NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
649617 | 6s10 | 27453 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 27.587 6.096 17.822 2 HA2 GLY 1 HA2 GLY 1 26.588 6.793 15.664 3 HA3 GLY 1 HA3 GLY 1 28.312 7.151 15.789 4 H SER 2 H SER 2 25.991 4.634 14.499 5 HA SER 2 HA SER 2 27.794 4.343 12.219 6 HB2 SER 2 HB2 SER 2 27.765 1.910 12.348 7 HB3 SER 2 HB3 SER 2 28.570 2.605 13.755 8 HG SER 2 HG SER 2 26.869 0.822 13.866 9 H ASN 3 H ASN 3 26.798 3.114 10.512 10 HA ASN 3 HA ASN 3 24.114 4.059 9.943 11 HB2 ASN 3 HB2 ASN 3 25.947 2.130 8.444 12 HB3 ASN 3 HB3 ASN 3 24.452 2.804 7.813 13 HD21 ASN 3 HD21 ASN 3 25.627 3.694 5.997 14 HD22 ASN 3 HD22 ASN 3 26.584 5.136 6.198 15 H GLN 4 H GLN 4 22.339 2.422 9.194 16 HA GLN 4 HA GLN 4 22.510 -0.243 10.387 17 HB2 GLN 4 HB2 GLN 4 21.777 1.729 12.057 18 HB3 GLN 4 HB3 GLN 4 20.233 1.558 11.255 19 HG2 GLN 4 HG2 GLN 4 21.750 -0.735 12.592 20 HG3 GLN 4 HG3 GLN 4 20.612 0.313 13.440 21 HE21 GLN 4 HE21 GLN 4 20.840 -2.600 11.658 22 HE22 GLN 4 HE22 GLN 4 19.136 -2.769 11.321 23 H GLN 5 H GLN 5 20.497 -1.566 9.637 24 HA GLN 5 HA GLN 5 18.826 -0.487 7.536 25 HB2 GLN 5 HB2 GLN 5 21.174 -1.010 6.505 26 HB3 GLN 5 HB3 GLN 5 20.796 -2.701 6.775 27 HG2 GLN 5 HG2 GLN 5 18.859 -2.497 5.268 28 HG3 GLN 5 HG3 GLN 5 19.113 -0.751 5.163 29 HE21 GLN 5 HE21 GLN 5 20.081 -0.162 3.223 30 HE22 GLN 5 HE22 GLN 5 21.367 -1.032 2.443 31 H LEU 6 H LEU 6 16.933 -1.849 7.497 32 HA LEU 6 HA LEU 6 17.163 -4.546 8.776 33 HB2 LEU 6 HB2 LEU 6 15.168 -2.368 9.458 34 HB3 LEU 6 HB3 LEU 6 14.989 -4.056 9.937 35 HG LEU 6 HG LEU 6 17.331 -2.314 10.738 36 HD11 LEU 6 HD11 LEU 6 14.895 -3.126 12.358 37 HD12 LEU 6 HD12 LEU 6 16.278 -2.140 12.905 38 HD13 LEU 6 HD13 LEU 6 15.187 -1.510 11.666 39 HD21 LEU 6 HD21 LEU 6 17.914 -4.709 10.825 40 HD22 LEU 6 HD22 LEU 6 17.709 -4.085 12.462 41 HD23 LEU 6 HD23 LEU 6 16.422 -5.059 11.725 42 H ASN 7 H ASN 7 17.041 -5.450 6.712 43 HA ASN 7 HA ASN 7 14.336 -5.279 5.454 44 HB2 ASN 7 HB2 ASN 7 15.259 -5.240 3.451 45 HB3 ASN 7 HB3 ASN 7 16.779 -4.858 4.234 46 HD21 ASN 7 HD21 ASN 7 18.397 -6.613 4.441 47 HD22 ASN 7 HD22 ASN 7 18.197 -8.104 3.524 48 H ALA 8 H ALA 8 13.364 -7.198 4.815 49 HA ALA 8 HA ALA 8 12.546 -9.240 4.979 50 HB1 ALA 8 HB1 ALA 8 14.727 -9.835 3.867 51 HB2 ALA 8 HB2 ALA 8 15.356 -10.274 5.468 52 HB3 ALA 8 HB3 ALA 8 13.982 -11.156 4.785 53 H THR 9 H THR 9 11.906 -10.988 6.218 54 HA THR 9 HA THR 9 12.561 -11.130 9.057 55 HB THR 9 HB THR 9 10.025 -11.027 9.557 56 HG1 THR 9 HG1 THR 9 10.026 -9.237 7.365 57 HG21 THR 9 HG21 THR 9 10.043 -8.689 10.108 58 HG22 THR 9 HG22 THR 9 11.653 -9.359 10.418 59 HG23 THR 9 HG23 THR 9 11.372 -8.362 8.982 60 H LYS 10 H LYS 10 9.733 -12.150 7.109 61 HA LYS 10 HA LYS 10 10.637 -14.992 7.231 62 HB2 LYS 10 HB2 LYS 10 8.342 -13.752 8.682 63 HB3 LYS 10 HB3 LYS 10 7.869 -15.100 7.677 64 HG2 LYS 10 HG2 LYS 10 8.111 -15.826 9.829 65 HG3 LYS 10 HG3 LYS 10 9.299 -16.620 8.807 66 HD2 LYS 10 HD2 LYS 10 11.117 -15.368 9.731 67 HD3 LYS 10 HD3 LYS 10 10.024 -14.207 10.507 68 HE2 LYS 10 HE2 LYS 10 10.451 -17.134 11.260 69 HE3 LYS 10 HE3 LYS 10 11.023 -15.716 12.155 70 HZ1 LYS 10 HZ1 LYS 10 9.037 -16.537 13.175 71 HZ2 LYS 10 HZ2 LYS 10 8.633 -15.117 12.429 72 HZ3 LYS 10 HZ3 LYS 10 8.234 -16.599 11.778 73 H LYS 11 H LYS 11 7.634 -13.307 6.308 74 HA LYS 11 HA LYS 11 7.371 -14.907 3.886 75 HB2 LYS 11 HB2 LYS 11 5.732 -12.525 4.889 76 HB3 LYS 11 HB3 LYS 11 5.313 -13.599 3.562 77 HG2 LYS 11 HG2 LYS 11 4.063 -14.597 5.122 78 HG3 LYS 11 HG3 LYS 11 5.551 -15.486 5.472 79 HD2 LYS 11 HD2 LYS 11 5.976 -13.729 7.320 80 HD3 LYS 11 HD3 LYS 11 4.399 -13.059 6.916 81 HE2 LYS 11 HE2 LYS 11 3.919 -14.386 8.735 82 HE3 LYS 11 HE3 LYS 11 3.450 -15.425 7.376 83 HZ1 LYS 11 HZ1 LYS 11 5.891 -15.553 9.023 84 HZ2 LYS 11 HZ2 LYS 11 4.656 -16.617 9.013 85 HZ3 LYS 11 HZ3 LYS 11 5.609 -16.544 7.689 86 H ASP 12 H ASP 12 8.147 -14.523 2.006 87 HA ASP 12 HA ASP 12 9.690 -12.264 1.285 88 HB2 ASP 12 HB2 ASP 12 8.271 -14.442 -0.281 89 HB3 ASP 12 HB3 ASP 12 9.205 -13.193 -1.084 90 H LYS 13 H LYS 13 6.255 -12.935 1.063 91 HA LYS 13 HA LYS 13 5.518 -10.855 -0.746 92 HB2 LYS 13 HB2 LYS 13 3.866 -11.954 1.583 93 HB3 LYS 13 HB3 LYS 13 3.246 -11.133 0.161 94 HG2 LYS 13 HG2 LYS 13 4.587 -13.882 0.241 95 HG3 LYS 13 HG3 LYS 13 2.869 -13.551 0.090 96 HD2 LYS 13 HD2 LYS 13 4.910 -12.700 -2.000 97 HD3 LYS 13 HD3 LYS 13 4.015 -14.217 -2.053 98 HE2 LYS 13 HE2 LYS 13 2.692 -11.496 -1.876 99 HE3 LYS 13 HE3 LYS 13 2.990 -12.349 -3.412 100 HZ1 LYS 13 HZ1 LYS 13 1.296 -13.299 -1.174 101 HZ2 LYS 13 HZ2 LYS 13 0.741 -12.737 -2.584 102 HZ3 LYS 13 HZ3 LYS 13 1.597 -14.162 -2.534 103 H LEU 14 H LEU 14 5.756 -10.912 2.897 104 HA LEU 14 HA LEU 14 5.110 -8.087 3.007 105 HB2 LEU 14 HB2 LEU 14 6.387 -9.877 5.107 106 HB3 LEU 14 HB3 LEU 14 5.665 -8.289 5.375 107 HG LEU 14 HG LEU 14 4.183 -10.809 4.479 108 HD11 LEU 14 HD11 LEU 14 3.179 -10.763 6.693 109 HD12 LEU 14 HD12 LEU 14 4.947 -10.796 6.819 110 HD13 LEU 14 HD13 LEU 14 4.084 -9.277 7.103 111 HD21 LEU 14 HD21 LEU 14 3.058 -8.061 5.125 112 HD22 LEU 14 HD22 LEU 14 3.089 -8.810 3.518 113 HD23 LEU 14 HD23 LEU 14 2.107 -9.542 4.773 114 H GLN 15 H GLN 15 8.100 -9.985 2.695 115 HA GLN 15 HA GLN 15 9.916 -8.049 3.560 116 HB2 GLN 15 HB2 GLN 15 10.443 -10.418 3.087 117 HB3 GLN 15 HB3 GLN 15 10.322 -10.103 1.357 118 HG2 GLN 15 HG2 GLN 15 12.167 -8.264 2.824 119 HG3 GLN 15 HG3 GLN 15 12.604 -9.969 2.880 120 HE21 GLN 15 HE21 GLN 15 13.377 -11.019 1.094 121 HE22 GLN 15 HE22 GLN 15 13.863 -10.136 -0.368 122 H VAL 16 H VAL 16 8.658 -8.518 0.179 123 HA VAL 16 HA VAL 16 10.224 -6.412 -0.859 124 HB VAL 16 HB VAL 16 8.588 -6.309 -2.737 125 HG11 VAL 16 HG11 VAL 16 10.448 -7.920 -2.741 126 HG12 VAL 16 HG12 VAL 16 9.440 -9.107 -1.895 127 HG13 VAL 16 HG13 VAL 16 9.008 -8.591 -3.546 128 HG21 VAL 16 HG21 VAL 16 6.784 -7.957 -2.887 129 HG22 VAL 16 HG22 VAL 16 7.109 -8.521 -1.250 130 HG23 VAL 16 HG23 VAL 16 6.490 -6.879 -1.519 131 H ILE 17 H ILE 17 7.113 -6.261 0.798 132 HA ILE 17 HA ILE 17 6.644 -3.456 0.280 133 HB ILE 17 HB ILE 17 5.510 -4.940 2.669 134 HG12 ILE 17 