -16.153 -21.231 10.083 855 HG22 ILE 104 2HG2 ILE 104 -15.364 -21.940 8.675 856 HG23 ILE 104 3HG2 ILE 104 -15.414 -22.828 10.198 857 HD11 ILE 104 3HD1 ILE 104 -13.048 -24.120 11.515 858 HD12 ILE 104 1HD1 ILE 104 -12.534 -22.736 12.479 859 HD13 ILE 104 2HD1 ILE 104 -14.230 -22.916 12.029 860 H GLN 105 H GLN 105 -12.921 -17.824 8.609 861 HA GLN 105 HA GLN 105 -15.716 -16.906 8.698 862 HB2 GLN 105 2HB GLN 105 -13.550 -15.077 9.620 863 HB3 GLN 105 3HB GLN 105 -15.242 -15.140 10.096 864 HG2 GLN 105 2HG GLN 105 -13.108 -17.094 10.924 865 HG3 GLN 105 3HG GLN 105 -13.763 -15.793 11.917 866 HE21 GLN 105 1HE2 GLN 105 -13.894 -18.167 13.014 867 HE22 GLN 105 2HE2 GLN 105 -15.490 -18.826 12.962 868 H ILE 106 H ILE 106 -15.382 -14.289 8.042 869 HA ILE 106 HA ILE 106 -13.932 -14.330 5.482 870 HB ILE 106 HB ILE 106 -16.659 -13.096 5.872 871 HG12 ILE 106 2HG1 ILE 106 -16.644 -15.210 3.949 872 HG13 ILE 106 3HG1 ILE 106 -15.953 -15.821 5.448 873 HG21 ILE 106 1HG2 ILE 106 -15.428 -11.923 4.203 874 HG22 ILE 106 2HG2 ILE 106 -14.879 -13.428 3.467 875 HG23 ILE 106 3HG2 ILE 106 -16.579 -12.969 3.371 876 HD11 ILE 106 3HD1 ILE 106 -18.400 -16.150 5.236 877 HD12 ILE 106 1HD1 ILE 106 -17.919 -15.236 6.666 878 HD13 ILE 106 2HD1 ILE 106 -18.594 -14.397 5.269 879 H GLY 107 H GLY 107 -15.844 -12.042 7.453 880 HA2 GLY 107 2HA GLY 107 -15.193 -10.046 8.430 881 HA3 GLY 107 3HA GLY 107 -13.541 -10.383 7.934 882 H ASN 108 H ASN 108 -12.973 -8.484 7.014 883 HA ASN 108 HA ASN 108 -14.684 -7.469 4.843 884 HB2 ASN 108 2HB ASN 108 -13.235 -5.345 5.207 885 HB3 ASN 108 3HB ASN 108 -14.506 -5.712 6.370 886 HD21 ASN 108 1HD2 ASN 108 -11.137 -5.370 5.839 887 HD22 ASN 108 2HD2 ASN 108 -10.628 -5.619 7.471 888 H GLY 109 H GLY 109 -13.770 -6.935 2.856 889 HA2 GLY 109 2HA GLY 109 -11.247 -6.671 2.002 890 HA3 GLY 109 3HA GLY 109 -11.346 -8.411 2.228 891 H HIS 110 H HIS 110 -14.182 -8.496 1.454 892 HA HIS 110 HA HIS 110 -13.762 -8.686 -1.394 893 HB2 HIS 110 2HB HIS 110 -15.117 -10.287 0.165 894 HB3 HIS 110 3HB HIS 110 -16.417 -9.123 -0.067 895 HD1 HIS 110 HD1 HIS 110 -15.215 -12.157 -1.431 896 HD2 HIS 110 HD2 HIS 110 -16.773 -8.667 -3.061 897 HE1 HIS 110 HE1 HIS 110 -15.990 -12.781 -3.741 898 H GLY 111 H GLY 111 -15.803 -6.785 0.797 899 HA2 GLY 111 2HA GLY 111 -16.817 -4.744 0.500 900 HA3 GLY 111 3HA GLY 111 -15.813 -4.535 -0.927 901 H GLN 112 H GLN 112 -17.265 -3.785 -2.376 902 HA GLN 112 HA GLN 112 -19.437 -5.617 -3.113 903 HB2 GLN 112 2HB GLN 112 -21.027 -3.869 -3.318 904 HB3 GLN 112 3HB GLN 112 -20.274 -3.662 -1.743 905 HG2 GLN 112 2HG GLN 112 -18.702 -2.024 -2.992 906 HG3 GLN 112 3HG GLN 112 -19.975 -2.014 -4.212 907 HE21 GLN 112 1HE2 GLN 112 -19.770 -1.900 -0.666 908 HE22 GLN 112 2HE2 GLN 112 -20.860 -0.574 -0.477 909 H SER 113 H SER 113 -20.361 -5.003 -5.313 910 HA SER 113 HA SER 113 -18.124 -4.268 -7.081 911 HB2 SER 113 2HB SER 113 -20.551 -5.919 -7.809 912 HB3 SER 113 3HB SER 113 -19.087 -5.691 -8.766 913 HG SER 113 HG SER 113 -18.988 -6.819 -6.182 914 H GLN 114 H GLN 114 -19.230 -3.695 -9.395 915 HA GLN 114 HA GLN 114 -20.668 -1.230 -8.857 916 HB2 GLN 114 2HB GLN 114 -19.274 -2.377 -11.254 917 HB3 GLN 114 3HB GLN 114 -20.373 -1.016 -11.433 918 HG2 GLN 114 2HG GLN 114 -17.893 -1.107 -9.730 919 HG3 GLN 114 3HG GLN 114 -18.100 -0.237 -11.249 920 HE21 GLN 114 1HE2 GLN 114 -20.485 0.962 -10.985 921 HE22 GLN 114 2HE2 GLN 114 -20.471 2.074 -9.663 922 H GLY 115 H GLY 115 -21.063 -3.779 -11.328 923 HA2 GLY 115 2HA GLY 115 -22.964 -4.845 -12.079 924 HA3 GLY 115 3HA GLY 115 -23.815 -4.198 -10.684 925 H LEU 116 H LEU 116 -23.211 -3.888 -14.040 926 HA LEU 116 HA LEU 116 -24.533 -1.287 -14.192 927 HB2 LEU 116 2HB LEU 116 -23.360 -2.985 -16.389 928 HB3 LEU 116 3HB LEU 116 -23.941 -1.329 -16.549 929 HG LEU 116 HG LEU 116 -21.583 -2.165 -14.864 930 HD11 LEU 116 1HD1 LEU 116 -20.595 -0.625 -16.873 931 HD12 LEU 116 2HD1 LEU 116 -21.845 -1.541 -17.715 932 HD13 LEU 116 3HD1 LEU 116 -20.565 -2.388 -16.847 933 HD21 LEU 116 3HD2 LEU 116 -21.229 0.432 -15.255 934 HD22 LEU 116 1HD2 LEU 116 -22.193 -0.187 -13.914 935 HD23 LEU 116 2HD2 LEU 116 -22.989 0.400 -15.374 936 H GLU 117 H GLU 117 -25.948 -1.269 -16.410 937 HA GLU 117 HA GLU 117 -28.257 -2.835 -15.749 938 HB2 GLU 117 2HB GLU 117 -29.319 -1.672 -17.633 939 HB3 GLU 117 3HB GLU 117 -28.504 -0.547 -16.556 940 HG2 GLU 117 2HG GLU 117 -26.889 -0.028 -18.088 941 HG3 GLU 117 3HG GLU 117 -27.027 -1.575 -18.922 942 H1 GLY -9 H GLY -9 6.999 -11.548 15.274 943 HA2 GLY -9 2HA GLY -9 8.483 -10.555 12.945 944 HA3 GLY -9 3HA GLY -9 9.283 -10.544 14.510 945 H LYS -8 H LYS -8 10.381 -11.935 12.428 946 HA LYS -8 HA LYS -8 10.473 -14.587 13.527 947 HB2 LYS -8 2HB LYS -8 8.544 -14.280 11.651 948 HB3 LYS -8 3HB LYS -8 9.914 -14.684 10.625 949 HG2 LYS -8 2HG LYS -8 9.129 -16.343 13.002 950 HG3 LYS -8 3HG LYS -8 8.464 -16.605 11.388 951 HD2 LYS -8 2HD LYS -8 11.360 -16.383 11.363 952 HD3 LYS -8 3HD LYS -8 10.800 -17.693 12.404 953 HE2 LYS -8 2HE LYS -8 9.554 -17.424 9.723 954 HE3 LYS -8 3HE LYS -8 11.210 -18.023 9.800 955 HZ1 LYS -8 3HZ LYS -8 10.336 -20.001 10.232 956 HZ2 LYS -8 1HZ LYS -8 8.782 -19.363 10.432 957 HZ3 LYS -8 2HZ LYS -8 9.852 -19.409 11.741 958 H PHE -7 H PHE -7 11.208 -12.964 10.432 959 HA PHE -7 HA PHE -7 13.852 -14.147 10.409 960 HB2 PHE -7 2HB PHE -7 12.429 -12.313 8.474 961 HB3 PHE -7 3HB PHE -7 14.064 -12.916 8.226 962 HD1 PHE -7 HD1 PHE -7 10.591 -14.100 8.843 963 HD2 PHE -7 HD2 PHE -7 14.389 -14.905 7.099 964 HE1 PHE -7 HE1 PHE -7 9.676 -16.130 7.797 965 HE2 PHE -7 HE2 PHE -7 13.480 -16.936 6.049 966 HZ PHE -7 HZ PHE -7 11.121 -17.551 6.397 967 H ILE -6 H ILE -6 13.017 -10.816 9.552 968 HA ILE -6 HA ILE -6 14.154 -8.866 9.928 969 HB ILE -6 HB ILE -6 14.133 -9.957 12.744 970 HG12 ILE -6 2HG1 ILE -6 12.153 -8.206 11.270 971 HG13 ILE -6 3HG1 ILE -6 11.897 -9.880 11.750 972 HG21 ILE -6 1HG2 ILE -6 15.168 -8.100 13.374 973 HG22 ILE -6 2HG2 ILE -6 15.320 -7.618 11.686 974 HG23 ILE -6 3HG2 ILE -6 13.908 -7.124 12.619 975 HD11 ILE -6 3HD1 ILE -6 11.526 -7.452 13.254 976 HD12 ILE -6 1HD1 ILE -6 10.975 -9.091 13.600 977 HD13 ILE -6 2HD1 ILE -6 12.587 -8.578 14.099 978 HA PRO -5 HA PRO -5 18.354 -10.733 9.793 979 HB2 PRO -5 2HB PRO -5 19.185 -9.221 7.697 980 HB3 PRO -5 3HB PRO -5 18.283 -10.728 7.497 981 HG2 PRO -5 2HG PRO -5 17.296 -7.903 7.403 982 HG3 PRO -5 3HG PRO -5 16.890 -9.266 6.343 983 HD2 PRO -5 2HD PRO -5 15.269 -8.451 8.353 984 HD3 PRO -5 3HD PRO -5 15.382 -10.149 7.846 985 H SER -4 H SER -4 19.866 -9.975 11.124 986 HA SER -4 HA SER -4 20.092 -7.059 11.482 987 HB2 SER -4 2HB SER -4 21.096 -9.007 13.526 988 HB3 SER -4 3HB SER -4 20.528 -7.352 13.745 989 HG SER -4 HG SER -4 19.152 -9.627 13.970 990 H ARG -3 H ARG -3 21.554 -9.542 9.980 991 HA ARG -3 HA ARG -3 24.218 -9.551 10.671 992 HB2 ARG -3 2HB ARG -3 22.668 -10.155 8.259 993 HB3 ARG -3 3HB ARG -3 24.325 -9.672 7.925 994 HG2 ARG -3 2HG ARG -3 24.108 -12.092 8.131 995 HG3 ARG -3 3HG ARG -3 25.153 -11.425 9.387 996 HD2 ARG -3 2HD ARG -3 23.380 -11.570 11.008 997 HD3 ARG -3 3HD ARG -3 22.233 -12.067 9.765 998 HE ARG -3 HE ARG -3 24.404 -13.869 9.857 999 HH11 ARG -3 1HH1 ARG -3 21.565 -12.928 11.638 1000 HH12 ARG -3 2HH1 ARG -3 21.341 -14.487 12.360 1001 HH21 ARG -3 1HH2 ARG -3 24.120 -15.927 10.801 1002 HH22 ARG -3 2HH2 ARG -3 22.795 -16.192 11.884 1003 HA PRO -2 HA PRO -2 26.021 -5.690 9.628 1004 HB2 PRO -2 2HB PRO -2 28.343 -6.397 8.412 1005 HB3 PRO -2 3HB PRO -2 28.068 -6.594 10.147 1006 HG2 PRO -2 2HG PRO -2 27.874 -8.625 7.957 1007 HG3 PRO -2 3HG PRO -2 28.594 -8.784 9.569 1008 HD2 PRO -2 2HD PRO -2 26.130 -9.735 8.974 1009 HD3 PRO -2 3HD PRO -2 26.553 -9.121 10.585 1010 H ALA -1 H ALA -1 25.291 -7.920 7.108 1011 HA ALA -1 HA ALA -1 24.711 -7.649 4.924 1012 HB1 ALA -1 1HB ALA -1 24.747 -4.675 5.280 1013 HB2 ALA -1 2HB ALA -1 23.696 -5.664 4.266 1014 HB3 ALA -1 3HB ALA -1 23.484 -5.662 6.017 1015 HA PRO 0 HA PRO 0 29.099 -6.820 3.831 1016 HB2 PRO 0 2HB PRO 0 29.342 -9.024 2.264 1017 HB3 PRO 0 3HB PRO 0 29.568 -9.062 4.017 1018 HG2 PRO 0 2HG PRO 0 27.170 -9.831 2.398 1019 HG3 PRO 0 3HG PRO 0 27.894 -10.660 3.789 1020 HD2 PRO 0 2HD PRO 0 25.695 -9.095 4.008 1021 HD3 PRO 0 3HD PRO 0 26.891 -9.250 5.311 1022 H LYS 1 H LYS 1 29.758 -5.703 2.083 1023 HA LYS 1 HA LYS 1 27.879 -4.998 0.061 1024 HB2 LYS 1 2HB LYS 1 30.705 -4.305 0.697 1025 HB3 LYS 1 3HB LYS 1 30.138 -3.996 -0.939 1026 HG2 LYS 1 2HG LYS 1 29.620 -2.001 -0.001 1027 HG3 LYS 1 3HG LYS 1 28.129 -2.869 0.372 1028 HD2 LYS 1 2HD LYS 1 28.668 -3.107 2.602 1029 HD3 LYS 1 3HD LYS 1 30.402 -2.969 2.305 1030 HE2 LYS 1 2HE LYS 1 30.195 -0.604 1.909 1031 HE3 LYS 1 3HE LYS 1 28.438 -0.700 2.008 1032 HZ1 LYS 1 3HZ LYS 1 30.416 -0.671 4.136 1033 HZ2 LYS 1 1HZ LYS 1 29.109 -1.721 4.363 1034 HZ3 LYS 1 2HZ LYS 1 28.835 -0.070 4.118 1035 HA PRO 2 HA PRO 2 28.700 -7.888 -3.136 1036 HB2 PRO 2 2HB PRO 2 28.655 -6.334 -5.362 1037 HB3 PRO 2 3HB PRO 2 27.201 -6.734 -4.439 1038 HG2 PRO 2 2HG PRO 2 28.861 -4.244 -4.373 1039 HG3 PRO 2 3HG PRO 2 27.096 -4.412 -4.376 1040 HD2 PRO 2 2HD PRO 2 28.509 -3.923 -2.119 1041 HD3 PRO 2 3HD PRO 2 27.011 -4.875 -2.119 1042 HA PRO 3 HA PRO 3 32.933 -8.038 -4.316 1043 HB2 PRO 3 2HB PRO 3 32.833 -9.210 -6.763 1044 HB3 PRO 3 3HB PRO 3 32.507 -10.087 -5.264 1045 HG2 PRO 3 2HG PRO 3 30.578 -8.922 -7.234 1046 HG3 PRO 3 3HG PRO 3 30.524 -10.491 -6.409 1047 HD2 PRO 3 2HD PRO 3 29.054 -8.366 -5.597 1048 HD3 PRO 3 3HD PRO 3 29.682 -9.581 -4.465 1049 H SER 4 H SER 4 30.701 -6.486 -6.513 1050 HA SER 4 HA SER 4 32.762 -5.297 -8.139 1051 HB2 SER 4 2HB SER 4 29.798 -4.695 -7.985 1052 HB3 SER 4 3HB SER 4 30.903 -4.092 -9.220 1053 HG SER 4 HG SER 4 29.811 -6.623 -8.886 1054 H SER 5 H SER 5 33.822 -4.468 -6.083 1055 HA SER 5 HA SER 5 32.637 -1.928 -5.204 1056 HB2 SER 5 2HB SER 5 34.882 -3.547 -3.976 1057 HB3 SER 5 3HB SER 5 34.225 -2.048 -3.320 1058 HG SER 5 HG SER 5 32.940 -4.555 -3.587 1059 H ALA 6 H ALA 6 35.592 -3.356 -6.507 1060 HA ALA 6 HA ALA 6 37.420 -2.453 -7.523 1061 HB1 ALA 6 1HB ALA 6 35.603 -0.164 -8.245 1062 HB2 ALA 6 2HB ALA 6 37.025 -0.737 -9.118 1063 HB3 ALA 6 3HB ALA 6 35.568 -1.729 -9.058 Start of MODEL 20 1 H1 MET -2 H MET -2 0.856 2.842 -6.255 2 HA MET -2 HA MET -2 3.604 1.815 -6.045 3 HB2 MET -2 2HB MET -2 1.819 1.045 -4.253 4 HB3 MET -2 3HB MET -2 1.306 -0.026 -5.550 5 HG2 MET -2 2HG MET -2 4.181 0.100 -4.756 6 HG3 MET -2 3HG MET -2 3.034 -0.848 -3.812 7 HE1 MET -2 3HE MET -2 4.969 -3.467 -5.358 8 HE2 MET -2 1HE MET -2 5.690 -2.243 -6.404 9 HE3 MET -2 2HE MET -2 5.405 -1.889 -4.700 10 H ALA -1 H ALA -1 4.312 0.637 -7.748 11 HA ALA -1 HA ALA -1 2.359 -0.160 -9.795 12 HB1 ALA -1 1HB ALA -1 3.081 1.533 -11.063 13 HB2 ALA -1 2HB ALA -1 4.501 1.807 -10.053 14 HB3 ALA -1 3HB ALA -1 4.532 0.557 -11.297 15 HA PRO 1 HA PRO 1 4.526 -3.968 -10.044 16 HB2 PRO 1 2HB PRO 1 4.406 -4.535 -12.696 17 HB3 PRO 1 3HB PRO 1 2.999 -4.623 -11.631 18 HG2 PRO 1 2HG PRO 1 3.818 -2.442 -13.510 19 HG3 PRO 1 3HG PRO 1 2.208 -3.126 -13.225 20 HD2 PRO 1 2HD PRO 1 3.009 -0.783 -12.131 21 HD3 PRO 1 3HD PRO 1 1.879 -1.881 -11.313 22 H LEU 2 H LEU 2 6.649 -4.176 -9.747 23 HA LEU 2 HA LEU 2 8.471 -3.019 -11.754 24 HB2 LEU 2 2HB LEU 2 9.921 -2.347 -10.135 25 HB3 LEU 2 3HB LEU 2 8.400 -2.192 -9.259 26 HG LEU 2 HG LEU 2 9.082 -4.715 -8.588 27 HD11 LEU 2 1HD1 LEU 2 11.507 -3.433 -9.583 28 HD12 LEU 2 2HD1 LEU 2 11.175 -5.132 -9.246 29 HD13 LEU 2 3HD1 LEU 2 11.657 -4.052 -7.938 30 HD21 LEU 2 3HD2 LEU 2 8.435 -3.119 -6.966 31 HD22 LEU 2 1HD2 LEU 2 9.840 -2.105 -7.297 32 HD23 LEU 2 2HD2 LEU 2 10.047 -3.667 -6.504 33 H PHE 3 H PHE 3 10.445 -4.186 -12.164 34 HA PHE 3 HA PHE 3 10.316 -7.043 -11.474 35 HB2 PHE 3 2HB PHE 3 10.779 -5.808 -14.186 36 HB3 PHE 3 3HB PHE 3 11.238 -7.466 -13.814 37 HD1 PHE 3 HD1 PHE 3 8.339 -5.151 -13.873 38 HD2 PHE 3 HD2 PHE 3 9.682 -9.189 -13.970 39 HE1 PHE 3 HE1 PHE 3 6.054 -5.896 -14.397 40 HE2 PHE 3 HE2 PHE 3 7.399 -9.940 -14.495 41 HZ PHE 3 HZ PHE 3 5.581 -8.292 -14.710 42 H ALA 4 H ALA 4 12.397 -8.172 -11.733 43 HA ALA 4 HA ALA 4 14.733 -6.404 -11.554 44 HB1 ALA 4 1HB ALA 4 14.354 -6.745 -9.285 45 HB2 ALA 4 2HB ALA 4 13.845 -8.417 -9.522 46 HB3 ALA 4 3HB ALA 4 15.546 -7.981 -9.688 47 H VAL 5 H VAL 5 16.795 -7.572 -11.806 48 HA VAL 5 HA VAL 5 16.510 -10.088 -13.307 49 HB VAL 5 HB VAL 5 16.802 -8.277 -14.924 50 HG11 VAL 5 1HG1 VAL 5 18.331 -7.064 -13.038 51 HG12 VAL 5 2HG1 VAL 5 19.565 -7.672 -14.143 52 HG13 VAL 5 3HG1 VAL 5 18.292 -6.606 -14.740 53 HG21 VAL 5 3HG2 VAL 5 19.315 -9.924 -14.657 54 HG22 VAL 5 1HG2 VAL 5 17.796 -10.498 -15.345 55 HG23 VAL 5 2HG2 VAL 5 18.685 -9.194 -16.133 56 H THR 6 H THR 6 17.829 -11.653 -12.640 57 HA THR 6 HA THR 6 19.654 -11.195 -10.487 58 HB THR 6 HB THR 6 20.247 -13.720 -11.223 59 HG1 THR 6 HG1 THR 6 17.978 -14.488 -11.846 60 HG21 THR 6 3HG2 THR 6 17.935 -14.169 -9.866 61 HG22 THR 6 1HG2 THR 6 18.238 -12.478 -9.471 62 HG23 THR 6 2HG2 THR 6 19.457 -13.701 -9.111 63 H LEU 7 H LEU 7 21.857 -11.168 -10.482 64 HA LEU 7 HA LEU 7 23.172 -11.174 -13.119 65 HB2 LEU 7 2HB LEU 7 24.200 -9.765 -10.675 66 HB3 LEU 7 3HB LEU 7 24.688 -9.539 -12.353 67 HG LEU 7 HG LEU 7 21.934 -8.824 -11.381 68 HD11 LEU 7 1HD1 LEU 7 24.488 -7.418 -10.964 69 HD12 LEU 7 2HD1 LEU 7 22.973 -7.316 -10.069 70 HD13 LEU 7 3HD1 LEU 7 23.160 -6.439 -11.587 71 HD21 LEU 7 3HD2 LEU 7 21.898 -7.426 -13.346 72 HD22 LEU 7 1HD2 LEU 7 22.319 -9.075 -13.809 73 HD23 LEU 7 2HD2 LEU 7 23.573 -7.839 -13.713 74 H TYR 8 H TYR 8 22.988 -12.675 -10.084 75 HA TYR 8 HA TYR 8 25.398 -14.235 -10.701 76 HB2 TYR 8 2HB TYR 8 24.651 -13.166 -7.971 77 HB3 TYR 8 3HB TYR 8 25.956 -14.305 -8.286 78 HD1 TYR 8 HD1 TYR 8 24.783 -10.869 -9.093 79 HD2 TYR 8 HD2 TYR 8 28.093 -13.531 -8.844 80 HE1 TYR 8 HE1 TYR 8 26.318 -8.988 -9.489 81 HE2 TYR 8 HE2 TYR 8 29.637 -11.658 -9.239 82 HH TYR 8 HH TYR 8 28.480 -8.475 -10.108 83 H GLU 9 H GLU 9 25.425 -16.366 -9.714 84 HA GLU 9 HA GLU 9 22.780 -17.541 -9.717 85 HB2 GLU 9 2HB GLU 9 24.595 -18.649 -10.927 86 HB3 GLU 9 3HB GLU 9 25.511 -18.807 -9.436 87 HG2 GLU 9 2HG GLU 9 24.602 -20.819 -9.246 88 HG3 GLU 9 3HG GLU 9 23.104 -19.991 -8.824 89 H PHE 10 H PHE 10 21.658 -17.306 -7.882 90 HA PHE 10 HA PHE 10 22.987 -17.452 -5.303 91 HB2 PHE 10 2HB PHE 10 21.183 -15.768 -5.823 92 HB3 PHE 10 3HB PHE 10 20.037 -17.104 -5.855 93 HD1 PHE 10 HD2 PHE 10 22.789 -15.960 -3.602 94 HD2 PHE 10 HD1 PHE 10 18.762 -17.289 -3.969 95 HE1 PHE 10 HE2 PHE 10 22.507 -15.771 -1.165 96 HE2 PHE 10 HE1 PHE 10 18.474 -17.101 -1.533 97 HZ PHE 10 HZ PHE 10 20.348 -16.342 -0.127 98 H LYS 11 H LYS 11 23.284 -19.317 -4.302 99 HA LYS 11 HA LYS 11 21.673 -21.635 -5.045 100 HB2 LYS 11 2HB LYS 11 24.207 -21.333 -3.434 101 HB3 LYS 11 3HB LYS 11 23.355 -22.862 -3.597 102 HG2 LYS 11 2HG LYS 11 24.006 -23.158 -5.746 103 HG3 LYS 11 3HG LYS 11 24.023 -21.429 -6.097 104 HD2 LYS 11 2HD LYS 11 26.165 -21.162 -5.362 105 HD3 LYS 11 3HD LYS 11 26.029 -22.450 -4.163 106 HE2 LYS 11 2HE LYS 11 25.969 -24.058 -6.136 107 HE3 LYS 11 3HE LYS 11 26.488 -22.694 -7.125 108 HZ1 LYS 11 3HZ LYS 11 28.559 -23.081 -6.498 109 HZ2 LYS 11 1HZ LYS 11 28.059 -24.377 -5.532 110 HZ3 LYS 11 2HZ LYS 11 28.145 -22.819 -4.878 