HG12 ILE 17 4.313 -5.049 -0.135 135 HG13 ILE 17 HG13 ILE 17 5.144 -6.378 0.662 136 HG21 ILE 17 HG21 ILE 17 4.314 -2.774 0.866 137 HG22 ILE 17 HG22 ILE 17 3.642 -3.378 2.392 138 HG23 ILE 17 HG23 ILE 17 5.139 -2.458 2.399 139 HD11 ILE 17 HD11 ILE 17 2.477 -5.175 1.376 140 HD12 ILE 17 HD12 ILE 17 2.891 -6.858 1.023 141 HD13 ILE 17 HD13 ILE 17 3.403 -6.141 2.559 142 H ASP 18 H ASP 18 8.060 -5.304 2.936 143 HA ASP 18 HA ASP 18 8.536 -3.125 4.738 144 HB2 ASP 18 HB2 ASP 18 8.522 -5.686 5.126 145 HB3 ASP 18 HB3 ASP 18 10.200 -5.657 4.584 146 H TRP 19 H TRP 19 10.391 -4.476 2.073 147 HA TRP 19 HA TRP 19 12.872 -3.100 2.519 148 HB2 TRP 19 HB2 TRP 19 12.746 -5.105 1.178 149 HB3 TRP 19 HB3 TRP 19 11.530 -4.421 0.130 150 HD1 TRP 19 HD1 TRP 19 12.484 -2.258 -1.496 151 HE1 TRP 19 HE1 TRP 19 14.700 -2.030 -2.691 152 HE3 TRP 19 HE3 TRP 19 15.129 -5.703 1.188 153 HZ2 TRP 19 HZ2 TRP 19 17.342 -3.289 -2.563 154 HZ3 TRP 19 HZ3 TRP 19 17.561 -6.065 0.697 155 HH2 TRP 19 HH2 TRP 19 18.618 -4.931 -1.196 156 H LEU 20 H LEU 20 10.123 -2.477 0.231 157 HA LEU 20 HA LEU 20 11.228 -0.028 -0.682 158 HB2 LEU 20 HB2 LEU 20 9.101 0.425 -1.701 159 HB3 LEU 20 HB3 LEU 20 9.682 -1.205 -2.001 160 HG LEU 20 HG LEU 20 8.085 -1.783 0.007 161 HD11 LEU 20 HD11 LEU 20 7.361 0.607 0.439 162 HD12 LEU 20 HD12 LEU 20 6.685 0.636 -1.195 163 HD13 LEU 20 HD13 LEU 20 6.020 -0.460 0.042 164 HD21 LEU 20 HD21 LEU 20 6.298 -2.301 -1.513 165 HD22 LEU 20 HD22 LEU 20 7.003 -1.259 -2.760 166 HD23 LEU 20 HD23 LEU 20 7.861 -2.725 -2.192 167 H ILE 21 H ILE 21 9.213 -0.748 2.136 168 HA ILE 21 HA ILE 21 8.513 1.914 2.813 169 HB ILE 21 HB ILE 21 8.773 -0.714 4.284 170 HG12 ILE 21 HG12 ILE 21 6.326 1.063 4.016 171 HG13 ILE 21 HG13 ILE 21 6.771 -0.085 2.775 172 HG21 ILE 21 HG21 ILE 21 7.805 0.327 6.322 173 HG22 ILE 21 HG22 ILE 21 9.473 0.789 5.992 174 HG23 ILE 21 HG23 ILE 21 8.157 1.924 5.644 175 HD11 ILE 21 HD11 ILE 21 6.571 -1.933 4.470 176 HD12 ILE 21 HD12 ILE 21 6.067 -0.741 5.669 177 HD13 ILE 21 HD13 ILE 21 5.068 -1.018 4.247 178 H GLU 22 H GLU 22 11.520 0.036 3.447 179 HA GLU 22 HA GLU 22 12.630 2.159 5.140 180 HB2 GLU 22 HB2 GLU 22 13.079 -0.252 5.529 181 HB3 GLU 22 HB3 GLU 22 13.941 -0.342 3.983 182 HG2 GLU 22 HG2 GLU 22 15.627 1.231 4.764 183 HG3 GLU 22 HG3 GLU 22 14.671 1.617 6.203 184 H ASN 23 H ASN 23 12.688 1.220 1.776 185 HA ASN 23 HA ASN 23 15.065 2.642 0.981 186 HB2 ASN 23 HB2 ASN 23 12.716 1.459 -0.508 187 HB3 ASN 23 HB3 ASN 23 13.739 2.615 -1.332 188 HD21 ASN 23 HD21 ASN 23 14.263 -0.270 0.839 189 HD22 ASN 23 HD22 ASN 23 15.715 -0.759 -0.056 190 H PHE 24 H PHE 24 11.602 3.639 0.902 191 HA PHE 24 HA PHE 24 12.604 6.432 0.518 192 HB2 PHE 24 HB2 PHE 24 10.234 5.087 -0.702 193 HB3 PHE 24 HB3 PHE 24 10.181 6.798 -0.334 194 HD1 PHE 24 HD1 PHE 24 12.725 7.989 -1.016 195 HD2 PHE 24 HD2 PHE 24 10.572 4.852 -2.994 196 HE1 PHE 24 HE1 PHE 24 13.705 8.669 -3.166 197 HE2 PHE 24 HE2 PHE 24 11.571 5.516 -5.170 198 HZ PHE 24 HZ PHE 24 13.128 7.437 -5.258 199 HA PRO 25 HA PRO 25 10.723 6.184 4.649 200 HB2 PRO 25 HB2 PRO 25 12.571 7.586 6.057 201 HB3 PRO 25 HB3 PRO 25 12.911 5.950 5.423 202 HG2 PRO 25 HG2 PRO 25 13.592 8.616 4.102 203 HG3 PRO 25 HG3 PRO 25 14.707 7.268 4.492 204 HD2 PRO 25 HD2 PRO 25 13.590 7.486 2.048 205 HD3 PRO 25 HD3 PRO 25 13.842 5.895 2.828 206 H ASN 26 H ASN 26 10.283 8.500 2.335 207 HA ASN 26 HA ASN 26 9.946 10.770 4.267 208 HB2 ASN 26 HB2 ASN 26 9.446 10.642 1.276 209 HB3 ASN 26 HB3 ASN 26 8.895 11.932 2.325 210 HD21 ASN 26 HD21 ASN 26 12.024 10.074 2.126 211 HD22 ASN 26 HD22 ASN 26 12.991 11.524 2.056 212 H ALA 27 H ALA 27 8.038 8.148 2.865 213 HA ALA 27 HA ALA 27 5.872 8.650 4.744 214 HB1 ALA 27 HB1 ALA 27 5.547 9.016 1.704 215 HB2 ALA 27 HB2 ALA 27 4.211 8.846 2.858 216 HB3 ALA 27 HB3 ALA 27 5.296 10.264 2.933 217 H PHE 28 H PHE 28 5.624 6.633 5.347 218 HA PHE 28 HA PHE 28 4.519 4.597 3.850 219 HB2 PHE 28 HB2 PHE 28 7.485 4.549 3.782 220 HB3 PHE 28 HB3 PHE 28 6.778 3.083 4.396 221 HD1 PHE 28 HD1 PHE 28 4.483 2.358 2.960 222 HD2 PHE 28 HD2 PHE 28 7.884 4.556 1.438 223 HE1 PHE 28 HE1 PHE 28 3.839 1.764 0.656 224 HE2 PHE 28 HE2 PHE 28 7.232 3.944 -0.860 225 HZ PHE 28 HZ PHE 28 5.169 2.574 -1.265 226 H PHE 29 H PHE 29 4.395 2.473 5.360 227 HA PHE 29 HA PHE 29 4.996 3.048 8.167 228 HB2 PHE 29 HB2 PHE 29 2.198 2.755 7.061 229 HB3 PHE 29 HB3 PHE 29 2.586 2.437 8.742 230 HD1 PHE 29 HD1 PHE 29 1.804 5.008 6.307 231 HD2 PHE 29 HD2 PHE 29 3.585 4.330 10.174 232 HE1 PHE 29 HE1 PHE 29 1.573 7.415 6.844 233 HE2 PHE 29 HE2 PHE 29 3.290 6.711 10.729 234 HZ PHE 29 HZ PHE 29 2.279 8.272 9.067 235 H LYS 30 H LYS 30 5.454 1.159 9.179 236 HA LYS 30 HA LYS 30 5.342 -1.343 7.609 237 HB2 LYS 30 HB2 LYS 30 6.372 -0.778 10.427 238 HB3 LYS 30 HB3 LYS 30 6.265 -2.380 9.711 239 HG2 LYS 30 HG2 LYS 30 8.403 -1.974 9.266 240 HG3 LYS 30 HG3 LYS 30 7.707 -1.414 7.764 241 HD2 LYS 30 HD2 LYS 30 7.997 0.930 8.467 242 HD3 LYS 30 HD3 LYS 30 8.380 0.424 10.114 243 HE2 LYS 30 HE2 LYS 30 10.393 -0.779 9.344 244 HE3 LYS 30 HE3 LYS 30 10.029 -0.414 7.667 245 HZ1 LYS 30 HZ1 LYS 30 10.526 1.917 8.110 246 HZ2 LYS 30 HZ2 LYS 30 10.746 1.628 9.713 247 HZ3 LYS 30 HZ3 LYS 30 11.763 0.990 8.645 248 H LYS 31 H LYS 31 4.032 -0.385 10.795 249 HA LYS 31 HA LYS 31 2.384 -2.791 10.913 250 HB2 LYS 31 HB2 LYS 31 2.203 -0.293 12.662 251 HB3 LYS 31 HB3 LYS 31 1.379 -1.825 12.921 252 HG2 LYS 31 HG2 LYS 31 3.127 -2.208 14.307 253 HG3 LYS 31 HG3 LYS 31 3.875 -2.788 12.819 254 HD2 LYS 31 HD2 LYS 31 4.866 -0.424 12.543 255 HD3 LYS 31 HD3 LYS 31 4.157 -0.038 14.111 256 HE2 LYS 31 HE2 LYS 31 6.459 -0.543 14.473 257 HE3 LYS 31 HE3 LYS 31 5.502 -1.872 15.142 258 HZ1 LYS 31 HZ1 LYS 31 6.027 -3.144 13.114 259 HZ2 LYS 31 HZ2 LYS 31 6.987 -1.895 12.569 260 HZ3 LYS 31 HZ3 LYS 31 7.377 -2.698 13.908 261 H GLY 32 H GLY 32 0.418 -3.137 10.052 262 HA2 GLY 32 HA2 GLY 32 -0.908 -1.416 8.289 263 HA3 GLY 32 HA3 GLY 32 -1.656 -2.782 9.112 264 H ASN 33 H ASN 33 -1.329 -1.695 11.838 265 HA ASN 33 HA ASN 33 -3.761 -0.319 12.052 266 HB2 ASN 33 HB2 ASN 33 -3.464 -0.373 14.291 267 HB3 ASN 33 HB3 ASN 33 -2.240 -1.557 