111 H ALA 12 H ALA 12 19.869 -21.985 -3.941 112 HA ALA 12 HA ALA 12 19.284 -20.816 -1.433 113 HB1 ALA 12 1HB ALA 12 17.320 -21.259 -2.442 114 HB2 ALA 12 2HB ALA 12 17.950 -22.674 -3.286 115 HB3 ALA 12 3HB ALA 12 17.464 -22.799 -1.596 116 H GLU 13 H GLU 13 18.847 -21.917 0.579 117 HA GLU 13 HA GLU 13 20.591 -24.258 0.978 118 HB2 GLU 13 2HB GLU 13 20.705 -23.428 3.383 119 HB3 GLU 13 3HB GLU 13 21.565 -22.478 2.179 120 HG2 GLU 13 2HG GLU 13 19.662 -20.912 2.101 121 HG3 GLU 13 3HG GLU 13 18.883 -21.838 3.383 122 H ARG 14 H ARG 14 17.464 -22.842 1.534 123 HA ARG 14 HA ARG 14 16.538 -25.420 2.599 124 HB2 ARG 14 2HB ARG 14 15.708 -22.696 3.618 125 HB3 ARG 14 3HB ARG 14 15.017 -24.229 4.130 126 HG2 ARG 14 2HG ARG 14 17.952 -23.863 4.388 127 HG3 ARG 14 3HG ARG 14 16.896 -23.018 5.522 128 HD2 ARG 14 2HD ARG 14 16.638 -25.961 4.973 129 HD3 ARG 14 3HD ARG 14 17.731 -25.328 6.203 130 HE ARG 14 HE ARG 14 15.201 -24.227 6.636 131 HH11 ARG 14 1HH1 ARG 14 16.792 -27.321 6.755 132 HH12 ARG 14 2HH1 ARG 14 15.753 -27.954 7.989 133 HH21 ARG 14 1HH2 ARG 14 13.827 -25.049 8.260 134 HH22 ARG 14 2HH2 ARG 14 14.066 -26.661 8.844 135 H ASP 15 H ASP 15 14.012 -25.404 2.591 136 HA ASP 15 HA ASP 15 13.169 -25.282 -0.070 137 HB2 ASP 15 2HB ASP 15 12.137 -26.680 1.735 138 HB3 ASP 15 3HB ASP 15 11.386 -25.219 2.371 139 H ASP 16 H ASP 16 12.733 -23.000 2.591 140 HA ASP 16 HA ASP 16 10.974 -21.233 1.315 141 HB2 ASP 16 2HB ASP 16 13.058 -20.725 3.446 142 HB3 ASP 16 3HB ASP 16 11.851 -19.542 2.949 143 H GLU 17 H GLU 17 14.381 -21.731 0.951 144 HA GLU 17 HA GLU 17 14.790 -19.212 -0.434 145 HB2 GLU 17 2HB GLU 17 16.699 -21.528 -0.073 146 HB3 GLU 17 3HB GLU 17 17.110 -19.913 -0.633 147 HG2 GLU 17 2HG GLU 17 16.205 -20.732 2.111 148 HG3 GLU 17 3HG GLU 17 17.772 -20.079 1.637 149 H LEU 18 H LEU 18 15.041 -18.949 -2.606 150 HA LEU 18 HA LEU 18 14.532 -21.319 -4.281 151 HB2 LEU 18 2HB LEU 18 12.767 -19.470 -4.136 152 HB3 LEU 18 3HB LEU 18 13.898 -18.493 -5.069 153 HG LEU 18 HG LEU 18 13.802 -20.536 -6.722 154 HD11 LEU 18 1HD1 LEU 18 12.210 -21.627 -4.905 155 HD12 LEU 18 2HD1 LEU 18 11.996 -21.911 -6.632 156 HD13 LEU 18 3HD1 LEU 18 10.989 -20.724 -5.803 157 HD21 LEU 18 3HD2 LEU 18 13.163 -18.434 -7.510 158 HD22 LEU 18 1HD2 LEU 18 11.813 -18.317 -6.381 159 HD23 LEU 18 2HD2 LEU 18 11.725 -19.429 -7.747 160 H ASP 19 H ASP 19 16.119 -21.886 -5.602 161 HA ASP 19 HA ASP 19 18.475 -20.286 -5.870 162 HB2 ASP 19 2HB ASP 19 18.805 -22.638 -5.813 163 HB3 ASP 19 3HB ASP 19 17.610 -22.910 -7.078 164 H VAL 20 H VAL 20 19.294 -19.276 -7.697 165 HA VAL 20 HA VAL 20 17.647 -19.153 -10.098 166 HB VAL 20 HB VAL 20 16.876 -17.315 -8.550 167 HG11 VAL 20 1HG1 VAL 20 19.226 -16.858 -7.718 168 HG12 VAL 20 2HG1 VAL 20 19.491 -15.996 -9.235 169 HG13 VAL 20 3HG1 VAL 20 18.247 -15.445 -8.112 170 HG21 VAL 20 3HG2 VAL 20 16.692 -15.693 -10.301 171 HG22 VAL 20 1HG2 VAL 20 18.111 -16.344 -11.122 172 HG23 VAL 20 2HG2 VAL 20 16.628 -17.294 -11.037 173 H SER 21 H SER 21 18.744 -18.187 -11.916 174 HA SER 21 HA SER 21 21.674 -18.280 -11.624 175 HB2 SER 21 2HB SER 21 19.830 -19.246 -13.766 176 HB3 SER 21 3HB SER 21 21.437 -18.690 -14.233 177 HG SER 21 HG SER 21 20.681 -20.915 -12.742 178 HA PRO 22 HA PRO 22 22.063 -14.149 -13.047 179 HB2 PRO 22 2HB PRO 22 24.301 -14.286 -14.578 180 HB3 PRO 22 3HB PRO 22 24.336 -14.393 -12.814 181 HG2 PRO 22 2HG PRO 22 24.441 -16.587 -14.848 182 HG3 PRO 22 3HG PRO 22 25.391 -16.392 -13.363 183 HD2 PRO 22 2HD PRO 22 23.251 -18.044 -13.517 184 HD3 PRO 22 3HD PRO 22 23.695 -17.193 -12.023 185 H GLY 23 H GLY 23 20.878 -13.107 -14.514 186 HA2 GLY 23 2HA GLY 23 20.648 -12.387 -16.819 187 HA3 GLY 23 3HA GLY 23 20.966 -14.045 -17.310 188 H GLU 24 H GLU 24 19.069 -14.485 -14.756 189 HA GLU 24 HA GLU 24 16.705 -14.828 -16.408 190 HB2 GLU 24 2HB GLU 24 17.360 -15.648 -13.578 191 HB3 GLU 24 3HB GLU 24 15.792 -15.926 -14.323 192 HG2 GLU 24 2HG GLU 24 17.254 -17.065 -16.189 193 HG3 GLU 24 3HG GLU 24 18.409 -17.219 -14.867 194 H ASN 25 H ASN 25 14.727 -13.856 -16.069 195 HA ASN 25 HA ASN 25 14.826 -11.368 -14.533 196 HB2 ASN 25 2HB ASN 25 12.864 -12.336 -16.624 197 HB3 ASN 25 3HB ASN 25 12.773 -10.777 -15.809 198 HD21 ASN 25 1HD2 ASN 25 13.181 -9.376 -17.390 199 HD22 ASN 25 2HD2 ASN 25 14.599 -9.377 -18.378 200 H LEU 26 H LEU 26 13.929 -11.272 -12.591 201 HA LEU 26 HA LEU 26 11.818 -13.210 -11.915 202 HB2 LEU 26 2HB LEU 26 13.765 -11.780 -10.112 203 HB3 LEU 26 3HB LEU 26 12.488 -12.866 -9.568 204 HG LEU 26 HG LEU 26 13.914 -14.407 -11.361 205 HD11 LEU 26 1HD1 LEU 26 15.590 -12.345 -10.990 206 HD12 LEU 26 2HD1 LEU 26 16.130 -14.002 -11.260 207 HD13 LEU 26 3HD1 LEU 26 16.051 -13.357 -9.620 208 HD21 LEU 26 3HD2 LEU 26 14.707 -14.473 -8.506 209 HD22 LEU 26 1HD2 LEU 26 14.184 -15.778 -9.571 210 HD23 LEU 26 2HD2 LEU 26 12.994 -14.677 -8.877 211 H SER 27 H SER 27 10.124 -12.482 -10.473 212 HA SER 27 HA SER 27 9.422 -9.683 -10.993 213 HB2 SER 27 2HB SER 27 7.949 -12.001 -11.280 214 HB3 SER 27 3HB SER 27 7.364 -11.354 -9.747 215 HG SER 27 HG SER 27 6.141 -10.329 -11.205 216 H ILE 28 H ILE 28 9.915 -8.304 -9.429 217 HA ILE 28 HA ILE 28 10.445 -9.085 -6.749 218 HB ILE 28 HB ILE 28 10.012 -6.341 -7.932 219 HG12 ILE 28 2HG1 ILE 28 11.968 -7.663 -8.774 220 HG13 ILE 28 3HG1 ILE 28 12.412 -6.169 -7.957 221 HG21 ILE 28 1HG2 ILE 28 9.640 -5.913 -5.711 222 HG22 ILE 28 2HG2 ILE 28 10.659 -7.246 -5.171 223 HG23 ILE 28 3HG2 ILE 28 11.396 -5.763 -5.776 224 HD11 ILE 28 3HD1 ILE 28 12.491 -8.916 -6.732 225 HD12 ILE 28 1HD1 ILE 28 13.879 -8.025 -7.356 226 HD13 ILE 28 2HD1 ILE 28 12.992 -7.412 -5.960 227 H CYS 29 H CYS 29 9.253 -8.803 -4.890 228 HA CYS 29 HA CYS 29 6.424 -8.070 -5.266 229 HB2 CYS 29 2HB CYS 29 7.448 -10.081 -3.260 230 HB3 CYS 29 3HB CYS 29 5.774 -9.753 -3.690 231 HG CYS 29 HG CYS 29 7.426 -12.175 -4.750 232 H ALA 30 H ALA 30 9.181 -8.105 -3.064 233 HA ALA 30 HA ALA 30 8.577 -5.569 -1.988 234 HB1 ALA 30 1HB ALA 30 8.324 -6.872 0.418 235 HB2 ALA 30 2HB ALA 30 7.013 -6.124 -0.494 236 HB3 ALA 30 3HB ALA 30 7.336 -7.849 -0.668 237 H HIS 31 H HIS 31 9.939 -5.186 0.087 238 HA HIS 31 HA HIS 31 12.466 -6.680 -0.172 239 HB2 HIS 31 2HB HIS 31 13.710 -4.682 0.131 240 HB3 HIS 31 3HB HIS 31 12.474 -4.299 -1.064 241 HD1 HIS 31 HD1 HIS 31 13.985 -2.901 1.805 242 HD2 HIS 31 HD2 HIS 31 10.079 -3.096 0.404 243 HE1 HIS 31 HE1 HIS 31 12.753 -1.057 2.991 244 H TYR 32 H TYR 32 13.911 -6.138 1.853 245 HA TYR 32 HA TYR 32 12.343 -5.999 4.305 246 HB2 TYR 32 2HB TYR 32 12.523 -8.429 3.540 247 HB3 TYR 32 3HB TYR 32 14.245 -8.301 3.880 248 HD1 TYR 32 HD2 TYR 32 15.051 -8.106 6.173 249 HD2 TYR 32 HD1 TYR 32 10.896 -8.476 5.336 250 HE1 TYR 32 HE2 TYR 32 14.629 -8.647 8.535 251 HE2 TYR 32 HE1 TYR 32 10.462 -9.017 7.696 252 HH TYR 32 HH TYR 32 11.630 -8.556 9.933 253 H ASP 33 H ASP 33 13.350 -4.228 5.083 254 HA ASP 33 HA ASP 33 14.957 -2.935 6.041 255 HB2 ASP 33 2HB ASP 33 15.350 -4.938 7.419 256 HB3 ASP 33 3HB ASP 33 16.484 -5.542 6.213 257 H TYR 34 H TYR 34 15.023 -3.789 3.079 258 HA TYR 34 HA TYR 34 16.213 -3.212 1.229 259 HB2 TYR 34 2HB TYR 34 17.955 -1.608 3.107 260 HB3 TYR 34 3HB TYR 34 17.782 -1.382 1.370 261 HD1 TYR 34 HD1 TYR 34 16.163 -0.927 4.638 262 HD2 TYR 34 HD2 TYR 34 15.878 -0.227 0.451 263 HE1 TYR 34 HE1 TYR 34 14.340 0.675 5.036 264 HE2 TYR 34 HE2 TYR 34 14.055 1.378 0.837 265 HH TYR 34 HH TYR 34 12.260 1.542 3.387 266 H GLU 35 H GLU 35 16.927 -5.553 2.832 267 HA GLU 35 HA GLU 35 19.667 -5.905 1.827 268 HB2 GLU 35 2HB GLU 35 19.860 -7.519 3.895 269 HB3 GLU 35 3HB GLU 35 20.180 -5.799 4.066 270 HG2 GLU 35 2HG