13.880 268 HD21 ASN 33 HD21 ASN 33 0.043 -0.129 13.236 269 HD22 ASN 33 HD22 ASN 33 0.436 0.891 14.625 270 H GLN 34 H GLN 34 -0.631 1.118 11.367 271 HA GLN 34 HA GLN 34 -1.771 3.843 11.755 272 HB2 GLN 34 HB2 GLN 34 0.534 4.573 12.020 273 HB3 GLN 34 HB3 GLN 34 0.045 3.415 13.274 274 HG2 GLN 34 HG2 GLN 34 1.298 1.643 12.126 275 HG3 GLN 34 HG3 GLN 34 1.734 2.749 10.826 276 HE21 GLN 34 HE21 GLN 34 1.895 4.715 13.475 277 HE22 GLN 34 HE22 GLN 34 3.553 4.445 13.956 278 H VAL 35 H VAL 35 -1.326 1.665 9.390 279 HA VAL 35 HA VAL 35 0.169 3.090 7.438 280 HB VAL 35 HB VAL 35 -0.600 0.632 7.605 281 HG11 VAL 35 HG11 VAL 35 -2.551 -0.093 6.517 282 HG12 VAL 35 HG12 VAL 35 -3.102 1.230 7.556 283 HG13 VAL 35 HG13 VAL 35 -2.890 1.530 5.844 284 HG21 VAL 35 HG21 VAL 35 -0.329 0.227 5.254 285 HG22 VAL 35 HG22 VAL 35 -0.617 1.944 4.893 286 HG23 VAL 35 HG23 VAL 35 0.822 1.438 5.820 287 H LYS 36 H LYS 36 -0.655 4.313 5.479 288 HA LYS 36 HA LYS 36 -3.337 5.522 5.843 289 HB2 LYS 36 HB2 LYS 36 -0.666 6.947 6.069 290 HB3 LYS 36 HB3 LYS 36 -1.970 7.773 5.261 291 HG2 LYS 36 HG2 LYS 36 -3.378 7.067 7.416 292 HG3 LYS 36 HG3 LYS 36 -1.779 6.959 8.162 293 HD2 LYS 36 HD2 LYS 36 -2.940 9.380 6.695 294 HD3 LYS 36 HD3 LYS 36 -2.911 9.182 8.448 295 HE2 LYS 36 HE2 LYS 36 -0.523 9.292 8.543 296 HE3 LYS 36 HE3 LYS 36 -0.362 9.149 6.781 297 HZ1 LYS 36 HZ1 LYS 36 -1.209 11.294 6.489 298 HZ2 LYS 36 HZ2 LYS 36 -1.768 11.444 7.987 299 HZ3 LYS 36 HZ3 LYS 36 -0.129 11.446 7.710 300 HA PRO 37 HA PRO 37 -3.451 5.352 1.471 301 HB2 PRO 37 HB2 PRO 37 -4.715 7.621 0.638 302 HB3 PRO 37 HB3 PRO 37 -5.541 6.311 1.515 303 HG2 PRO 37 HG2 PRO 37 -4.444 8.860 2.670 304 HG3 PRO 37 HG3 PRO 37 -6.049 8.105 2.939 305 HD2 PRO 37 HD2 PRO 37 -4.024 7.784 4.702 306 HD3 PRO 37 HD3 PRO 37 -5.142 6.441 4.337 307 H LEU 38 H LEU 38 -2.171 5.727 -0.162 308 HA LEU 38 HA LEU 38 -0.016 7.794 0.035 309 HB2 LEU 38 HB2 LEU 38 -0.128 5.057 -1.259 310 HB3 LEU 38 HB3 LEU 38 1.222 6.162 -1.441 311 HG LEU 38 HG LEU 38 0.310 5.266 1.313 312 HD11 LEU 38 HD11 LEU 38 0.731 3.240 0.043 313 HD12 LEU 38 HD12 LEU 38 2.317 3.869 -0.489 314 HD13 LEU 38 HD13 LEU 38 2.017 3.512 1.223 315 HD21 LEU 38 HD21 LEU 38 1.833 7.210 1.249 316 HD22 LEU 38 HD22 LEU 38 2.663 5.786 1.905 317 HD23 LEU 38 HD23 LEU 38 2.980 6.301 0.251 318 H LYS 39 H LYS 39 0.967 8.385 -2.131 319 HA LYS 39 HA LYS 39 -0.769 9.875 -3.741 320 HB2 LYS 39 HB2 LYS 39 1.577 10.328 -3.605 321 HB3 LYS 39 HB3 LYS 39 2.015 8.718 -4.113 322 HG2 LYS 39 HG2 LYS 39 0.538 10.098 -6.255 323 HG3 LYS 39 HG3 LYS 39 1.888 11.056 -5.698 324 HD2 LYS 39 HD2 LYS 39 3.473 9.238 -6.077 325 HD3 LYS 39 HD3 LYS 39 2.154 8.147 -6.482 326 HE2 LYS 39 HE2 LYS 39 3.173 8.813 -8.523 327 HE3 LYS 39 HE3 LYS 39 1.579 9.569 -8.455 328 HZ1 LYS 39 HZ1 LYS 39 3.331 11.012 -9.252 329 HZ2 LYS 39 HZ2 LYS 39 2.731 11.680 -7.888 330 HZ3 LYS 39 HZ3 LYS 39 4.181 10.910 -7.891 331 H ILE 40 H ILE 40 -1.563 9.538 -5.956 332 HA ILE 40 HA ILE 40 -2.610 6.904 -6.341 333 HB ILE 40 HB ILE 40 -3.698 9.007 -7.103 334 HG12 ILE 40 HG12 ILE 40 -4.543 8.237 -9.226 335 HG13 ILE 40 HG13 ILE 40 -3.206 7.104 -9.428 336 HG21 ILE 40 HG21 ILE 40 -1.618 10.134 -8.024 337 HG22 ILE 40 HG22 ILE 40 -1.713 9.034 -9.400 338 HG23 ILE 40 HG23 ILE 40 -3.034 10.163 -9.080 339 HD11 ILE 40 HD11 ILE 40 -5.429 6.144 -8.627 340 HD12 ILE 40 HD12 ILE 40 -4.021 5.702 -7.649 341 HD13 ILE 40 HD13 ILE 40 -5.148 6.961 -7.091 342 H GLY 41 H GLY 41 -1.927 5.230 -7.748 343 HA2 GLY 41 HA2 GLY 41 -0.413 3.917 -8.842 344 HA3 GLY 41 HA3 GLY 41 -0.040 5.371 -9.770 345 H ILE 42 H ILE 42 0.648 5.336 -6.301 346 HA ILE 42 HA ILE 42 3.284 6.107 -6.563 347 HB ILE 42 HB ILE 42 1.908 6.312 -4.540 348 HG12 ILE 42 HG12 ILE 42 4.599 5.003 -4.019 349 HG13 ILE 42 HG13 ILE 42 4.363 6.655 -4.604 350 HG21 ILE 42 HG21 ILE 42 0.991 3.974 -4.473 351 HG22 ILE 42 HG22 ILE 42 2.597 3.394 -3.968 352 HG23 ILE 42 HG23 ILE 42 1.676 4.486 -2.936 353 HD11 ILE 42 HD11 ILE 42 4.771 6.723 -2.230 354 HD12 ILE 42 HD12 ILE 42 3.084 7.181 -2.516 355 HD13 ILE 42 HD13 ILE 42 3.492 5.547 -1.917 356 H PHE 43 H PHE 43 2.082 2.711 -6.692 357 HA PHE 43 HA PHE 43 4.585 1.537 -6.200 358 HB2 PHE 43 HB2 PHE 43 2.941 -0.088 -6.180 359 HB3 PHE 43 HB3 PHE 43 2.024 0.693 -7.463 360 HD1 PHE 43 HD1 PHE 43 2.401 0.257 -9.780 361 HD2 PHE 43 HD2 PHE 43 4.843 -1.698 -6.819 362 HE1 PHE 43 HE1 PHE 43 3.381 -1.224 -11.540 363 HE2 PHE 43 HE2 PHE 43 5.879 -3.083 -8.576 364 HZ PHE 43 HZ PHE 43 5.131 -2.870 -10.931 365 H ASP 44 H ASP 44 3.173 2.905 -9.154 366 HA ASP 44 HA ASP 44 5.126 1.874 -10.971 367 HB2 ASP 44 HB2 ASP 44 2.770 2.825 -11.443 368 HB3 ASP 44 HB3 ASP 44 3.533 4.422 -11.388 369 H ASP 45 H ASP 45 5.051 4.563 -8.792 370 HA ASP 45 HA ASP 45 7.204 6.115 -9.970 371 HB2 ASP 45 HB2 ASP 45 5.051 6.635 -8.337 372 HB3 ASP 45 HB3 ASP 45 6.298 6.472 -7.121 373 H LEU 46 H LEU 46 6.663 4.023 -7.211 374 HA LEU 46 HA LEU 46 9.231 4.063 -5.986 375 HB2 LEU 46 HB2 LEU 46 7.107 3.620 -4.837 376 HB3 LEU 46 HB3 LEU 46 6.838 2.198 -5.806 377 HG LEU 46 HG LEU 46 7.462 1.685 -3.511 378 HD11 LEU 46 HD11 LEU 46 8.685 -0.185 -3.876 379 HD12 LEU 46 HD12 LEU 46 8.446 0.207 -5.579 380 HD13 LEU 46 HD13 LEU 46 9.944 0.644 -4.758 381 HD21 LEU 46 HD21 LEU 46 10.099 3.040 -4.139 382 HD22 LEU 46 HD22 LEU 46 8.813 3.610 -3.028 383 HD23 LEU 46 HD23 LEU 46 9.753 2.173 -2.649 384 H ILE 47 H ILE 47 7.704 1.715 -8.248 385 HA ILE 47 HA ILE 47 9.512 -0.402 -7.913 386 HB ILE 47 HB ILE 47 7.366 -0.389 -9.182 387 HG12 ILE 47 HG12 ILE 47 9.296 -2.163 -9.410 388 HG13 ILE 47 HG13 ILE 47 7.799 -2.246 -10.311 389 HG21 ILE 47 HG21 ILE 47 7.332 0.317 -11.553 390 HG22 ILE 47 HG22 ILE 47 7.705 1.657 -10.468 391 HG23 ILE 47 HG23 ILE 47 9.009 0.933 -11.403 392 HD11 ILE 47 HD11 ILE 47 9.820 -2.760 -11.666 393 HD12 ILE 47 HD12 ILE 47 8.831 -1.463 -12.341 394 HD13 ILE 47 HD13 ILE 47 10.342 -1.082 -11.497 395 H ASP 48 H ASP 48 9.973 2.720 -9.478 396 HA ASP 48 HA ASP 48 12.022 2.155 -11.243 397 HB2 ASP 48 HB2 ASP 48 10.736 4.333 -10.758 398 HB3 ASP 48 HB3 ASP 48 11.886 4.627 -9.461 399 H PHE 49 H PHE 49 12.049 2.711 -7.768 400 