GLU 35 17.940 -5.448 4.937 271 HG3 GLU 35 3HG GLU 35 17.579 -7.160 4.728 272 H TRP 36 H TRP 36 16.540 -6.847 1.635 273 HA TRP 36 HA TRP 36 17.252 -9.327 0.317 274 HB2 TRP 36 2HB TRP 36 15.280 -9.314 2.613 275 HB3 TRP 36 3HB TRP 36 15.635 -10.686 1.567 276 HD1 TRP 36 HD1 TRP 36 16.805 -8.968 4.682 277 HE1 TRP 36 HE1 TRP 36 18.878 -10.175 5.616 278 HE3 TRP 36 HE3 TRP 36 17.841 -12.005 0.701 279 HZ2 TRP 36 HZ2 TRP 36 20.710 -12.151 4.777 280 HZ3 TRP 36 HZ3 TRP 36 19.771 -13.524 0.847 281 HH2 TRP 36 HH2 TRP 36 21.176 -13.593 2.843 282 H PHE 37 H PHE 37 15.953 -9.746 -1.385 283 HA PHE 37 HA PHE 37 13.496 -8.140 -1.639 284 HB2 PHE 37 2HB PHE 37 15.801 -8.389 -3.419 285 HB3 PHE 37 3HB PHE 37 14.271 -8.702 -4.232 286 HD1 PHE 37 HD1 PHE 37 12.373 -6.911 -3.314 287 HD2 PHE 37 HD2 PHE 37 16.561 -6.255 -3.696 288 HE1 PHE 37 HE1 PHE 37 11.973 -4.490 -3.495 289 HE2 PHE 37 HE2 PHE 37 16.168 -3.833 -3.877 290 HZ PHE 37 HZ PHE 37 13.873 -2.947 -3.775 291 H ILE 38 H ILE 38 11.677 -9.146 -2.357 292 HA ILE 38 HA ILE 38 11.783 -12.059 -2.490 293 HB ILE 38 HB ILE 38 9.284 -10.385 -2.554 294 HG12 ILE 38 2HG1 ILE 38 10.532 -9.650 -0.608 295 HG13 ILE 38 3HG1 ILE 38 9.195 -10.669 -0.085 296 HG21 ILE 38 1HG2 ILE 38 8.203 -12.327 -2.434 297 HG22 ILE 38 2HG2 ILE 38 9.745 -13.111 -2.771 298 HG23 ILE 38 3HG2 ILE 38 9.216 -12.888 -1.104 299 HD11 ILE 38 3HD1 ILE 38 11.442 -12.338 -0.485 300 HD12 ILE 38 1HD1 ILE 38 11.960 -10.944 0.463 301 HD13 ILE 38 2HD1 ILE 38 10.617 -11.941 1.022 302 H ALA 39 H ALA 39 12.514 -12.536 -4.532 303 HA ALA 39 HA ALA 39 10.925 -11.516 -6.790 304 HB1 ALA 39 1HB ALA 39 13.598 -11.403 -6.520 305 HB2 ALA 39 2HB ALA 39 13.438 -12.954 -7.346 306 HB3 ALA 39 3HB ALA 39 12.777 -11.492 -8.079 307 H LYS 40 H LYS 40 9.793 -12.881 -8.054 308 HA LYS 40 HA LYS 40 9.911 -15.744 -7.376 309 HB2 LYS 40 2HB LYS 40 7.582 -15.758 -8.445 310 HB3 LYS 40 3HB LYS 40 7.744 -14.991 -6.871 311 HG2 LYS 40 2HG LYS 40 7.454 -12.872 -7.722 312 HG3 LYS 40 3HG LYS 40 7.973 -13.337 -9.343 313 HD2 LYS 40 2HD LYS 40 5.529 -14.635 -8.281 314 HD3 LYS 40 3HD LYS 40 5.412 -12.926 -8.708 315 HE2 LYS 40 2HE LYS 40 4.894 -13.850 -10.727 316 HE3 LYS 40 3HE LYS 40 6.647 -13.765 -10.893 317 HZ1 LYS 40 3HZ LYS 40 6.874 -16.013 -10.627 318 HZ2 LYS 40 1HZ LYS 40 5.379 -15.958 -11.418 319 HZ3 LYS 40 2HZ LYS 40 5.441 -16.182 -9.743 320 HA PRO 41 HA PRO 41 11.191 -16.815 -11.434 321 HB2 PRO 41 2HB PRO 41 9.864 -19.150 -11.830 322 HB3 PRO 41 3HB PRO 41 11.236 -19.000 -10.725 323 HG2 PRO 41 2HG PRO 41 8.304 -18.999 -10.117 324 HG3 PRO 41 3HG PRO 41 9.624 -19.819 -9.262 325 HD2 PRO 41 2HD PRO 41 8.540 -17.498 -8.384 326 HD3 PRO 41 3HD PRO 41 10.249 -17.908 -8.135 327 H ILE 42 H ILE 42 10.601 -15.898 -13.288 328 HA ILE 42 HA ILE 42 7.781 -15.489 -13.882 329 HB ILE 42 HB ILE 42 10.194 -14.547 -15.434 330 HG12 ILE 42 2HG1 ILE 42 8.522 -13.099 -13.368 331 HG13 ILE 42 3HG1 ILE 42 10.184 -13.637 -13.153 332 HG21 ILE 42 1HG2 ILE 42 8.698 -13.054 -16.552 333 HG22 ILE 42 2HG2 ILE 42 8.034 -14.682 -16.671 334 HG23 ILE 42 3HG2 ILE 42 7.358 -13.537 -15.513 335 HD11 ILE 42 3HD1 ILE 42 10.558 -12.142 -15.298 336 HD12 ILE 42 1HD1 ILE 42 9.112 -11.342 -14.685 337 HD13 ILE 42 2HD1 ILE 42 10.551 -11.462 -13.672 338 H ASN 43 H ASN 43 10.627 -17.012 -15.360 339 HA ASN 43 HA ASN 43 9.170 -18.019 -17.607 340 HB2 ASN 43 2HB ASN 43 11.698 -17.538 -17.438 341 HB3 ASN 43 3HB ASN 43 11.807 -19.105 -16.642 342 HD21 ASN 43 1HD2 ASN 43 12.609 -17.887 -19.352 343 HD22 ASN 43 2HD2 ASN 43 12.113 -19.094 -20.485 344 H ARG 43 H ARG 43 10.901 -19.820 -15.060 345 HA ARG 43 HA ARG 43 9.300 -22.159 -15.508 346 HB2 ARG 43 2HB ARG 43 10.586 -23.083 -13.576 347 HB3 ARG 43 3HB ARG 43 11.596 -22.469 -14.878 348 HG2 ARG 43 2HG ARG 43 12.189 -20.548 -13.649 349 HG3 ARG 43 3HG ARG 43 10.924 -20.833 -12.453 350 HD2 ARG 43 2HD ARG 43 12.393 -21.951 -11.219 351 HD3 ARG 43 3HD ARG 43 12.515 -23.152 -12.504 352 HE ARG 43 HE ARG 43 14.417 -21.079 -11.871 353 HH11 ARG 43 1HH1 ARG 43 13.262 -23.301 -14.289 354 HH12 ARG 43 2HH1 ARG 43 14.752 -23.319 -15.172 355 HH21 ARG 43 1HH2 ARG 43 16.384 -21.093 -13.025 356 HH22 ARG 43 2HH2 ARG 43 16.528 -22.063 -14.452 357 H LEU 44 H LEU 44 8.338 -23.296 -13.523 358 HA LEU 44 HA LEU 44 6.672 -21.342 -12.088 359 HB2 LEU 44 2HB LEU 44 5.236 -23.481 -11.726 360 HB3 LEU 44 3HB LEU 44 5.177 -22.621 -13.263 361 HG LEU 44 HG LEU 44 6.591 -24.280 -14.297 362 HD11 LEU 44 1HD1 LEU 44 6.647 -25.677 -11.628 363 HD12 LEU 44 2HD1 LEU 44 7.985 -24.758 -12.316 364 HD13 LEU 44 3HD1 LEU 44 7.411 -26.217 -13.123 365 HD21 LEU 44 3HD2 LEU 44 4.819 -25.566 -14.680 366 HD22 LEU 44 1HD2 LEU 44 3.999 -24.721 -13.368 367 HD23 LEU 44 2HD2 LEU 44 4.867 -26.221 -13.043 368 H GLY 45 H GLY 45 5.687 -22.655 -10.023 369 HA2 GLY 45 2HA GLY 45 6.689 -24.381 -8.390 370 HA3 GLY 45 3HA GLY 45 8.080 -23.307 -8.437 371 H GLY 46 H GLY 46 8.016 -21.345 -7.356 372 HA2 GLY 46 2HA GLY 46 5.695 -20.198 -6.239 373 HA3 GLY 46 3HA GLY 46 6.461 -21.221 -5.032 374 HA PRO 47 HA PRO 47 8.407 -16.888 -5.304 375 HB2 PRO 47 2HB PRO 47 7.358 -15.850 -3.025 376 HB3 PRO 47 3HB PRO 47 6.578 -15.688 -4.603 377 HG2 PRO 47 2HG PRO 47 5.994 -17.618 -2.391 378 HG3 PRO 47 3HG PRO 47 4.863 -16.704 -3.405 379 HD2 PRO 47 2HD PRO 47 5.438 -19.312 -3.851 380 HD3 PRO 47 3HD PRO 47 5.049 -18.182 -5.164 381 H GLY 48 H GLY 48 10.281 -16.426 -4.227 382 HA2 GLY 48 2HA GLY 48 10.832 -17.926 -1.749 383 HA3 GLY 48 3HA GLY 48 11.977 -17.961 -3.081 384 H LEU 49 H LEU 49 13.541 -17.108 -1.588 385 HA LEU 49 HA LEU 49 13.255 -14.200 -1.219 386 HB2 LEU 49 2HB LEU 49 13.275 -15.886 0.839 387 HB3 LEU 49 3HB LEU 49 15.016 -15.744 0.604 388 HG LEU 49 HG LEU 49 13.371 -13.264 0.849 389 HD11 LEU 49 1HD1 LEU 49 14.482 -14.497 3.315 390 HD12 LEU 49 2HD1 LEU 49 12.925 -15.070 2.717 391 HD13 LEU 49 3HD1 LEU 49 13.142 -13.366 3.117 392 HD21 LEU 49 3HD2 LEU 49 15.551 -12.671 2.121 393 HD22 LEU 49 1HD2 LEU 49 15.575 -12.763 0.360 394 HD23 LEU 49 2HD2 LEU 49 16.203 -14.102 1.321 395 H VAL 50 H VAL 50 14.748 -13.034 -2.226 396 HA VAL 50 HA VAL 50 17.366 -14.257 -2.786 397 HB VAL 50 HB VAL 50 16.098 -14.337 -4.855 398 HG11 VAL 50 1HG1 VAL 50 15.292 -12.282 -5.931 399 HG12 VAL 50 2HG1 VAL 50 14.482 -12.581 -4.392 400 HG13 VAL 50 3HG1 VAL 50 15.752 -11.361 -4.500 401 HG21 VAL 50 3HG2 VAL 50 18.443 -13.932 -5.107 402 HG22 VAL 50 1HG2 VAL 50 17.591 -12.923 -6.275 403 HG23 VAL 50 2HG2 VAL 50 18.233 -12.209 -4.796 404 HA PRO 51 HA PRO 51 18.868 -10.548 -0.902 405 HB2 PRO 51 2HB PRO 51 21.472 -10.819 -1.619 406 HB3 PRO 51 3HB PRO 51 20.723 -11.780 -0.338 407 HG2 PRO 51 2HG PRO 51 21.262 -12.516 -3.189 408 HG3 PRO 51 3HG PRO 51 21.499 -13.482 -1.721 409 HD2 PRO 51 2HD PRO 51 19.357 -13.802 -3.345 410 HD3 PRO 51 3HD PRO 51 19.272 -14.060 -1.591 411 H VAL 52 H VAL 52 19.600 -8.483 -1.473 412 HA VAL 52 HA VAL 52 19.024 -7.689 -4.160 413 HB VAL 52 HB VAL 52 20.343 -5.946 -2.091 414 HG11 VAL 52 1HG1 VAL 52 18.354 -4.580 -3.502 415 HG12 VAL 52 2HG1 VAL 52 20.101 -4.426 -3.696 416 HG13 VAL 52 3HG1 VAL 52 19.197 -5.558 -4.703 417 HG21 VAL 52 3HG2 VAL 52 17.800 -5.346 -1.675 418 HG22 VAL 52 1HG2 VAL 52 17.576 -7.028 -2.157 419 HG23 VAL 52 2HG2 VAL 52 18.604 -6.634 -0.779 420 H SER 53 H SER 53 21.861 -8.620 -2.463 421 HA SER 53 HA SER 53 23.733 -7.241 -4.142 422 HB2 SER 53 2HB SER 53 24.156 -9.578 -2.263 423 HB3 SER 53 3HB SER 53 25.432 -8.606 -2.997 424 HG SER 53 HG SER 53 23.926 -8.095 -0.804 425 H TYR 54 H TYR 54 21.697 -9.752 -4.739 426 HA TYR 54 HA TYR 54 23.487 -10.847 -6.807 427 HB2 TYR 54 2HB TYR 54 21.468 -12.330 -5.115 428 HB3 TYR 54 3HB TYR 54 22.239 -13.012 -6.543 429 HD1 TYR 54 HD2 TYR 54 23.117 -11.407 -3.287 430 HD2 TYR 54 HD1 TYR 54 24.189 -14.232 -6.282 431 HE1 TYR 54 HE2 TYR 54 25.011 -12.146 -1.903 432 HE2 TYR 54 HE1 TYR 54 26.086 -14.980 -4.906 433 HH TYR 54 HH TYR 54 26.417 -14.204 -1.656 434 H VAL 55 H VAL 55 21.345 -8.707 -6.731 435 HA VAL 55 HA VAL 55 19.991 -9.577 -9.155 436 HB VAL 55 HB VAL 55 17.781 -9.018 -8.431 437 HG11 VAL 55 1HG1 VAL 55 17.355 -10.741 -6.796 438 HG12 VAL 55 2HG1 VAL 55 18.612 -11.289 -7.906 439 HG13 VAL 55 3HG1 VAL 55 19.045 -10.727 -6.291 440 HG21 VAL 55 3HG2 VAL 55 17.715 -7.310 -6.958 441 HG22 VAL 55 1HG2 VAL 55 17.695 -8.607 -5.763 442 HG23 VAL 55 2HG2 VAL 55 19.211 -7.799 -6.162 443 H ARG 56 H ARG 56 18.750 -7.732 -10.153 444 HA ARG 56 HA ARG 56 19.813 -5.106 -9.401 445 HB2 ARG 56 2HB ARG 56 21.329 -5.793 -11.109 446 HB3 ARG 56 3HB ARG 56 20.022 -6.394 -12.119 447 HG2 ARG 56 2HG ARG 56 19.207 -4.062 -12.358 448 HG3 ARG 56 3HG ARG 56 20.633 -3.520 -11.471 449 HD2 ARG 56 2HD ARG 56 20.557 -4.951 -14.122 450 HD3 ARG 56 3HD ARG 56 21.065 -3.290 -13.818 451 HE ARG 56 HE ARG 56 22.655 -5.633 -13.556 452 HH11 ARG 56 1HH1 ARG 56 22.113 -2.474 -12.196 453 HH12 ARG 56 2HH1 ARG 56 23.733 -2.309 -11.603 454 HH21 ARG 56 1HH2 ARG 56 24.790 -5.427 -12.780 455 HH22 ARG 56 2HH2 ARG 56 25.255 -3.988 -11.937 456 H ILE 57 H ILE 57 18.178 -3.742 -9.180 457 HA ILE 57 HA ILE 57 15.546 -4.347 -10.073 458 HB ILE 57 HB ILE 57 16.569 -1.685 -9.085 459 HG12 ILE 57 2HG1 ILE 57 17.134 -3.418 -7.470 460 HG13 ILE 57 3HG1 ILE 57 15.806 -2.440 -6.854 461 HG21 ILE 57 1HG2 ILE 57 13.840 -2.892 -9.390 462 HG22 ILE 57 2HG2 ILE 57 14.146 -1.569 -8.266 463 HG23 ILE 57 3HG2 ILE 57 14.441 -1.346 -9.990 464 HD11 ILE 57 3HD1 ILE 57 14.495 -4.462 -8.142 465 HD12 ILE 57 1HD1 ILE 57 15.911 -5.280 -7.481 466 HD13 ILE 57 2HD1 ILE 57 14.828 -4.389 -6.412 467 H ILE 58 H ILE 58 15.026 -4.292 -12.162 468 HA ILE 58 HA ILE 58 15.787 -1.905 -13.710 469 HB ILE 58 HB ILE 58 15.814 -3.388 -15.745 470 HG12 ILE 58 2HG1 ILE 58 16.440 -5.742 -14.074 471 HG13 ILE 58 3HG1 ILE 58 14.742 -5.277 -14.110 472 HG21 ILE 58 1HG2 ILE 58 17.816 -2.593 -14.251 473 HG22 ILE 58 2HG2 ILE 58 17.958 -4.314 -13.897 474 HG23 ILE 58 3HG2 ILE 58 18.073 -3.745 -15.562 475 HD11 ILE 58 3HD1 ILE 58 14.566 -6.420 -15.993 476 HD12 ILE 58 1HD1 ILE 58 15.567 -5.190 -16.764 477 HD13 ILE 58 2HD1 ILE 58 16.313 -6.640 -16.091 478 H ASP 59 H ASP 59 14.225 -1.010 -14.982 479 HA ASP 59 HA ASP 59 11.507 -1.776 -14.436 480 HB2 ASP 59 2HB ASP 59 12.628 0.614 -14.885 481 HB3 ASP 59 3HB ASP 59 12.114 0.246 -16.530 482 H LEU 60 H LEU 60 10.348 -3.179 -15.564 483 HA LEU 60 HA LEU 60 11.256 -4.621 -17.743 484 HB2 LEU 60 2HB LEU 60 9.007 -4.624 -16.140 485 HB3 LEU 60 3HB LEU 60 8.365 -4.295 -17.748 486 HG LEU 60 HG LEU 60 8.324 -6.689 -17.160 487 HD11 LEU 60 1HD1 LEU 60 10.319 -6.290 -19.360 488 HD12 LEU 60 2HD1 LEU 60 8.651 -5.745 -19.522 489 HD13 LEU 60 3HD1 LEU 60 8.997 -7.453 -19.255 490 HD21 LEU 60 3HD2 LEU 60 11.133 -7.202 -17.561 491 HD22 LEU 60 1HD2 LEU 60 10.064 -7.744 -16.267 492 HD23 LEU 60 2HD2 LEU 60 10.871 -6.180 -16.147 493 H MET 61 H MET 61 9.637 -1.535 -17.640 494 HA MET 61 HA MET 61 9.138 -1.498 -20.494 495 HB2 MET 61 2HB MET 61 8.875 0.775 -18.523 496 HB3 MET 61 3HB MET 61 8.158 0.671 -20.125 497 HG2 MET 61 2HG MET 61 7.497 -1.234 -17.898 498 HG3 MET 61 3HG MET 61 6.607 0.257 -18.199 499 HE1 MET 61 3HE MET 61 7.587 -2.998 -20.921 500 HE2 MET 61 1HE MET 61 7.732 -3.038 -19.163 501 HE3 MET 61 2HE MET 61 6.321 -3.749 -19.948 502 H ASP 62 H ASP 62 11.570 -0.438 -18.269 503 HA ASP 62 HA ASP 62 13.220 0.442 -20.496 504 HB2 ASP 62 2HB ASP 62 13.038 2.267 -18.120 505 HB3 ASP 62 3HB ASP 62 13.640 2.611 -19.739 506 HA PRO 63 HA PRO 63 15.471 -2.029 -17.300 507 HB2 PRO 63 2HB PRO 63 16.766 -3.593 -19.102 508 HB3 PRO 63 3HB PRO 63 15.145 -3.961 -18.501 509 HG2 PRO 63 2HG PRO 63 15.963 -2.657 -21.069 510 HG3 PRO 63 3HG PRO 63 14.725 -3.895 -20.787 511 HD2 PRO 63 2HD PRO 63 14.120 -1.273 -21.095 512 HD3 PRO 63 3HD PRO 63 13.173 -2.356 -20.054 513 H ALA 64 H ALA 64 16.246 0.110 -19.803 514 HA ALA 64 HA ALA 64 19.124 -0.002 -19.312 515 HB1 ALA 64 1HB ALA 64 19.403 0.915 -21.341 516 HB2 ALA 64 2HB ALA 64 17.724 0.437 -21.599 517 HB3 ALA 64 3HB ALA 64 18.105 2.086 -21.102 518 H LYS 65 H LYS 65 16.470 1.484 -17.989 519 HA LYS 65 HA LYS 65 17.687 4.054 -17.454 520 HB2 LYS 65 2HB LYS 65 15.075 2.755 -16.781 521 HB3 LYS 65 3HB LYS 65 15.595 4.166 -15.870 522 HG2 LYS 65 2HG LYS 65 15.992 4.973 -18.449 523 HG3 LYS 65 3HG LYS 65 14.551 3.964 -18.586 524 HD2 LYS 65 2HD LYS 65 13.783 6.161 -18.152 525 HD3 LYS 65 3HD LYS 65 13.606 5.270 -16.638 526 HE2 LYS 65 2HE LYS 65 15.245 6.454 -15.592 527 HE3 LYS 65 3HE LYS 65 16.161 6.707 -17.077 528 HZ1 LYS 65 3HZ LYS 65 14.221 8.232 -17.712 529 HZ2 LYS 65 1HZ LYS 65 15.340 8.797 -16.576 530 HZ3 LYS 65 2HZ LYS 65 13.837 8.215 -16.064 531 H TYR 66 H TYR 66 16.955 1.084 -15.680 532 HA TYR 66 HA TYR 66 18.548 2.110 -13.425 533 HB2 TYR 66 2HB TYR 66 16.405 -0.024 -13.473 534 HB3 TYR 66 3HB TYR 66 17.373 0.384 -12.061 535 HD1 TYR 66 HD1 TYR 66 15.091 1.967 -14.556 536 HD2 TYR 66 HD2 TYR 66 16.577 1.970 -10.569 537 HE1 TYR 66 HE1 TYR 66 13.470 3.718 -13.959 538 HE2 TYR 66 HE2 TYR 66 14.959 3.720 -9.961 539 HH TYR 66 HH TYR 66 13.491 5.642 -11.965 540 H ALA 67 H ALA 67 19.443 0.767 -15.954 541 HA ALA 67 HA ALA 67 20.398 -1.826 -15.124 542 HB1 ALA 67 1HB ALA 67 20.558 -2.154 -17.311 543 HB2 ALA 67 2HB ALA 67 20.047 -0.488 -17.582 544 HB3 ALA 67 3HB ALA 67 21.762 -0.872 -17.442 545 H SER 68 H SER 68 21.417 1.370 -14.712 546 HA SER 68 HA SER 68 24.227 0.587 -14.375 547 HB2 SER 68 2HB SER 68 23.638 2.602 -15.786 548 HB3 SER 68 3HB SER 68 23.087 3.387 -14.306 549 HG SER 68 HG SER 68 25.117 3.977 -14.226 550 H VAL 69 H VAL 69 21.384 1.452 -12.644 551 HA VAL 69 HA VAL 69 22.330 2.541 -10.297 552 HB VAL 69 HB VAL 69 19.917 2.120 -10.902 553 HG11 VAL 69 1HG1 VAL 69 20.567 -0.441 -11.196 554 HG12 VAL 69 2HG1 VAL 69 20.057 -0.493 -9.508 555 HG13 VAL 69 3HG1 VAL 69 18.940 0.072 -10.751 556 HG21 VAL 69 3HG2 VAL 69 19.316 2.473 -8.751 557 HG22 VAL 69 1HG2 VAL 69 20.214 1.076 -8.158 558 HG23 VAL 69 2HG2 VAL 69 21.060 2.583 -8.510 559 H ASP 70 H ASP 70 22.758 1.600 -8.209 560 HA ASP 70 HA ASP 70 24.060 -1.036 -8.411 561 HB2 ASP 70 2HB ASP 70 25.238 1.354 -7.749 562 HB3 ASP 70 3HB ASP 70 24.868 0.676 -6.166 563 H THR 71 H THR 71 22.739 -2.509 -7.556 564 HA THR 71 HA THR 71 20.820 -1.935 -5.534 565 HB THR 71 HB THR 71 21.119 -4.678 -5.480 566 HG1 THR 71 HG1 THR 71 21.175 -4.951 -7.947 567 HG21 THR 71 3HG2 THR 71 19.077 -3.175 -5.841 568 HG22 THR 71 1HG2 THR 71 19.086 -4.737 -6.659 569 HG23 THR 71 2HG2 THR 71 19.466 -3.268 -7.559 570 H TYR 72 H TYR 72 24.126 -2.973 -5.504 571 HA TYR 72 HA TYR 72 24.219 -4.183 -2.968 572 HB2 TYR 72 2HB TYR 72 26.080 -4.526 -4.388 573 HB3 TYR 72 3HB TYR 72 26.301 -2.800 -4.652 574 HD1 TYR 72 HD1 TYR 72 25.829 -4.618 -1.439 575 HD2 TYR 72 HD2 TYR 72 28.480 -2.394 -3.915 576 HE1 TYR 72 HE1 TYR 72 27.474 -4.555 0.389 577 HE2 TYR 72 HE2 TYR 72 30.132 -2.326 -2.095 578 HH TYR 72 HH TYR 72 30.018 -2.485 0.501 579 H ASP 73 H ASP 73 24.831 -0.831 -3.975 580 HA ASP 73 HA ASP 73 25.449 0.159 -1.410 581 HB2 ASP 73 2HB ASP 73 24.672 1.363 -4.024 582 HB3 ASP 73 3HB ASP 73 24.558 2.376 -2.587 583 H ARG 74 H ARG 74 24.127 0.035 0.279 584 HA ARG 74 HA ARG 74 21.389 -0.359 0.247 585 HB2 ARG 74 2HB ARG 74 21.401 0.087 2.570 586 HB3 ARG 74 3HB ARG 74 22.984 -0.589 2.210 