HA PHE 49 HA PHE 49 14.887 2.729 -7.391 401 HB2 PHE 49 HB2 PHE 49 12.893 3.474 -5.804 402 HB3 PHE 49 HB3 PHE 49 13.065 1.857 -5.155 403 HD1 PHE 49 HD1 PHE 49 13.311 4.083 -3.397 404 HD2 PHE 49 HD2 PHE 49 16.438 2.422 -5.874 405 HE1 PHE 49 HE1 PHE 49 15.026 5.169 -1.994 406 HE2 PHE 49 HE2 PHE 49 18.113 3.455 -4.446 407 HZ PHE 49 HZ PHE 49 17.434 4.859 -2.510 408 H TYR 50 H TYR 50 12.549 0.112 -7.728 409 HA TYR 50 HA TYR 50 14.273 -1.994 -6.602 410 HB2 TYR 50 HB2 TYR 50 12.217 -2.898 -6.523 411 HB3 TYR 50 HB3 TYR 50 11.552 -1.838 -7.738 412 HD1 TYR 50 HD1 TYR 50 13.024 -5.161 -7.139 413 HD2 TYR 50 HD2 TYR 50 11.825 -2.347 -10.170 414 HE1 TYR 50 HE1 TYR 50 12.941 -6.988 -8.823 415 HE2 TYR 50 HE2 TYR 50 11.815 -4.118 -11.863 416 HH TYR 50 HH TYR 50 12.589 -6.334 -12.273 417 H GLU 51 H GLU 51 13.863 -0.317 -9.726 418 HA GLU 51 HA GLU 51 15.366 -2.345 -11.169 419 HB2 GLU 51 HB2 GLU 51 14.691 0.528 -11.956 420 HB3 GLU 51 HB3 GLU 51 15.452 -0.691 -12.988 421 HG2 GLU 51 HG2 GLU 51 13.316 -2.142 -12.283 422 HG3 GLU 51 HG3 GLU 51 12.632 -0.557 -11.949 423 H ARG 52 H ARG 52 16.265 0.154 -8.974 424 HA ARG 52 HA ARG 52 18.876 0.758 -10.077 425 HB2 ARG 52 HB2 ARG 52 17.204 1.617 -7.871 426 HB3 ARG 52 HB3 ARG 52 18.743 1.143 -7.205 427 HG2 ARG 52 HG2 ARG 52 18.904 3.392 -7.575 428 HG3 ARG 52 HG3 ARG 52 19.837 2.699 -8.913 429 HD2 ARG 52 HD2 ARG 52 18.158 3.277 -10.507 430 HD3 ARG 52 HD3 ARG 52 16.901 3.375 -9.257 431 HE ARG 52 HE ARG 52 19.133 5.281 -9.113 432 HH11 ARG 52 HH11 ARG 52 15.727 4.918 -10.045 433 HH12 ARG 52 HH12 ARG 52 15.238 6.449 -9.411 434 HH21 ARG 52 HH21 ARG 52 18.569 7.402 -8.520 435 HH22 ARG 52 HH22 ARG 52 16.940 7.961 -8.636 436 H LEU 53 H LEU 53 17.694 -1.915 -7.894 437 HA LEU 53 HA LEU 53 19.903 -2.684 -6.610 438 HB2 LEU 53 HB2 LEU 53 17.559 -4.100 -7.990 439 HB3 LEU 53 HB3 LEU 53 18.721 -4.957 -6.986 440 HG LEU 53 HG LEU 53 18.252 -3.454 -5.154 441 HD11 LEU 53 HD11 LEU 53 16.332 -2.040 -6.754 442 HD12 LEU 53 HD12 LEU 53 16.063 -2.259 -5.011 443 HD13 LEU 53 HD13 LEU 53 17.519 -1.469 -5.615 444 HD21 LEU 53 HD21 LEU 53 17.119 -5.665 -5.387 445 HD22 LEU 53 HD22 LEU 53 16.102 -4.517 -4.509 446 HD23 LEU 53 HD23 LEU 53 15.770 -4.850 -6.227 447 H ASP 54 H ASP 54 21.543 -4.070 -6.999 448 HA ASP 54 HA ASP 54 22.505 -4.236 -9.738 449 HB2 ASP 54 HB2 ASP 54 24.043 -3.895 -7.811 450 HB3 ASP 54 HB3 ASP 54 23.651 -5.529 -7.228 451 H THR 55 H THR 55 20.834 -6.335 -7.456 452 HA THR 55 HA THR 55 20.430 -8.338 -9.604 453 HB THR 55 HB THR 55 21.271 -9.105 -6.792 454 HG1 THR 55 HG1 THR 55 23.164 -9.838 -8.049 455 HG21 THR 55 HG21 THR 55 21.547 -11.334 -7.777 456 HG22 THR 55 HG22 THR 55 19.878 -10.795 -7.942 457 HG23 THR 55 HG23 THR 55 20.967 -10.734 -9.353 458 HA PRO 56 HA PRO 56 16.553 -6.923 -7.469 459 HB2 PRO 56 HB2 PRO 56 15.008 -7.120 -9.776 460 HB3 PRO 56 HB3 PRO 56 15.844 -5.638 -9.212 461 HG2 PRO 56 HG2 PRO 56 16.684 -7.662 -11.284 462 HG3 PRO 56 HG3 PRO 56 16.840 -5.878 -11.338 463 HD2 PRO 56 HD2 PRO 56 18.915 -7.506 -10.731 464 HD3 PRO 56 HD3 PRO 56 18.722 -5.915 -9.937 465 HA PRO 57 HA PRO 57 15.855 -11.421 -7.481 466 HB2 PRO 57 HB2 PRO 57 14.871 -11.784 -4.982 467 HB3 PRO 57 HB3 PRO 57 16.568 -11.328 -5.291 468 HG2 PRO 57 HG2 PRO 57 14.310 -9.511 -4.435 469 HG3 PRO 57 HG3 PRO 57 15.988 -9.571 -3.853 470 HD2 PRO 57 HD2 PRO 57 14.999 -7.835 -5.835 471 HD3 PRO 57 HD3 PRO 57 16.714 -8.245 -5.606 472 H PHE 58 H PHE 58 13.156 -10.000 -5.594 473 HA PHE 58 HA PHE 58 11.191 -11.550 -7.064 474 HB2 PHE 58 HB2 PHE 58 11.085 -9.653 -4.712 475 HB3 PHE 58 HB3 PHE 58 9.643 -10.316 -5.469 476 HD1 PHE 58 HD1 PHE 58 9.010 -12.662 -5.218 477 HD2 PHE 58 HD2 PHE 58 12.770 -11.230 -3.639 478 HE1 PHE 58 HE1 PHE 58 9.337 -14.797 -4.006 479 HE2 PHE 58 HE2 PHE 58 13.116 -13.406 -2.516 480 HZ PHE 58 HZ PHE 58 11.407 -15.184 -2.685 481 H SER 59 H SER 59 10.731 -10.920 -9.064 482 HA SER 59 HA SER 59 11.202 -8.440 -10.172 483 HB2 SER 59 HB2 SER 59 9.084 -10.433 -11.039 484 HB3 SER 59 HB3 SER 59 9.979 -9.288 -12.057 485 HG SER 59 HG SER 59 10.867 -11.313 -12.263 486 H LYS 60 H LYS 60 9.681 -6.956 -11.130 487 HA LYS 60 HA LYS 60 8.129 -5.491 -9.457 488 HB2 LYS 60 HB2 LYS 60 7.294 -4.342 -11.418 489 HB3 LYS 60 HB3 LYS 60 8.987 -4.794 -11.617 490 HG2 LYS 60 HG2 LYS 60 7.902 -6.923 -12.829 491 HG3 LYS 60 HG3 LYS 60 6.558 -5.814 -13.072 492 HD2 LYS 60 HD2 LYS 60 9.456 -5.333 -13.885 493 HD3 LYS 60 HD3 LYS 60 8.223 -5.950 -14.968 494 HE2 LYS 60 HE2 LYS 60 7.962 -3.247 -13.582 495 HE3 LYS 60 HE3 LYS 60 8.796 -3.463 -15.118 496 HZ1 LYS 60 HZ1 LYS 60 6.632 -2.826 -15.573 497 HZ2 LYS 60 HZ2 LYS 60 6.749 -4.383 -16.035 498 HZ3 LYS 60 HZ3 LYS 60 5.930 -3.976 -14.644 499 H LYS 61 H LYS 61 6.945 -8.319 -11.225 500 HA LYS 61 HA LYS 61 4.169 -7.873 -10.793 501 HB2 LYS 61 HB2 LYS 61 5.453 -9.640 -12.289 502 HB3 LYS 61 HB3 LYS 61 5.462 -10.620 -10.853 503 HG2 LYS 61 HG2 LYS 61 3.582 -11.326 -12.101 504 HG3 LYS 61 HG3 LYS 61 2.932 -10.417 -10.745 505 HD2 LYS 61 HD2 LYS 61 1.773 -9.975 -12.905 506 HD3 LYS 61 HD3 LYS 61 2.456 -8.508 -12.193 507 HE2 LYS 61 HE2 LYS 61 4.380 -8.617 -13.694 508 HE3 LYS 61 HE3 LYS 61 3.816 -10.149 -14.386 509 HZ1 LYS 61 HZ1 LYS 61 2.004 -9.004 -15.373 510 HZ2 LYS 61 HZ2 LYS 61 2.315 -7.604 -14.559 511 HZ3 LYS 61 HZ3 LYS 61 3.337 -8.122 -15.717 512 H SER 62 H SER 62 6.531 -9.870 -8.818 513 HA SER 62 HA SER 62 4.640 -10.483 -6.824 514 HB2 SER 62 HB2 SER 62 7.096 -11.424 -7.341 515 HB3 SER 62 HB3 SER 62 7.567 -10.216 -6.144 516 HG SER 62 HG SER 62 6.784 -11.487 -4.640 517 H LEU 63 H LEU 63 7.007 -7.790 -7.106 518 HA LEU 63 HA LEU 63 6.581 -6.697 -4.554 519 HB2 LEU 63 HB2 LEU 63 8.379 -6.179 -6.066 520 HB3 LEU 63 HB3 LEU 63 7.318 -5.229 -7.112 521 HG LEU 63 HG LEU 63 7.597 -4.586 -4.155 522 HD11 LEU 63 HD11 LEU 63 9.477 -3.112 -4.548 523 HD12 LEU 63 HD12 LEU 63 9.918 -4.747 -5.041 524 HD13 LEU 63 HD13 LEU 63 9.514 -3.531 -6.280 525 HD21 LEU 63 HD21 LEU 63 5.910 -3.325 -5.507 526 HD22 LEU 63 HD22 LEU 63 7.200 -2.312 -4.868 527 HD23 LEU 63 HD23 LEU 63 7.236 -2.761 -6.580 528 H ARG 64 H ARG 64 4.859 -5.807 -7.632 529 