587 HG2 ARG 74 2HG ARG 74 22.458 2.364 2.397 588 HG3 ARG 74 3HG ARG 74 22.970 1.376 3.766 589 HD2 ARG 74 2HD ARG 74 24.465 1.888 1.202 590 HD3 ARG 74 3HD ARG 74 24.915 2.396 2.829 591 HE ARG 74 HE ARG 74 24.782 -0.331 2.965 592 HH11 ARG 74 1HH1 ARG 74 26.520 1.968 1.012 593 HH12 ARG 74 2HH1 ARG 74 27.888 0.931 0.777 594 HH21 ARG 74 1HH2 ARG 74 26.577 -1.705 2.663 595 HH22 ARG 74 2HH2 ARG 74 27.919 -1.159 1.716 596 H GLU 75 H GLU 75 23.201 2.583 -0.110 597 HA GLU 75 HA GLU 75 21.131 4.413 0.502 598 HB2 GLU 75 2HB GLU 75 23.728 4.578 -0.977 599 HB3 GLU 75 3HB GLU 75 22.594 5.917 -1.081 600 HG2 GLU 75 2HG GLU 75 22.623 6.146 1.343 601 HG3 GLU 75 3HG GLU 75 23.743 4.789 1.462 602 H GLN 76 H GLN 76 22.382 3.272 -2.636 603 HA GLN 76 HA GLN 76 20.497 4.581 -4.234 604 HB2 GLN 76 2HB GLN 76 21.946 1.984 -4.777 605 HB3 GLN 76 3HB GLN 76 21.126 2.965 -5.984 606 HG2 GLN 76 2HG GLN 76 22.814 4.777 -4.849 607 HG3 GLN 76 3HG GLN 76 23.759 3.291 -4.763 608 HE21 GLN 76 1HE2 GLN 76 25.180 3.396 -6.357 609 HE22 GLN 76 2HE2 GLN 76 24.819 3.751 -8.009 610 H VAL 77 H VAL 77 20.534 1.171 -3.185 611 HA VAL 77 HA VAL 77 18.094 0.401 -4.245 612 HB VAL 77 HB VAL 77 19.847 -1.061 -3.103 613 HG11 VAL 77 1HG1 VAL 77 19.915 0.173 -0.984 614 HG12 VAL 77 2HG1 VAL 77 18.248 -0.307 -0.658 615 HG13 VAL 77 3HG1 VAL 77 19.518 -1.528 -0.740 616 HG21 VAL 77 3HG2 VAL 77 18.167 -2.408 -3.757 617 HG22 VAL 77 1HG2 VAL 77 17.774 -2.448 -2.038 618 HG23 VAL 77 2HG2 VAL 77 16.921 -1.339 -3.112 619 H MET 78 H MET 78 18.795 2.183 -1.311 620 HA MET 78 HA MET 78 16.238 1.946 -0.121 621 HB2 MET 78 2HB MET 78 18.662 3.574 0.301 622 HB3 MET 78 3HB MET 78 17.163 4.309 0.853 623 HG2 MET 78 2HG MET 78 16.709 2.192 2.119 624 HG3 MET 78 3HG MET 78 18.346 1.684 1.710 625 HE1 MET 78 3HE MET 78 20.296 2.161 2.883 626 HE2 MET 78 1HE MET 78 20.469 3.813 2.290 627 HE3 MET 78 2HE MET 78 20.613 3.477 4.015 628 H LYS 79 H LYS 79 17.719 4.606 -1.977 629 HA LYS 79 HA LYS 79 15.503 6.289 -2.048 630 HB2 LYS 79 2HB LYS 79 17.643 5.936 -4.155 631 HB3 LYS 79 3HB LYS 79 16.554 7.311 -4.030 632 HG2 LYS 79 2HG LYS 79 17.644 8.190 -2.227 633 HG3 LYS 79 3HG LYS 79 18.225 6.619 -1.672 634 HD2 LYS 79 2HD LYS 79 19.654 6.638 -3.820 635 HD3 LYS 79 3HD LYS 79 19.305 8.368 -3.858 636 HE2 LYS 79 2HE LYS 79 20.402 7.030 -1.404 637 HE3 LYS 79 3HE LYS 79 21.457 7.600 -2.696 638 HZ1 LYS 79 3HZ LYS 79 20.188 9.799 -2.388 639 HZ2 LYS 79 1HZ LYS 79 21.375 9.385 -1.256 640 HZ3 LYS 79 2HZ LYS 79 19.740 9.166 -0.884 641 H ILE 80 H ILE 80 16.373 3.585 -4.135 642 HA ILE 80 HA ILE 80 14.380 3.991 -6.092 643 HB ILE 80 HB ILE 80 15.725 1.421 -5.251 644 HG12 ILE 80 2HG1 ILE 80 16.395 2.898 -7.753 645 HG13 ILE 80 3HG1 ILE 80 17.004 3.539 -6.231 646 HG21 ILE 80 1HG2 ILE 80 15.057 1.136 -7.880 647 HG22 ILE 80 2HG2 ILE 80 14.141 0.480 -6.525 648 HG23 ILE 80 3HG2 ILE 80 13.669 2.019 -7.244 649 HD11 ILE 80 3HD1 ILE 80 17.576 0.823 -6.135 650 HD12 ILE 80 1HD1 ILE 80 17.934 1.309 -7.792 651 HD13 ILE 80 2HD1 ILE 80 18.706 2.142 -6.442 652 H ILE 81 H ILE 81 14.473 1.777 -3.299 653 HA ILE 81 HA ILE 81 11.868 0.776 -3.612 654 HB ILE 81 HB ILE 81 13.539 1.020 -1.109 655 HG12 ILE 81 2HG1 ILE 81 13.024 -1.406 -2.834 656 HG13 ILE 81 3HG1 ILE 81 14.426 -0.362 -3.036 657 HG21 ILE 81 1HG2 ILE 81 11.764 -1.121 -0.861 658 HG22 ILE 81 2HG2 ILE 81 11.727 0.405 0.019 659 HG23 ILE 81 3HG2 ILE 81 10.797 0.223 -1.467 660 HD11 ILE 81 3HD1 ILE 81 15.491 -1.284 -1.315 661 HD12 ILE 81 1HD1 ILE 81 14.052 -1.266 -0.295 662 HD13 ILE 81 2HD1 ILE 81 14.300 -2.578 -1.448 663 H ASP 82 H ASP 82 13.110 3.599 -1.919 664 HA ASP 82 HA ASP 82 10.684 4.242 -0.580 665 HB2 ASP 82 2HB ASP 82 12.720 5.139 0.298 666 HB3 ASP 82 3HB ASP 82 13.135 5.874 -1.248 667 H GLU 83 H GLU 83 12.200 5.425 -3.566 668 HA GLU 83 HA GLU 83 10.212 7.312 -4.208 669 HB2 GLU 83 2HB GLU 83 12.285 5.860 -5.829 670 HB3 GLU 83 3HB GLU 83 11.128 6.938 -6.598 671 HG2 GLU 83 2HG GLU 83 12.876 7.809 -4.320 672 HG3 GLU 83 3HG GLU 83 13.381 7.915 -6.006 673 H PHE 84 H PHE 84 10.723 4.008 -5.444 674 HA PHE 84 HA PHE 84 8.325 3.953 -6.955 675 HB2 PHE 84 2HB PHE 84 10.274 1.868 -6.029 676 HB3 PHE 84 3HB PHE 84 8.762 1.386 -6.790 677 HD1 PHE 84 HD1 PHE 84 11.745 3.538 -7.320 678 HD2 PHE 84 HD2 PHE 84 8.610 1.274 -9.098 679 HE1 PHE 84 HE1 PHE 84 12.760 3.880 -9.536 680 HE2 PHE 84 HE2 PHE 84 9.620 1.611 -11.316 681 HZ PHE 84 HZ PHE 84 11.698 2.914 -11.537 682 H LYS 85 H LYS 85 8.924 3.701 -3.633 683 HA LYS 85 HA LYS 85 7.611 3.248 -1.832 684 HB2 LYS 85 2HB LYS 85 5.346 3.388 -3.831 685 HB3 LYS 85 3HB LYS 85 5.193 3.500 -2.083 686 HG2 LYS 85 2HG LYS 85 6.973 5.441 -3.451 687 HG3 LYS 85 3HG LYS 85 5.228 5.641 -3.622 688 HD2 LYS 85 2HD LYS 85 5.104 5.472 -1.094 689 HD3 LYS 85 3HD LYS 85 6.862 5.637 -1.094 690 HE2 LYS 85 2HE LYS 85 5.055 7.610 -2.466 691 HE3 LYS 85 3HE LYS 85 5.498 7.762 -0.766 692 HZ1 LYS 85 3HZ LYS 85 7.703 7.355 -2.606 693 HZ2 LYS 85 1HZ LYS 85 7.579 8.391 -1.274 694 HZ3 LYS 85 2HZ LYS 85 6.898 8.835 -2.757 695 H ILE 86 H ILE 86 8.826 1.065 -2.590 696 HA ILE 86 HA ILE 86 6.992 -1.073 -3.225 697 HB ILE 86 HB ILE 86 9.862 -1.320 -2.330 698 HG12 ILE 86 2HG1 ILE 86 8.784 -1.114 -5.150 699 HG13 ILE 86 3HG1 ILE 86 9.636 0.173 -4.303 700 HG21 ILE 86 1HG2 ILE 86 8.206 -3.315 -2.390 701 HG22 ILE 86 2HG2 ILE 86 8.408 -3.204 -4.138 702 HG23 ILE 86 3HG2 ILE 86 9.808 -3.499 -3.106 703 HD11 ILE 86 3HD1 ILE 86 11.032 -1.105 -5.904 704 HD12 ILE 86 1HD1 ILE 86 11.649 -1.106 -4.252 705 HD13 ILE 86 2HD1 ILE 86 10.819 -2.528 -4.886 706 HA PRO 87 HA PRO 87 5.852 -1.902 0.971 707 HB2 PRO 87 2HB PRO 87 4.688 -4.315 0.536 708 HB3 PRO 87 3HB PRO 87 3.919 -2.785 0.099 709 HG2 PRO 87 2HG PRO 87 5.423 -4.710 -1.631 710 HG3 PRO 87 3HG PRO 87 3.912 -3.847 -1.969 711 HD2 PRO 87 2HD PRO 87 6.304 -3.032 -2.942 712 HD3 PRO 87 3HD PRO 87 5.004 -1.896 -2.529 713 H THR 88 H THR 88 6.168 -3.602 2.614 714 HA THR 88 HA THR 88 8.778 -4.878 2.257 715 HB THR 88 HB THR 88 7.714 -5.178 4.918 716 HG1 THR 88 HG1 THR 88 7.536 -2.965 5.428 717 HG21 THR 88 3HG2 THR 88 9.766 -3.714 5.391 718 HG22 THR 88 1HG2 THR 88 10.070 -3.801 3.657 719 HG23 THR 88 2HG2 THR 88 10.041 -5.277 4.622 720 H VAL 89 H VAL 89 9.062 -7.016 3.419 721 HA VAL 89 HA VAL 89 7.561 -9.001 2.234 722 HB VAL 89 HB VAL 89 9.054 -9.180 4.854 723 HG11 VAL 89 1HG1 VAL 89 7.411 -11.082 3.523 724 HG12 VAL 89 2HG1 VAL 89 9.090 -11.615 3.406 725 HG13 VAL 89 3HG1 VAL 89 8.375 -11.288 4.985 726 HG21 VAL 89 3HG2 VAL 89 9.949 -9.763 2.032 727 HG22 VAL 89 1HG2 VAL 89 10.452 -8.390 3.018 728 HG23 VAL 89 2HG2 VAL 89 10.903 -10.028 3.491 729 H GLU 90 H GLU 90 7.304 -7.900 5.618 730 HA GLU 90 HA GLU 90 5.192 -9.482 6.421 731 HB2 GLU 90 2HB GLU 90 5.734 -6.617 7.221 732 HB3 GLU 90 3HB GLU 90 4.711 -7.744 8.101 733 HG2 GLU 90 2HG GLU 90 6.562 -9.107 8.681 734 HG3 GLU 90 3HG GLU 90 7.627 -8.239 7.576 735 H GLN 91 H GLN 91 5.005 -6.214 5.017 736 HA GLN 91 HA GLN 91 2.231 -5.982 4.981 737 HB2 GLN 91 2HB GLN 91 4.088 -4.844 2.891 738 HB3 GLN 91 3HB GLN 91 2.524 -4.212 3.389 739 HG2 GLN 91 2HG GLN 91 5.112 -4.186 4.901 740 HG3 GLN 91 3HG GLN 91 4.125 -2.820 4.385 741 HE21 GLN 91 1HE2 GLN 91 5.122 -4.120 7.039 742 HE22 GLN 91 2HE2 GLN 91 3.724 -4.020 8.049 743 H TRP 92 H TRP 92 4.427 -7.366 2.577 744 HA TRP 92 HA TRP 92 2.514 -7.849 0.576 745 HB2 TRP 92 2HB TRP 92 4.981 -7.937 0.241 746 HB3 TRP 92 3HB TRP 92 5.019 -9.448 1.145 747 HD1 TRP 92 HD1 TRP 92 3.029 -8.150 -1.942 748 HE1 TRP 92 HE1 TRP 92 2.982 -10.038 -3.691 749 HE3 TRP 92 HE3 TRP 92 5.637 -11.712 0.637 750 HZ2 TRP 92 HZ2 TRP 92 3.924 -12.687 -3.943 751 HZ3 TRP 92 HZ3 TRP 92 6.020 -13.896 -0.429 752 HH2 TRP 92 HH2 TRP 92 5.180 -14.372 -2.671 753 H LYS 93 H LYS 93 3.570 -9.780 3.334 754 HA LYS 93 HA LYS 93 2.176 -12.141 2.662 755 HB2 LYS 93 2HB LYS 93 2.974 -11.105 5.389 756 HB3 LYS 93 3HB LYS 93 2.480 -12.754 5.028 757 HG2 LYS 93 2HG LYS 93 4.773 -11.578 3.537 758 HG3 LYS 93 3HG LYS 93 5.009 -12.114 5.202 759 HD2 LYS 93 2HD LYS 93 5.385 -14.132 4.304 760 HD3 LYS 93 3HD LYS 93 3.633 -14.212 4.103 761 HE2 LYS 93 2HE LYS 93 4.327 -12.832 1.885 762 HE3 LYS 93 3HE LYS 93 5.762 -13.834 2.100 763 HZ1 LYS 93 3HZ LYS 93 4.482 -15.236 0.878 764 HZ2 LYS 93 1HZ LYS 93 3.019 -14.626 1.470 765 HZ3 LYS 93 2HZ LYS 93 3.939 -15.682 2.417 766 H ASP 94 H ASP 94 1.338 -9.522 4.930 767 HA ASP 94 HA ASP 94 -1.189 -10.483 5.640 768 HB2 ASP 94 2HB ASP 94 0.040 -8.657 6.813 769 HB3 ASP 94 3HB ASP 94 -0.339 -7.585 5.468 770 H GLN 95 H GLN 95 -0.153 -8.487 2.931 771 HA GLN 95 HA GLN 95 -2.715 -7.745 2.019 772 HB2 GLN 95 2HB GLN 95 -0.040 -7.970 0.655 773 HB3 GLN 95 3HB GLN 95 -1.483 -7.462 -0.212 774 HG2 GLN 95 2HG GLN 95 -1.591 -5.453 0.853 775 HG3 GLN 95 3HG GLN 95 -0.810 -6.058 2.312 776 HE21 GLN 95 1HE2 GLN 95 0.188 -6.141 -1.083 777 HE22 GLN 95 2HE2 GLN 95 1.675 -5.295 -0.848 778 H THR 96 H THR 96 -0.528 -10.319 0.879 779 HA THR 96 HA THR 96 -2.290 -11.440 -0.986 780 HB THR 96 HB THR 96 -0.883 -13.600 -0.436 781 HG1 THR 96 HG1 THR 96 0.058 -12.904 1.478 782 HG21 THR 96 3HG2 THR 96 0.933 -12.743 -1.858 783 HG22 THR 96 1HG2 THR 96 0.334 -11.101 -1.621 784 HG23 THR 96 2HG2 THR 96 -0.654 -12.286 -2.476 785 H ARG 97 H ARG 97 -1.740 -12.221 2.431 786 HA ARG 97 HA ARG 97 -3.408 -14.449 2.610 787 HB2 ARG 97 2HB ARG 97 -2.587 -12.374 4.633 788 HB3 ARG 97 3HB ARG 97 -3.619 -13.731 5.062 789 HG2 ARG 97 2HG ARG 97 -0.953 -14.127 3.748 790 HG3 ARG 97 3HG ARG 97 -1.123 -13.962 5.497 791 HD2 ARG 97 2HD ARG 97 -2.652 -15.982 3.872 792 HD3 ARG 97 3HD ARG 97 -1.088 -16.324 4.612 793 HE ARG 97 HE ARG 97 -2.674 -15.348 6.637 794 HH11 ARG 97 1HH1 ARG 97 -2.779 -18.024 4.413 795 HH12 ARG 97 2HH1 ARG 97 -3.654 -19.058 5.494 796 HH21 ARG 97 1HH2 ARG 97 -3.826 -16.699 8.069 797 HH22 ARG 97 2HH2 ARG 97 -4.250 -18.303 7.573 798 H ARG 98 H ARG 98 -4.184 -11.090 3.539 799 HA ARG 98 HA ARG 98 -6.894 -11.495 4.035 800 HB2 ARG 98 2HB ARG 98 -5.384 -9.044 3.134 801 HB3 ARG 98 3HB ARG 98 -7.094 -9.010 3.541 802 HG2 ARG 98 2HG ARG 98 -6.281 -10.101 5.773 803 HG3 ARG 98 3HG ARG 98 -4.731 -9.396 5.310 804 HD2 ARG 98 2HD ARG 98 -5.641 -7.202 5.281 805 HD3 ARG 98 3HD ARG 98 -7.289 -7.816 5.410 806 HE ARG 98 HE ARG 98 -6.003 -8.711 7.663 807 HH11 ARG 98 1HH1 ARG 98 -6.649 -5.615 6.208 808 HH12 ARG 98 2HH1 ARG 98 -6.698 -4.769 7.720 809 HH21 ARG 98 1HH2 ARG 98 -6.065 -7.608 9.659 810 HH22 ARG 98 2HH2 ARG 98 -6.364 -5.904 9.682 811 H TYR 99 H TYR 99 -5.200 -10.810 1.027 812 HA TYR 99 HA TYR 99 -7.434 -10.250 -0.578 813 HB2 TYR 99 2HB TYR 99 -5.249 -9.720 -1.400 814 HB3 TYR 99 3HB TYR 99 -4.722 -11.393 -1.256 815 HD1 TYR 99 HD2 TYR 99 -7.483 -9.499 -2.932 816 HD2 TYR 99 HD1 TYR 99 -4.541 -12.558 -3.230 817 HE1 TYR 99 HE2 TYR 99 -8.148 -9.904 -5.265 818 HE2 TYR 99 HE1 TYR 99 -5.196 -12.970 -5.565 819 HH TYR 99 HH TYR 99 -6.970 -10.882 -7.371 820 H LYS 100 H LYS 100 -5.769 -13.302 0.119 821 HA LYS 100 HA LYS 100 -7.537 -14.853 -1.526 822 HB2 LYS 100 2HB LYS 100 -5.258 -15.417 0.304 823 HB3 LYS 100 3HB LYS 100 -6.377 -16.732 -0.030 824 HG2 LYS 100 2HG LYS 100 -5.955 -15.926 -2.530 825 HG3 LYS 100 3HG LYS 100 -4.435 -15.389 -1.812 826 HD2 LYS 100 2HD LYS 100 -3.840 -17.517 -2.375 827 HD3 LYS 100 3HD LYS 100 -4.503 -17.828 -0.768 828 HE2 LYS 100 2HE LYS 100 -5.566 -19.445 -2.012 829 HE3 LYS 100 3HE LYS 100 -6.745 -18.136 -2.075 830 HZ1 LYS 100 3HZ LYS 100 -6.565 -18.069 -4.268 831 HZ2 LYS 100 1HZ LYS 100 -5.563 -19.431 -4.212 832 HZ3 LYS 100 2HZ LYS 100 -4.885 -17.882 -4.191 833 H GLU 101 H GLU 101 -7.487 -13.781 1.765 834 HA GLU 101 HA GLU 101 -9.266 -15.734 2.824 835 HB2 GLU 101 2HB GLU 101 -8.419 -12.996 3.755 836 HB3 GLU 101 3HB GLU 101 -9.588 -13.964 4.643 837 HG2 GLU 101 2HG GLU 101 -8.020 -15.565 5.222 838 HG3 GLU 101 3HG GLU 101 -6.920 -15.100 3.925 839 H SER 102 H SER 102 -11.329 -14.637 4.013 840 HA SER 102 HA SER 102 -13.472 -13.923 3.747 841 HB2 SER 102 2HB SER 102 -12.248 -11.749 3.269 842 HB3 SER 102 3HB SER 102 -12.445 -12.114 1.555 843 HG SER 102 HG SER 102 -14.136 -10.837 2.951 844 H SER 103 H SER 103 -12.718 -16.242 2.393 845 HA SER 103 HA SER 103 -14.268 -16.060 -0.106 846 HB2 SER 103 2HB SER 103 -12.265 -18.205 0.628 847 HB3 SER 103 3HB SER 103 -13.034 -17.956 -0.940 848 HG SER 103 HG SER 103 -11.374 -16.746 -1.353 849 H ILE 104 H ILE 104 -15.497 -18.050 -0.664 850 HA ILE 104 HA ILE 104 -17.324 -18.708 1.344 851 HB ILE 104 HB ILE 104 -16.769 -20.382 -1.103 852 HG12 ILE 104 2HG1 ILE 104 -18.953 -18.515 -1.390 853 HG13 ILE 104 3HG1 ILE 104 -17.461 -17.656 -1.021 854 HG21 ILE 104 1HG2 ILE 104 -18.269 -21.493 0.354 855 HG22 ILE 104 2HG2 ILE 104 -19.170 -20.011 0.670 856 HG23 ILE 104 3HG2 ILE 104 -19.254 -20.773 -0.919 857 HD11 ILE 104 3HD1 ILE 104 -17.684 -17.793 -3.385 858 HD12 ILE 104 1HD1 ILE 104 -16.381 -18.877 -2.900 859 HD13 ILE 104 2HD1 ILE 104 -17.965 -19.532 -3.313 860 H GLN 105 H GLN 105 -17.440 -20.284 2.837 861 HA GLN 105 HA GLN 105 -16.183 -22.775 2.733 862 HB2 GLN 105 2HB GLN 105 -14.492 -20.590 3.668 863 HB3 GLN 105 3HB GLN 105 -14.636 -21.884 4.849 864 HG2 GLN 105 2HG GLN 105 -14.174 -23.322 2.621 865 HG3 GLN 105 3HG GLN 105 -13.294 -21.844 2.234 866 HE21 GLN 105 1HE2 GLN 105 -12.535 -24.685 3.018 867 HE22 GLN 105 2HE2 GLN 105 -11.356 -24.466 4.262 868 H ILE 106 H ILE 106 -16.244 -23.915 4.868 869 HA ILE 106 HA ILE 106 -18.188 -22.706 6.713 870 HB ILE 106 HB ILE 106 -18.292 -25.570 5.761 871 HG12 ILE 106 2HG1 ILE 106 -19.017 -24.018 4.008 872 HG13 ILE 106 3HG1 ILE 106 -20.387 -24.920 4.647 873 HG21 ILE 106 1HG2 ILE 106 -19.644 -24.059 7.907 874 HG22 ILE 106 2HG2 ILE 106 -20.656 -25.139 6.950 875 HG23 ILE 106 3HG2 ILE 106 -19.247 -25.773 7.801 876 HD11 ILE 106 3HD1 ILE 106 -20.068 -22.126 4.425 877 HD12 ILE 106 1HD1 ILE 106 -21.434 -23.027 5.082 878 HD13 ILE 106 2HD1 ILE 106 -20.119 -22.522 6.143 879 H GLY 107 H GLY 107 -17.184 -22.519 8.605 880 HA2 GLY 107 2HA GLY 107 -16.407 -24.593 10.222 881 HA3 GLY 107 3HA GLY 107 -14.952 -24.160 9.336 882 H ASN 108 H ASN 108 -17.153 -23.265 11.838 883 HA ASN 108 HA ASN 108 -15.956 -20.658 12.248 884 HB2 ASN 108 2HB ASN 108 -17.488 -20.608 14.253 885 HB3 ASN 108 3HB ASN 108 -18.301 -20.796 12.702 886 HD21 ASN 108 1HD2 ASN 108 -17.707 -22.142 15.774 887 HD22 ASN 108 2HD2 ASN 108 -18.630 -23.589 15.575 888 H GLY 109 H GLY 109 -14.733 -20.043 14.050 889 HA2 GLY 109 2HA GLY 109 -14.023 -21.766 16.169 890 HA3 GLY 109 3HA GLY 109 -12.791 -21.859 14.919 891 H HIS 110 H HIS 110 -14.716 -19.186 16.281 892 HA HIS 110 HA HIS 110 -12.183 -17.758 16.760 893 HB2 HIS 110 2HB HIS 110 -14.900 -16.541 16.228 894 HB3 HIS 110 3HB HIS 110 -13.379 -15.672 16.408 895 HD1 HIS 110 HD1 HIS 110 -15.048 -18.129 14.055 896 HD2 HIS 110 HD2 HIS 110 -11.987 -15.321 14.088 897 HE1 HIS 110 HE1 HIS 110 -14.283 -17.940 11.667 898 H GLY 111 H GLY 111 -12.369 -16.069 18.523 899 HA2 GLY 111 2HA GLY 111 -14.346 -16.417 20.557 900 HA3 GLY 111 3HA GLY 111 -12.845 -17.230 20.973 901 H GLN 112 H GLN 112 -12.677 -15.796 22.781 902 HA GLN 112 HA GLN 112 -12.346 -12.969 22.295 903 HB2 GLN 112 2HB GLN 112 -11.842 -14.559 24.816 904 HB3 GLN 112 3HB GLN 112 -11.947 -12.807 24.696 905 HG2 GLN 112 2HG GLN 112 -14.191 -14.717 24.082 906 HG3 GLN 112 3HG GLN 112 -13.987 -13.840 25.598 907 HE21 GLN 112 1HE2 GLN 112 -15.342 -13.791 22.540 908 HE22 GLN 112 2HE2 GLN 112 -15.801 -12.126 22.483 909 H SER 113 H SER 113 -10.419 -11.782 22.793 910 HA SER 113 HA SER 113 -8.043 -13.146 21.868 911 HB2 SER 113 2HB SER 113 -7.118 -10.695 22.334 912 HB3 SER 113 3HB SER 113 -8.094 -11.054 20.910 913 HG SER 113 HG SER 113 -9.714 -9.945 21.721 914 H GLN 114 H GLN 114 -8.534 -10.893 24.589 915 HA GLN 114 HA GLN 114 -7.106 -12.732 26.351 916 HB2 GLN 114 2HB GLN 114 -5.478 -11.158 27.045 917 HB3 GLN 114 3HB GLN 114 -5.461 -11.124 25.287 918 HG2 GLN 114 2HG GLN 114 -6.886 -9.139 27.044 919 HG3 GLN 114 3HG GLN 114 -5.313 -8.888 26.287 920 HE21 GLN 114 1HE2 GLN 114 -8.475 -8.186 26.019 921 HE22 GLN 114 2HE2 GLN 114 -8.589 -7.930 24.314 922 H GLY 115 H GLY 115 -7.363 -12.241 28.615 923 HA2 GLY 115 2HA GLY 115 -9.791 -10.636 29.115 924 HA3 GLY 115 3HA GLY 115 -9.339 -12.063 30.036 925 H LEU 116 H LEU 116 -6.464 -10.998 29.898 926 HA LEU 116 HA LEU 116 -5.179 -10.146 31.628 927 HB2 LEU 116 2HB LEU 116 -5.656 -7.532 31.621 928 HB3 LEU 116 3HB LEU 116 -4.809 -8.350 30.310 929 HG LEU 116 HG LEU 116 -7.203 -8.519 29.265 930 HD11 LEU 116 1HD1 LEU 116 -8.832 -7.499 30.364 931 HD12 LEU 116 2HD1 LEU 116 -7.976 -5.968 30.188 932 HD13 LEU 116 3HD1 LEU 116 -7.698 -6.975 31.609 933 HD21 LEU 116 3HD2 LEU 116 -5.451 -6.079 29.367 934 HD22 LEU 116 1HD2 LEU 116 -6.846 -6.201 28.295 935 HD23 LEU 116 2HD2 LEU 116 -5.508 -7.339 28.133 936 H GLU 117 H GLU 117 -7.201 -11.356 32.904 937 HA GLU 117 HA GLU 117 -8.240 -9.391 34.828 938 HB2 GLU 117 2HB GLU 117 -9.748 -11.084 33.537 939 HB3 GLU 117 3HB GLU 117 -9.142 -12.248 34.706 940 HG2 GLU 117 2HG GLU 117 -11.244 -11.393 35.466 941 HG3 GLU 117 3HG GLU 117 -9.966 -10.799 36.525 942 H1 GLY -9 H GLY -9 4.850 -10.035 9.109 943 HA2 GLY -9 2HA GLY -9 4.638 -11.718 7.170 944 HA3 GLY -9 3HA GLY -9 6.270 -11.292 7.665 945 H LYS -8 H LYS -8 6.177 -13.582 6.440 946 HA LYS -8 HA LYS -8 6.180 -15.622 8.567 947 HB2 LYS -8 2HB LYS -8 5.397 -15.826 5.668 948 HB3 LYS -8 3HB LYS -8 5.860 -17.248 6.595 949 HG2 LYS -8 2HG LYS -8 3.795 -17.408 7.362 950 HG3 LYS -8 3HG LYS -8 3.957 -15.826 8.128 951 HD2 LYS -8 2HD LYS -8 2.033 -15.817 6.671 952 HD3 LYS -8 3HD LYS -8 3.282 -14.770 5.993 953 HE2 LYS -8 2HE LYS -8 2.365 -16.058 4.206 954 HE3 LYS -8 3HE LYS -8 3.980 -16.680 4.541 955 HZ1 LYS -8 3HZ LYS -8 3.167 -18.625 5.346 956 HZ2 LYS -8 1HZ LYS -8 1.919 -18.266 4.262 957 HZ3 LYS -8 2HZ LYS -8 1.726 -17.941 5.911 958 H PHE -7 H PHE -7 7.820 -14.266 5.792 959 HA PHE -7 HA PHE -7 9.939 -16.194 5.768 960 HB2 PHE -7 2HB PHE -7 9.613 -13.492 4.462 961 HB3 PHE -7 3HB PHE -7 11.049 -14.488 4.253 962 HD1 PHE -7 HD2 PHE -7 7.340 -14.719 3.959 963 HD2 PHE -7 HD1 PHE -7 11.138 -15.922 2.461 964 HE1 PHE -7 HE2 PHE -7 6.230 -15.924 2.123 965 HE2 PHE -7 HE1 PHE -7 10.034 -17.128 0.622 966 HZ PHE -7 HZ PHE -7 7.577 -17.131 0.452 967 H ILE -6 H ILE -6 10.262 -12.683 6.212 968 HA ILE -6 HA ILE -6 11.697 -11.452 7.486 969 HB ILE -6 HB ILE -6 10.999 -13.615 9.472 970 HG12 ILE -6 2HG1 ILE -6 9.619 -11.615 10.382 971 HG13 ILE -6 3HG1 ILE -6 9.857 -10.920 8.783 972 HG21 ILE -6 1HG2 ILE -6 12.679 -12.797 10.697 973 HG22 ILE -6 2HG2 ILE -6 12.874 -11.393 9.649 974 HG23 ILE -6 3HG2 ILE -6 11.655 -11.379 10.922 975 HD11 ILE -6 3HD1 ILE -6 7.789 -12.515 9.490 976 HD12 ILE -6 1HD1 ILE -6 8.363 -12.286 7.839 977 HD13 ILE -6 2HD1 ILE -6 8.898 -13.684 8.773 978 HA PRO -5 HA PRO -5 15.328 -14.122 6.525 979 HB2 PRO -5 2HB PRO -5 16.692 -12.164 5.231 980 HB3 PRO -5 3HB PRO -5 15.487 -13.182 4.434 981 HG2 PRO -5 2HG PRO -5 15.203 -10.406 5.518 982 HG3 PRO -5 3HG PRO -5 14.596 -11.080 3.994 983 HD2 PRO -5 2HD PRO -5 13.021 -10.753 6.173 984 HD3 PRO -5 3HD PRO -5 12.782 -12.074 5.011 985 H SER -4 H SER -4 16.584 -14.386 8.259 986 HA SER -4 HA SER -4 17.562 -12.004 9.680 987 HB2 SER -4 2HB SER -4 16.317 -13.460 11.138 988 HB3 SER -4 3HB SER -4 17.229 -14.869 10.595 989 HG SER -4 HG SER -4 18.845 -14.326 11.857 990 H ARG -3 H ARG -3 18.561 -13.914 7.304 991 HA ARG -3 HA ARG -3 20.999 -15.013 7.975 992 HB2 ARG -3 2HB ARG -3 19.702 -14.094 5.526 993 HB3 ARG -3 3HB ARG -3 21.454 -13.956 5.460 994 HG2 ARG -3 2HG ARG -3 20.895 -16.073 4.573 995 HG3 ARG -3 3HG ARG -3 21.571 -16.358 6.179 996 HD2 ARG -3 2HD ARG -3 19.621 -17.744 5.868 997 HD3 ARG -3 3HD ARG -3 19.279 -16.510 7.080 998 HE ARG -3 HE ARG -3 18.408 -15.440 4.715 999 HH11 ARG -3 1HH1 ARG -3 17.741 -18.333 6.534 1000 HH12 ARG -3 2HH1 ARG -3 16.104 -18.461 5.979 1001 HH21 ARG -3 1HH2 ARG -3 16.255 -15.598 3.977 1002 HH22 ARG -3 2HH2 ARG -3 15.261 -16.905 4.524 1003 HA PRO -2 HA PRO -2 23.852 -11.790 8.819 1004 HB2 PRO -2 2HB PRO -2 26.087 -12.594 7.505 1005 HB3 PRO -2 3HB PRO -2 25.492 -13.392 8.965 1006 HG2 PRO -2 2HG PRO -2 25.152 -14.188 6.100 1007 HG3 PRO -2 3HG PRO -2 25.535 -15.201 7.504 1008 HD2 PRO -2 2HD PRO -2 23.042 -15.042 6.460 1009 HD3 PRO -2 3HD PRO -2 23.337 -15.299 8.191 1010 H ALA -1 H ALA -1 22.860 -12.381 5.613 1011 HA ALA -1 HA ALA -1 22.712 -11.062 3.764 1012 HB1 ALA -1 1HB ALA -1 22.889 -9.197 5.986 1013 HB2 ALA -1 2HB ALA -1 23.506 -8.521 4.477 1014 HB3 ALA -1 3HB ALA -1 21.862 -9.157 4.552 1015 HA PRO 0 HA PRO 0 27.253 -11.480 3.096 1016 HB2 PRO 0 2HB PRO 0 26.998 -12.883 0.786 1017 HB3 PRO 0 3HB PRO 0 26.963 -13.644 2.381 1018 HG2 PRO 0 2HG PRO 0 24.685 -12.887 0.593 1019 HG3 PRO 0 3HG PRO 0 24.918 -14.367 1.542 1020 HD2 PRO 0 2HD PRO 0 23.314 -12.346 2.364 1021 HD3 PRO 0 3HD PRO 0 24.215 -13.373 3.499 1022 H LYS 1 H LYS 1 28.491 -10.165 1.859 1023 HA LYS 1 HA LYS 1 27.129 -8.264 0.141 1024 HB2 LYS 1 2HB LYS 1 29.847 -8.448 1.377 1025 HB3 LYS 1 3HB LYS 1 29.611 -7.393 -0.010 1026 HG2 LYS 1 2HG LYS 1 27.715 -6.332 1.272 1027 HG3 LYS 1 3HG LYS 1 28.280 -7.237 2.678 1028 HD2 LYS 1 2HD LYS 1 30.255 -5.618 1.149 1029 HD3 LYS 1 3HD LYS 1 29.110 -4.775 2.194 1030 HE2 LYS 1 2HE LYS 1 30.806 -7.079 3.129 1031 HE3 LYS 1 3HE LYS 1 31.323 -5.397 3.243 1032 HZ1 LYS 1 3HZ LYS 1 29.404 -6.845 4.839 1033 HZ2 LYS 1 1HZ LYS 1 28.872 -5.316 4.346 1034 HZ3 LYS 1 2HZ LYS 1 30.312 -5.469 5.220 1035 HA PRO 2 HA PRO 2 28.267 -9.944 -3.749 1036 HB2 PRO 2 2HB PRO 2 28.879 -7.722 -5.183 1037 HB3 PRO 2 3HB PRO 2 27.225 -8.143 -4.723 1038 HG2 PRO 2 2HG PRO 2 29.108 -6.197 -3.447 1039 HG3 PRO 2 3HG PRO 2 27.377 -6.019 -3.788 1040 HD2 PRO 2 2HD PRO 2 28.321 -6.638 -1.327 1041 HD3 PRO 2 3HD PRO 2 26.758 -7.229 -1.926 1042 HA PRO 3 HA PRO 3 32.609 -10.459 -4.210 1043 HB2 PRO 3 2HB PRO 3 32.898 -10.677 -6.901 1044 HB3 PRO 3 3HB PRO 3 32.163 -11.941 -5.908 1045 HG2 PRO 3 2HG PRO 3 30.843 -9.835 -7.576 1046 HG3 PRO 3 3HG PRO 3 30.435 -11.553 -7.415 1047 HD2 PRO 3 2HD PRO 3 29.080 -9.606 -6.110 1048 HD3 PRO 3 3HD PRO 3 29.310 -11.230 -5.430 1049 H SER 4 H SER 4 33.542 -8.545 -3.525 1050 HA SER 4 HA SER 4 33.747 -6.321 -5.402 1051 HB2 SER 4 2HB SER 4 34.948 -6.386 -2.641 1052 HB3 SER 4 3HB SER 4 34.425 -4.989 -3.582 1053 HG SER 4 HG SER 4 32.993 -5.720 -1.823 1054 H SER 5 H SER 5 35.915 -5.224 -5.560 1055 HA SER 5 HA SER 5 38.256 -6.862 -5.220 1056 HB2 SER 5 2HB SER 5 38.836 -6.819 -7.672 1057 HB3 SER 5 3HB SER 5 37.489 -7.879 -7.258 1058 HG SER 5 HG SER 5 37.210 -5.223 -8.219 1059 H ALA 6 H ALA 6 40.091 -5.659 -5.146 1060 HA ALA 6 HA ALA 6 39.805 -2.785 -5.735 1061 HB1 ALA 6 1HB ALA 6 40.415 -2.429 -3.633 1062 HB2 ALA 6 2HB ALA 6 40.683 -4.153 -3.375 1063 HB3 ALA 6 3HB ALA 6 41.985 -3.143 -4.004
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