HA ARG 64 HA ARG 64 3.046 -4.114 -6.269 530 HB2 ARG 64 HB2 ARG 64 3.373 -4.151 -8.759 531 HB3 ARG 64 HB3 ARG 64 2.603 -5.713 -8.835 532 HG2 ARG 64 HG2 ARG 64 1.214 -3.755 -9.535 533 HG3 ARG 64 HG3 ARG 64 0.450 -4.812 -8.347 534 HD2 ARG 64 HD2 ARG 64 0.405 -3.213 -6.707 535 HD3 ARG 64 HD3 ARG 64 1.928 -2.473 -7.216 536 HE ARG 64 HE ARG 64 0.237 -1.896 -9.281 537 HH11 ARG 64 HH11 ARG 64 -0.254 -1.310 -5.781 538 HH12 ARG 64 HH12 ARG 64 -0.786 0.324 -6.044 539 HH21 ARG 64 HH21 ARG 64 -0.365 0.325 -9.532 540 HH22 ARG 64 HH22 ARG 64 -1.026 1.159 -8.145 541 H GLU 65 H GLU 65 2.675 -7.601 -7.151 542 HA GLU 65 HA GLU 65 0.019 -7.858 -6.266 543 HB2 GLU 65 HB2 GLU 65 2.356 -9.782 -6.541 544 HB3 GLU 65 HB3 GLU 65 0.843 -10.325 -5.840 545 HG2 GLU 65 HG2 GLU 65 1.088 -9.043 -8.597 546 HG3 GLU 65 HG3 GLU 65 0.964 -10.777 -8.282 547 H ALA 66 H ALA 66 3.059 -8.126 -4.407 548 HA ALA 66 HA ALA 66 1.800 -8.855 -1.933 549 HB1 ALA 66 HB1 ALA 66 3.969 -8.011 -1.002 550 HB2 ALA 66 HB2 ALA 66 4.172 -9.275 -2.235 551 HB3 ALA 66 HB3 ALA 66 4.465 -7.564 -2.635 552 H LEU 67 H LEU 67 2.842 -5.685 -3.342 553 HA LEU 67 HA LEU 67 2.100 -4.114 -1.097 554 HB2 LEU 67 HB2 LEU 67 3.163 -3.612 -3.654 555 HB3 LEU 67 HB3 LEU 67 1.631 -2.762 -3.681 556 HG LEU 67 HG LEU 67 3.856 -2.431 -1.622 557 HD11 LEU 67 HD11 LEU 67 4.228 -0.265 -2.701 558 HD12 LEU 67 HD12 LEU 67 4.361 -1.564 -3.883 559 HD13 LEU 67 HD13 LEU 67 2.892 -0.561 -3.838 560 HD21 LEU 67 HD21 LEU 67 2.648 -0.413 -0.861 561 HD22 LEU 67 HD22 LEU 67 1.268 -0.849 -1.881 562 HD23 LEU 67 HD23 LEU 67 1.740 -1.885 -0.518 563 H SER 68 H SER 68 0.168 -5.597 -3.660 564 HA SER 68 HA SER 68 -2.199 -4.056 -3.426 565 HB2 SER 68 HB2 SER 68 -1.241 -6.207 -4.971 566 HB3 SER 68 HB3 SER 68 -2.567 -6.919 -4.052 567 HG SER 68 HG SER 68 -3.909 -5.275 -4.866 568 H TYR 69 H TYR 69 -0.768 -6.711 -1.561 569 HA TYR 69 HA TYR 69 -3.136 -7.391 -0.114 570 HB2 TYR 69 HB2 TYR 69 -0.649 -8.556 -0.459 571 HB3 TYR 69 HB3 TYR 69 -0.510 -7.938 1.184 572 HD1 TYR 69 HD1 TYR 69 -1.284 -9.444 2.901 573 HD2 TYR 69 HD2 TYR 69 -2.926 -9.663 -1.079 574 HE1 TYR 69 HE1 TYR 69 -2.728 -11.318 3.623 575 HE2 TYR 69 HE2 TYR 69 -4.395 -11.572 -0.357 576 HH TYR 69 HH TYR 69 -4.211 -13.105 2.819 577 H TYR 70 H TYR 70 -0.452 -5.062 0.420 578 HA TYR 70 HA TYR 70 -1.349 -4.398 3.084 579 HB2 TYR 70 HB2 TYR 70 0.835 -3.544 1.320 580 HB3 TYR 70 HB3 TYR 70 0.090 -2.184 2.132 581 HD1 TYR 70 HD1 TYR 70 0.698 -5.749 3.227 582 HD2 TYR 70 HD2 TYR 70 1.417 -1.557 3.991 583 HE1 TYR 70 HE1 TYR 70 1.716 -6.322 5.385 584 HE2 TYR 70 HE2 TYR 70 2.457 -2.126 6.150 585 HH TYR 70 HH TYR 70 3.018 -3.850 7.628 586 H SER 71 H SER 71 -2.124 -3.132 -0.148 587 HA SER 71 HA SER 71 -3.695 -0.943 0.992 588 HB2 SER 71 HB2 SER 71 -4.612 -0.778 -1.317 589 HB3 SER 71 HB3 SER 71 -2.868 -0.524 -1.111 590 HG SER 71 HG SER 71 -4.255 -2.735 -2.220 591 H ALA 72 H ALA 72 -4.203 -4.279 0.695 592 HA ALA 72 HA ALA 72 -7.149 -4.148 0.829 593 HB1 ALA 72 HB1 ALA 72 -6.906 -6.628 0.493 594 HB2 ALA 72 HB2 ALA 72 -6.223 -5.670 -0.839 595 HB3 ALA 72 HB3 ALA 72 -5.164 -6.414 0.375 596 H SER 73 H SER 73 -4.727 -3.752 2.978 597 HA SER 73 HA SER 73 -5.355 -5.799 4.909 598 HB2 SER 73 HB2 SER 73 -3.990 -3.099 5.225 599 HB3 SER 73 HB3 SER 73 -4.150 -4.279 6.526 600 HG SER 73 HG SER 73 -3.161 -5.838 5.037 601 HA PRO 74 HA PRO 74 -9.164 -4.497 6.501 602 HB2 PRO 74 HB2 PRO 74 -8.929 -4.969 9.239 603 HB3 PRO 74 HB3 PRO 74 -9.305 -6.210 7.998 604 HG2 PRO 74 HG2 PRO 74 -6.684 -5.540 9.296 605 HG3 PRO 74 HG3 PRO 74 -7.332 -7.155 8.856 606 HD2 PRO 74 HD2 PRO 74 -5.455 -5.867 7.351 607 HD3 PRO 74 HD3 PRO 74 -6.713 -6.902 6.604 608 H ALA 75 H ALA 75 -6.488 -3.406 8.668 609 HA ALA 75 HA ALA 75 -7.789 -1.189 9.716 610 HB1 ALA 75 HB1 ALA 75 -4.827 -1.593 9.144 611 HB2 ALA 75 HB2 ALA 75 -5.524 -0.401 10.275 612 HB3 ALA 75 HB3 ALA 75 -5.731 -2.150 10.579 613 H TYR 76 H TYR 76 -5.734 -1.300 6.766 614 HA TYR 76 HA TYR 76 -5.863 1.443 6.155 615 HB2 TYR 76 HB2 TYR 76 -4.382 -0.172 4.914 616 HB3 TYR 76 HB3 TYR 76 -5.793 -0.958 4.237 617 HD1 TYR 76 HD1 TYR 76 -3.402 1.807 3.780 618 HD2 TYR 76 HD2 TYR 76 -7.292 0.299 2.615 619 HE1 TYR 76 HE1 TYR 76 -3.481 3.415 1.994 620 HE2 TYR 76 HE2 TYR 76 -7.488 2.104 0.966 621 HH TYR 76 HH TYR 76 -6.548 4.129 0.216 622 H LEU 77 H LEU 77 -8.134 -1.124 5.128 623 HA LEU 77 HA LEU 77 -9.800 0.711 3.669 624 HB2 LEU 77 HB2 LEU 77 -10.476 -2.033 4.756 625 HB3 LEU 77 HB3 LEU 77 -11.377 -1.154 3.537 626 HG LEU 77 HG LEU 77 -8.447 -1.903 3.104 627 HD11 LEU 77 HD11 LEU 77 -9.252 -3.928 1.974 628 HD12 LEU 77 HD12 LEU 77 -9.662 -3.902 3.698 629 HD13 LEU 77 HD13 LEU 77 -10.907 -3.542 2.489 630 HD21 LEU 77 HD21 LEU 77 -9.280 -0.217 1.562 631 HD22 LEU 77 HD22 LEU 77 -9.054 -1.746 0.724 632 HD23 LEU 77 HD23 LEU 77 -10.687 -1.213 1.173 633 H SER 78 H SER 78 -10.091 -0.836 6.856 634 HA SER 78 HA SER 78 -12.534 0.305 7.669 635 HB2 SER 78 HB2 SER 78 -11.118 -1.613 8.736 636 HB3 SER 78 HB3 SER 78 -10.236 -0.326 9.562 637 HG SER 78 HG SER 78 -12.652 0.321 10.001 638 H CYS 79 H CYS 79 -9.406 1.797 7.414 639 HA CYS 79 HA CYS 79 -10.185 4.089 9.082 640 HB2 CYS 79 HB2 CYS 79 -7.934 2.849 9.391 641 HB3 CYS 79 HB3 CYS 79 -7.474 3.697 7.901 642 HG CYS 79 HG CYS 79 -8.159 6.089 8.779 643 H GLN 80 H GLN 80 -11.085 3.388 6.160 644 HA GLN 80 HA GLN 80 -10.163 5.280 4.326 645 HB2 GLN 80 HB2 GLN 80 -12.388 5.402 3.386 646 HB3 GLN 80 HB3 GLN 80 -11.927 3.752 3.650 647 HG2 GLN 80 HG2 GLN 80 -14.018 3.563 4.413 648 HG3 GLN 80 HG3 GLN 80 -13.250 4.056 5.924 649 HE21 GLN 80 HE21 GLN 80 -15.257 4.812 6.686 650 HE22 GLN 80 HE22 GLN 80 -15.969 6.331 6.168 651 H LYS 81 H LYS 81 -9.747 7.259 4.615 652 HA LYS 81 HA LYS 81 -11.673 9.059 5.900 653 HB2 LYS 81 HB2 LYS 81 -8.833 8.843 6.832 654 HB3 LYS 81 HB3 LYS 81 -9.778 10.312 7.059 655 HG2 LYS 81 HG2 LYS 81 -10.585 7.553 8.052 656 HG3 LYS 81 HG3 LYS 81 -9.816 8.797 9.016 657 HD2 LYS 81 HD2 LYS 81 -11.777 10.233 8.763 658 HD3 LYS 81 HD3 LYS 81 -12.577 8.981 7.774 659 HE2 LYS 81 HE2 LYS 81 -12.555 7.391 9.548 660 HE3 LYS 81 HE3 LYS 81 -11.542 8.430 10.566 661 HZ1 LYS 81 HZ1 LYS 81 -13.327 9.977 10.760 662 HZ2 LYS 81 HZ2 LYS 81 -14.233 9.197 9.647 663 HZ3 LYS 81 HZ3 LYS 81 -13.976 8.501 11.099 664 HA PRO 82 HA PRO 82 -10.416 10.831 1.932 665 HB2 PRO 82 HB2 PRO 82 -12.597 12.453 1.570 666 HB3 PRO 82 HB3 PRO 82 -12.657 10.689 1.319 667 HG2 PRO 82 HG2 PRO 82 -13.489 12.259 3.757 668 HG3 PRO 82 HG3 PRO 82 -14.401 10.956 2.934 669 HD2 PRO 82 HD2 PRO 82 -12.875 10.556 5.179 670 HD3 PRO 82 HD3 PRO 82 -13.078 9.296 3.933 671 H ASP 83 H ASP 83 -10.349 13.331 1.310 672 HA ASP 83 HA ASP 83 -9.163 15.315 1.760 673 HB2 ASP 83 HB2 ASP 83 -11.307 15.316 3.880 674 HB3 ASP 83 HB3 ASP 83 -10.136 16.628 3.694 675 H THR 84 H THR 84 -7.365 13.804 2.209 676 HA THR 84 HA THR 84 -6.314 14.187 4.970 677 HB THR 84 HB THR 84 -7.343 11.981 4.652 678 HG1 THR 84 HG1 THR 84 -5.555 12.006 5.993 679 HG21 THR 84 HG21 THR 84 -7.048 11.705 2.203 680 HG22 THR 84 HG22 THR 84 -5.287 11.523 2.447 681 HG23 THR 84 HG23 THR 84 -6.427 10.334 3.098 682 H ALA 85 H ALA 85 -5.582 14.348 1.567 683 HA ALA 85 HA ALA 85 -3.745 15.009 0.417 684 HB1 ALA 85 HB1 ALA 85 -2.181 16.563 1.447 685 HB2 ALA 85 HB2 ALA 85 -3.879 17.027 1.660 686 HB3 ALA 85 HB3 ALA 85 -2.968 16.314 3.024 687 H ARG 86 H ARG 86 -3.102 13.007 -0.084 688 HA ARG 86 HA ARG 86 -1.352 11.488 1.717 689 HB2 ARG 86 HB2 ARG 86 -1.599 10.912 -1.241 690 HB3 ARG 86 HB3 ARG 86 -1.127 9.853 0.063 691 HG2 ARG 86 HG2 ARG 86 -3.240 9.065 -0.188 692 HG3 ARG 86 HG3 ARG 86 -3.654 10.409 0.881 693 HD2 ARG 86 HD2 ARG 86 -5.139 10.764 -0.895 694 HD3 ARG 86 HD3 ARG 86 -3.764 11.737 -1.401 695 HE ARG 86 HE ARG 86 -3.696 8.984 -2.340 696 HH11 ARG 86 HH11 ARG 86 -4.377 12.371 -3.262 697 HH12 ARG 86 HH12 ARG 86 -4.822 11.956 -4.889 698 HH21 ARG 86 HH21 ARG 86 -4.557 8.460 -4.433 699 HH22 ARG 86 HH22 ARG 86 -5.061 9.724 -5.485 700 H VAL 87 H VAL 87 0.823 10.688 0.478 701 HA VAL 87 HA VAL 87 2.255 13.000 -0.592 702 HB VAL 87 HB VAL 87 4.180 12.153 1.007 703 HG11 VAL 87 HG11 VAL 87 1.883 13.934 1.939 704 HG12 VAL 87 HG12 VAL 87 3.482 13.838 2.715 705 HG13 VAL 87 HG13 VAL 87 3.345 14.434 1.070 706 HG21 VAL 87 HG21 VAL 87 1.737 11.556 2.739 707 HG22 VAL 87 HG22 VAL 87 2.761 10.306 2.002 708 HG23 VAL 87 HG23 VAL 87 3.432 11.449 3.202 709 H ASP 88 H ASP 88 4.251 12.317 -1.683 710 HA ASP 88 HA ASP 88 3.915 9.692 -3.010 711 HB2 ASP 88 HB2 ASP 88 5.038 10.582 -4.880 712 HB3 ASP 88 HB3 ASP 88 3.804 11.740 -4.420 713 H ILE 89 H ILE 89 6.366 9.167 -3.984 714 HA ILE 89 HA ILE 89 7.682 8.120 -1.657 715 HB ILE 89 HB ILE 89 9.439 7.465 -3.404 716 HG12 ILE 89 HG12 ILE 89 7.291 8.119 -5.453 717 HG13 ILE 89 HG13 ILE 89 8.593 9.244 -5.083 718 HG21 ILE 89 HG21 ILE 89 7.660 5.992 -2.492 719 HG22 ILE 89 HG22 ILE 89 6.582 6.516 -3.803 720 HG23 ILE 89 HG23 ILE 89 8.056 5.605 -4.180 721 HD11 ILE 89 HD11 ILE 89 9.102 7.866 -7.058 722 HD12 ILE 89 HD12 ILE 89 10.287 7.667 -5.771 723 HD13 ILE 89 HD13 ILE 89 9.058 6.408 -6.050 724 H TYR 90 H TYR 90 8.139 11.084 -3.564 725 HA TYR 90 HA TYR 90 10.841 11.564 -2.524 726 HB2 TYR 90 HB2 TYR 90 8.903 13.079 -4.287 727 HB3 TYR 90 HB3 TYR 90 10.330 13.837 -3.614 728 HD1 TYR 90 HD1 TYR 90 10.493 10.255 -4.802 729 HD2 TYR 90 HD2 TYR 90 11.317 14.398 -5.705 730 HE1 TYR 90 HE1 TYR 90 11.766 9.558 -6.758 731 HE2 TYR 90 HE2 TYR 90 12.643 13.685 -7.671 732 HH TYR 90 HH TYR 90 13.033 10.242 -8.601 733 H GLY 91 H GLY 91 7.598 11.928 -1.437 734 HA2 GLY 91 HA2 GLY 91 7.057 12.482 0.813 735 HA3 GLY 91 HA3 GLY 91 8.490 13.531 0.901 736 H ASN 92 H ASN 92 6.938 14.049 -2.089 737 HA ASN 92 HA ASN 92 6.135 16.724 -1.292 738 HB2 ASN 92 HB2 ASN 92 5.388 15.147 -3.799 739 HB3 ASN 92 HB3 ASN 92 5.110 16.842 -3.567 740 HD21 ASN 92 HD21 ASN 92 7.199 14.701 -4.960 741 HD22 ASN 92 HD22 ASN 92 8.610 15.787 -5.101 742 H GLU 93 H GLU 93 4.045 17.578 -1.195 743 HA GLU 93 HA GLU 93 2.049 15.751 -0.197 744 HB2 GLU 93 HB2 GLU 93 2.499 18.727 -0.416 745 HB3 GLU 93 HB3 GLU 93 0.837 18.129 -0.359 746 HG2 GLU 93 HG2 GLU 93 1.283 16.838 1.661 747 HG3 GLU 93 HG3 GLU 93 2.985 17.354 1.658 748 H VAL 94 H VAL 94 0.169 15.221 -1.173 749 HA VAL 94 HA VAL 94 -0.156 15.893 -4.013 750 HB VAL 94 HB VAL 94 -0.451 13.769 -4.723 751 HG11 VAL 94 HG11 VAL 94 1.949 14.277 -4.032 752 HG12 VAL 94 HG12 VAL 94 1.661 13.296 -2.607 753 HG13 VAL 94 HG13 VAL 94 1.536 12.568 -4.211 754 HG21 VAL 94 HG21 VAL 94 -1.827 12.468 -3.545 755 HG22 VAL 94 HG22 VAL 94 -0.333 11.851 -2.798 756 HG23 VAL 94 HG23 VAL 94 -1.300 13.112 -2.000 757 H ASP 95 H ASP 95 -2.510 14.955 -4.668 758 HA ASP 95 HA ASP 95 -4.290 16.741 -3.261 759 HB2 ASP 95 HB2 ASP 95 -4.889 14.540 -5.295 760 HB3 ASP 95 HB3 ASP 95 -5.929 15.910 -4.904 761 H VAL 96 H VAL 96 -6.710 15.466 -2.875 762 HA VAL 96 HA VAL 96 -5.987 13.363 -0.883 763 HB VAL 96 HB VAL 96 -7.762 14.162 0.413 764 HG11 VAL 96 HG11 VAL 96 -6.783 16.824 -0.626 765 HG12 VAL 96 HG12 VAL 96 -6.987 16.262 1.038 766 HG13 VAL 96 HG13 VAL 96 -5.622 15.723 0.043 767 HG21 VAL 96 HG21 VAL 96 -9.537 14.591 -1.210 768 HG22 VAL 96 HG22 VAL 96 -9.222 16.096 -0.331 769 HG23 VAL 96 HG23 VAL 96 -8.570 15.884 -1.953 770 H VAL 97 H VAL 97 -7.684 11.886 -0.240 771 HA VAL 97 HA VAL 97 -8.776 10.511 -2.618 772 HB VAL 97 HB VAL 97 -9.223 9.714 0.291 773 HG11 VAL 97 HG11 VAL 97 -9.149 8.103 -2.309 774 HG12 VAL 97 HG12 VAL 97 -9.526 7.474 -0.689 775 HG13 VAL 97 HG13 VAL 97 -10.622 8.626 -1.466 776 HG21 VAL 97 HG21 VAL 97 -6.823 9.789 0.138 777 HG22 VAL 97 HG22 VAL 97 -7.318 8.104 0.005 778 HG23 VAL 97 HG23 VAL 97 -6.845 8.987 -1.463 779 H THR 98 H THR 98 -10.924 10.943 -3.300 780 HA THR 98 HA THR 98 -12.389 13.021 -1.997 781 HB THR 98 HB THR 98 -14.070 12.236 -3.847 782 HG1 THR 98 HG1 THR 98 -12.730 11.153 -5.527 783 HG21 THR 98 HG21 THR 98 -12.768 13.395 -5.581 784 HG22 THR 98 HG22 THR 98 -12.615 14.215 -4.043 785 HG23 THR 98 HG23 THR 98 -11.280 13.199 -4.627 786 HA PRO 99 HA PRO 99 -14.828 10.790 0.825 787 HB2 PRO 99 HB2 PRO 99 -17.440 11.703 0.470 788 HB3 PRO 99 HB3 PRO 99 -16.137 12.525 1.377 789 HG2 PRO 99 HG2 PRO 99 -17.034 12.999 -1.458 790 HG3 PRO 99 HG3 PRO 99 -16.610 14.201 -0.213 791 HD2 PRO 99 HD2 PRO 99 -14.839 13.504 -2.153 792 HD3 PRO 99 HD3 PRO 99 -14.278 13.797 -0.485 793 H GLU 100 H GLU 100 -16.206 10.580 -2.494 794 HA GLU 100 HA GLU 100 -17.769 8.242 -1.833 795 HB2 GLU 100 HB2 GLU 100 -16.950 9.596 -4.407 796 HB3 GLU 100 HB3 GLU 100 -17.662 7.989 -4.456 797 HG2 GLU 100 HG2 GLU 100 -18.893 10.315 -2.959 798 HG3 GLU 100 HG3 GLU 100 -19.360 9.867 -4.619 799 H GLN 101 H GLN 101 -14.606 8.766 -3.512 800 HA GLN 101 HA GLN 101 -14.252 5.958 -3.897 801 HB2 GLN 101 HB2 GLN 101 -12.149 8.138 -3.904 802 HB3 GLN 101 HB3 GLN 101 -12.002 6.438 -4.458 803 HG2 GLN 101 HG2 GLN 101 -13.996 6.978 -6.033 804 HG3 GLN 101 HG3 GLN 101 -13.659 8.674 -5.691 805 HE21 GLN 101 HE21 GLN 101 -12.478 9.540 -7.433 806 HE22 GLN 101 HE22 GLN 101 -11.159 8.733 -8.233 807 H ALA 102 H ALA 102 -13.399 8.076 -1.159 808 HA ALA 102 HA ALA 102 -11.635 6.185 0.098 809 HB1 ALA 102 HB1 ALA 102 -11.691 8.581 0.730 810 HB2 ALA 102 HB2 ALA 102 -13.348 8.403 1.334 811 HB3 ALA 102 HB3 ALA 102 -12.014 7.552 2.132 812 H LYS 103 H LYS 103 -15.144 6.929 0.686 813 HA LYS 103 HA LYS 103 -15.436 4.883 2.596 814 HB2 LYS 103 HB2 LYS 103 -17.800 5.258 2.518 815 HB3 LYS 103 HB3 LYS 103 -17.044 6.815 2.217 816 HG2 LYS 103 HG2 LYS 103 -17.390 6.431 -0.239 817 HG3 LYS 103 HG3 LYS 103 -18.294 4.958 0.130 818 HD2 LYS 103 HD2 LYS 103 -19.027 7.795 0.925 819 HD3 LYS 103 HD3 LYS 103 -19.710 6.870 -0.422 820 HE2 LYS 103 HE2 LYS 103 -20.690 5.235 1.101 821 HE3 LYS 103 HE3 LYS 103 -19.933 6.015 2.495 822 HZ1 LYS 103 HZ1 LYS 103 -21.936 7.305 0.734 823 HZ2 LYS 103 HZ2 LYS 103 -22.235 6.677 2.229 824 HZ3 LYS 103 HZ3 LYS 103 -21.227 7.976 2.056 825 H TYR 104 H TYR 104 -15.522 4.625 -0.864 826 HA TYR 104 HA TYR 104 -16.861 2.236 -1.177 827 HB2 TYR 104 HB2 TYR 104 -15.157 3.916 -2.763 828 HB3 TYR 104 HB3 TYR 104 -14.631 2.247 -2.987 829 HD1 TYR 104 HD1 TYR 104 -17.417 4.623 -3.372 830 HD2 TYR 104 HD2 TYR 104 -16.143 0.541 -3.911 831 HE1 TYR 104 HE1 TYR 104 -19.588 4.094 -4.457 832 HE2 TYR 104 HE2 TYR 104 -18.252 0.049 -5.130 833 HH TYR 104 HH TYR 104 -20.846 2.468 -5.573 834 H ALA 105 H ALA 105 -13.697 2.763 0.206 835 HA ALA 105 HA ALA 105 -12.473 0.265 -0.056 836 HB1 ALA 105 HB1 ALA 105 -12.516 2.151 2.321 837 HB2 ALA 105 HB2 ALA 105 -11.308 0.904 2.037 838 HB3 ALA 105 HB3 ALA 105 -11.419 2.284 0.922 839 H TYR 106 H TYR 106 -15.245 1.192 1.981 840 HA TYR 106 HA TYR 106 -15.101 -0.891 3.862 841 HB2 TYR 106 HB2 TYR 106 -17.116 -0.211 4.602 842 HB3 TYR 106 HB3 TYR 106 -16.675 1.216 3.717 843 HD1 TYR 106 HD1 TYR 106 -17.537 0.945 0.976 844 HD2 TYR 106 HD2 TYR 106 -19.310 -0.926 4.443 845 HE1 TYR 106 HE1 TYR 106 -19.720 0.932 -0.149 846 HE2 TYR 106 HE2 TYR 106 -21.465 -1.055 3.261 847 HH TYR 106 HH TYR 106 -21.934 0.310 -0.046 848 H GLN 107 H GLN 107 -16.352 -0.929 0.541 849 HA GLN 107 HA GLN 107 -17.712 -3.422 0.701 850 HB2 GLN 107 HB2 GLN 107 -16.256 -2.157 -1.645 851 HB3 GLN 107 HB3 GLN 107 -17.348 -3.564 -1.708 852 HG2 GLN 107 HG2 GLN 107 -19.009 -1.880 -0.477 853 HG3 GLN 107 HG3 GLN 107 -17.993 -0.658 -1.249 854 HE21 GLN 107 HE21 GLN 107 -17.500 -2.312 -3.774 855 HE22 GLN 107 HE22 GLN 107 -19.066 -2.229 -4.572 856 H ARG 108 H ARG 108 -14.387 -2.595 -0.310 857 HA ARG 108 HA ARG 108 -13.434 -5.223 -0.694 858 HB2 ARG 108 HB2 ARG 108 -11.780 -2.919 0.388 859 HB3 ARG 108 HB3 ARG 108 -11.229 -4.259 -0.599 860 HG2 ARG 108 HG2 ARG 108 -13.084 -2.003 -1.510 861 HG3 ARG 108 HG3 ARG 108 -11.361 -2.113 -1.840 862 HD2 ARG 108 HD2 ARG 108 -11.602 -3.978 -3.291 863 HD3 ARG 108 HD3 ARG 108 -13.233 -4.339 -2.717 864 HE ARG 108 HE ARG 108 -14.139 -2.852 -4.114 865 HH11 ARG 108 HH11 ARG 108 -10.596 -2.243 -4.159 866 HH12 ARG 108 HH12 ARG 108 -10.723 -0.980 -5.328 867 HH21 ARG 108 HH21 ARG 108 -14.211 -1.290 -5.814 868 HH22 ARG 108 HH22 ARG 108 -12.787 -0.363 -6.177 869 H TYR 109 H TYR 109 -13.782 -3.360 2.351 870 HA TYR 109 HA TYR 109 -12.294 -5.238 3.938 871 HB2 TYR 109 HB2 TYR 109 -12.807 -2.913 4.587 872 HB3 TYR 109 HB3 TYR 109 -14.508 -3.290 4.733 873 HD1 TYR 109 HD1 TYR 109 -15.258 -5.104 6.412 874 HD2 TYR 109 HD2 TYR 109 -11.370 -3.217 6.510 875 HE1 TYR 109 HE1 TYR 109 -14.923 -5.907 8.716 876 HE2 TYR 109 HE2 TYR 109 -11.089 -3.931 8.857 877 HH TYR 109 HH TYR 109 -11.937 -5.367 10.544 878 H GLN 110 H GLN 110 -15.847 -4.783 3.440 879 HA GLN 110 HA GLN 110 -16.529 -7.092 4.964 880 HB2 GLN 110 HB2 GLN 110 -18.787 -6.886 4.193 881 HB3 GLN 110 HB3 GLN 110 -18.176 -5.311 4.700 882 HG2 GLN 110 HG2 GLN 110 -17.904 -4.574 2.443 883 HG3 GLN 110 HG3 GLN 110 -18.176 -6.175 1.774 884 HE21 GLN 110 HE21 GLN 110 -20.105 -3.972 4.038 885 HE22 GLN 110 HE22 GLN 110 -21.485 -4.035 2.986 886 H GLU 111 H GLU 111 -15.590 -6.710 1.616 887 HA GLU 111 HA GLU 111 -16.762 -8.991 0.414 888 HB2 GLU 111 HB2 GLU 111 -14.182 -7.447 0.074 889 HB3 GLU 111 HB3 GLU 111 -14.362 -8.944 -0.802 890 HG2 GLU 111 HG2 GLU 111 -16.591 -6.915 -1.000 891 HG3 GLU 111 HG3 GLU 111 -15.067 -6.622 -1.863 892 H ARG 112 H ARG 112 -13.720 -8.699 2.256 893 HA ARG 112 HA ARG 112 -13.562 -11.689 2.311 894 HB2 ARG 112 HB2 ARG 112 -11.348 -9.699 2.842 895 HB3 ARG 112 HB3 ARG 112 -11.236 -11.449 2.812 896 HG2 ARG 112 HG2 ARG 112 -12.401 -10.862 0.309 897 HG3 ARG 112 HG3 ARG 112 -11.297 -9.518 0.577 898 HD2 ARG 112 HD2 ARG 112 -10.050 -11.140 -0.604 899 HD3 ARG 112 HD3 ARG 112 -9.495 -11.278 1.071 900 HE ARG 112 HE ARG 112 -11.716 -13.012 0.141 901 HH11 ARG 112 HH11 ARG 112 -8.245 -12.898 1.038 902 HH12 ARG 112 HH12 ARG 112 -8.032 -14.607 0.860 903 HH21 ARG 112 HH21 ARG 112 -11.398 -15.301 0.028 904 HH22 ARG 112 HH22 ARG 112 -9.880 -15.975 0.516 905 H TYR 113 H TYR 113 -13.582 -8.927 4.527 906 HA TYR 113 HA TYR 113 -13.302 -10.775 6.829 907 HB2 TYR 113 HB2 TYR 113 -13.363 -7.767 6.961 908 HB3 TYR 113 HB3 TYR 113 -12.664 -8.901 8.102 909 HD1 TYR 113 HD1 TYR 113 -11.762 -6.418 5.968 910 HD2 TYR 113 HD2 TYR 113 -10.785 -10.559 6.663 911 HE1 TYR 113 HE1 TYR 113 -9.572 -6.085 4.822 912 HE2 TYR 113 HE2 TYR 113 -8.558 -10.202 5.624 913 HH TYR 113 HH TYR 113 -7.636 -7.108 4.026 914 H GLY 114 H GLY 114 -15.855 -10.067 5.017 915 HA2 GLY 114 HA2 GLY 114 -17.731 -10.066 7.265 916 HA3 GLY 114 HA3 GLY 114 -17.892 -8.771 6.042 917 H ASN 115 H ASN 115 -20.044 -10.112 6.153 918 HA ASN 115 HA ASN 115 -20.172 -11.652 3.670 919 HB2 ASN 115 HB2 ASN 115 -19.814 -13.409 5.380 920 HB3 ASN 115 HB3 ASN 115 -21.259 -12.860 6.244 921 HD21 ASN 115 HD21 ASN 115 -21.089 -15.515 5.244 922 HD22 ASN 115 HD22 ASN 115 -22.201 -15.659 3.875 923 H LYS 116 H LYS 116 -21.191 -9.797 2.907 924 HA LYS 116 HA LYS 116 -23.970 -9.289 3.716 925 HB2 LYS 116 HB2 LYS 116 -22.066 -7.631 4.543 926 HB3 LYS 116 HB3 LYS 116 -21.975 -7.153 2.861 927 HG2 LYS 116 HG2 LYS 116 -24.429 -6.995 4.644 928 HG3 LYS 116 HG3 LYS 116 -23.287 -5.676 4.338 929 HD2 LYS 116 HD2 LYS 116 -23.876 -6.015 1.828 930 HD3 LYS 116 HD3 LYS 116 -25.285 -6.906 2.458 931 HE2 LYS 116 HE2 LYS 116 -26.129 -4.998 3.584 932 HE3 LYS 116 HE3 LYS 116 -24.682 -4.039 3.213 933 HZ1 LYS 116 HZ1 LYS 116 -26.739 -3.772 1.748 934 HZ2 LYS 116 HZ2 LYS 116 -25.311 -3.915 0.971 935 HZ3 LYS 116 HZ3 LYS 116 -26.342 -5.201 1.062 936 H LYS 117 H LYS 117 -25.168 -8.508 1.673 937 HA LYS 117 HA LYS 117 -23.732 -9.088 -0.867 938 HB2 LYS 117 HB2 LYS 117 -25.167 -11.014 0.143 939 HB3 LYS 117 HB3 LYS 117 -26.546 -9.968 -0.092 940 HG2 LYS 117 HG2 LYS 117 -26.769 -11.062 -2.027 941 HG3 LYS 117 HG3 LYS 117 -25.604 -9.925 -2.640 942 HD2 LYS 117 HD2 LYS 117 -24.984 -12.112 -3.360 943 HD3 LYS 117 HD3 LYS 117 -23.780 -11.547 -2.200 944 HE2 LYS 117 HE2 LYS 117 -24.323 -13.909 -1.834 945 HE3 LYS 117 HE3 LYS 117 -24.802 -12.927 -0.456 946 HZ1 LYS 117 HZ1 LYS 117 -27.095 -12.982 -1.350 947 HZ2 LYS 117 HZ2 LYS 117 -26.604 -14.025 -2.519 948 HZ3 LYS 117 HZ3 LYS 117 -26.526 -14.450 -0.927 949 H SER 118 H SER 118 -24.927 -8.154 -2.734 950 HA SER 118 HA SER 118 -26.094 -5.525 -2.105 951 HB2 SER 118 HB2 SER 118 -25.280 -6.978 -4.664 952 HB3 SER 118 HB3 SER 118 -26.065 -5.399 -4.650 953 HG SER 118 HG SER 118 -23.591 -5.980 -3.326 954 H GLN 119 H GLN 119 -28.053 -5.099 -3.757 955 HA GLN 119 HA GLN 119 -30.062 -7.279 -3.530 956 HB2 GLN 119 HB2 GLN 119 -30.237 -5.112 -1.979 957 HB3 GLN 119 HB3 GLN 119 -30.754 -4.336 -3.471 958 HG2 GLN 119 HG2 GLN 119 -32.512 -6.345 -3.558 959 HG3 GLN 119 HG3 GLN 119 -32.064 -6.560 -1.873 960 HE21 GLN 119 HE21 GLN 119 -33.654 -4.355 -4.242 961 HE22 GLN 119 HE22 GLN 119 -34.385 -3.376 -2.979 962 H ASP 120 H ASP 120 -31.995 -6.178 -5.154 963 HA ASP 120 HA ASP 120 -30.805 -5.393 -7.727 964 HB2 ASP 120 HB2 ASP 120 -32.513 -7.830 -7.197 965 HB3 ASP 120 HB3 ASP 120 -32.404 -7.000 -8.765 966 H LEU 121 H LEU 121 -32.580 -4.596 -9.097 967 HA LEU 121 HA LEU 121 -34.174 -2.709 -7.580 968 HB2 LEU 121 HB2 LEU 121 -34.788 -1.785 -9.680 969 HB3 LEU 121 HB3 LEU 121 -33.075 -2.075 -9.715 970 HG LEU 121 HG LEU 121 -35.093 -3.990 -10.983 971 HD11 LEU 121 HD11 LEU 121 -34.634 -2.852 -13.119 972 HD12 LEU 121 HD12 LEU 121 -35.386 -1.758 -11.958 973 HD13 LEU 121 HD13 LEU 121 -33.635 -1.644 -12.274 974 HD21 LEU 121 HD21 LEU 121 -32.941 -5.066 -10.790 975 HD22 LEU 121 HD22 LEU 121 -33.123 -4.564 -12.452 976 HD23 LEU 121 HD23 LEU 121 -32.088 -3.606 -11.375 977 H LYS 122 H LYS 122 -36.480 -2.378 -8.060 978 HA LYS 122 HA LYS 122 -37.980 -4.857 -7.675 979 HB2 LYS 122 HB2 LYS 122 -38.704 -3.138 -6.241 980 HB3 LYS 122 HB3 LYS 122 -38.567 -1.871 -7.482 981 HG2 LYS 122 HG2 LYS 122 -40.648 -4.055 -7.861 982 HG3 LYS 122 HG3 LYS 122 -40.918 -2.833 -6.654 983 HD2 LYS 122 HD2 LYS 122 -41.504 -1.273 -8.110 984 HD3 LYS 122 HD3 LYS 122 -40.085 -1.502 -9.098 985 HE2 LYS 122 HE2 LYS 122 -42.547 -3.284 -9.291 986 HE3 LYS 122 HE3 LYS 122 -42.304 -1.805 -10.258 987 HZ1 LYS 122 HZ1 LYS 122 -40.610 -4.254 -10.319 988 HZ2 LYS 122 HZ2 LYS 122 -41.494 -3.615 -11.582 989 HZ3 LYS 122 HZ3 LYS 122 -40.126 -2.938 -10.930 Start of MODEL 2 1 H1 GLY 1 H GLY 1 28.960 -7.430 11.657 2 HA2 GLY 1 HA2 GLY 1 30.953 -5.411 10.756 3 HA3 GLY 1 HA3 GLY 1 30.010 -6.468 9.680 4 H SER 2 H SER 2 28.862 -4.684 8.604 5 HA SER 2 HA SER 2 27.070 -3.122 10.392 6 HB2 SER 2 HB2 SER 2 26.989 -1.608 8.324 7 HB3 SER 2 HB3 SER 2 28.458 -1.600 9.311 8 HG SER 2 HG SER 2 28.916 -1.670 7.098 9 H ASN 3 H ASN 3 24.930 -2.747 9.555 10 HA ASN 3 HA ASN 3 23.646 -5.171 8.634 11 HB2 ASN 3 HB2 ASN 3 22.644 -2.354 9.190 12 HB3 ASN 3 HB3 ASN 3 21.619 -3.575 8.460 13 HD21 ASN 3 HD21 ASN 3 20.203 -3.520 10.366 14 HD22 ASN 3 HD22 ASN 3 20.747 -4.381 11.811 15 H GLN 4 H GLN 4 23.878 -5.862 6.640 16 HA GLN 4 HA GLN 4 23.522 -4.085 4.286 17 HB2 GLN 4 HB2 GLN 4 25.923 -4.428 5.029 18 HB3 GLN 4 HB3 GLN 4 25.730 -6.145 4.732 19 HG2 GLN 4 HG2 GLN 4 25.481 -5.726 2.320 20 HG3 GLN 4 HG3 GLN 4 25.495 -3.977 2.597 21 HE21 GLN 4 HE21 GLN 4 27.488 -3.023 3.421 22 HE22 GLN 4 HE22 GLN 4 29.042 -3.818 3.145 23 H GLN 5 H GLN 5 22.333 -6.620 5.926 24 HA GLN 5 HA GLN 5 22.168 -8.767 4.002 25 HB2 GLN 5 HB2 GLN 5 21.884 -8.744 6.595 26 HB3 GLN 5 HB3 GLN 5 20.243 -8.189 6.303 27 HG2 GLN 5 HG2 GLN 5 19.751 -10.267 5.073 28 HG3 GLN 5 HG3 GLN 5 21.451 -10.764 5.209 29 HE21 GLN 5 HE21 GLN 5 20.987 -12.732 6.384 30 HE22 GLN 5 HE22 GLN 5 20.325 -12.642 8.008 31 H LEU 6 H LEU 6 20.237 -9.387 2.723 32 HA LEU 6 HA LEU 6 18.702 -7.029 1.831 33 HB2 LEU 6 HB2 LEU 6 18.871 -9.856 0.719 34 HB3 LEU 6 HB3 LEU 6 17.819 -8.592 0.102 35 HG LEU 6 HG LEU 6 20.147 -7.191 0.075 36 HD11 LEU 6 HD11 LEU 6 20.952 -10.073 -0.538 37 HD12 LEU 6 HD12 LEU 6 21.942 -8.624 -0.804 38 HD13 LEU 6 HD13 LEU 6 21.532 -9.102 0.837 39 HD21 LEU 6 HD21 LEU 6 19.191 -9.068 -2.119 40 HD22 LEU 6 HD22 LEU 6 18.612 -7.419 -1.815 41 HD23 LEU 6 HD23 LEU 6 20.279 -7.666 -2.326 42 H ASN 7 H ASN 7 18.245 -9.143 4.306 43 HA ASN 7 HA ASN 7 15.420 -9.714 3.929 44 HB2 ASN 7 HB2 ASN 7 15.507 -10.920 5.846 45 HB3 ASN 7 HB3 ASN 7 17.180 -11.039 5.356 46 HD21 ASN 7 HD21 ASN 7 17.794 -8.092 6.557 47 HD22 ASN 7 HD22 ASN 7 17.866 -8.574 8.222 48 H ALA 8 H ALA 8 14.046 -9.185 6.131 49 HA ALA 8 HA ALA 8 14.333 -6.457 7.082 50 HB1 ALA 8 HB1 ALA 8 12.204 -5.655 6.400 51 HB2 ALA 8 HB2 ALA 8 13.027 -6.162 4.930 52 HB3 ALA 8 HB3 ALA 8 11.746 -7.186 5.632 53 H THR 9 H THR 9 11.161 -7.345 7.604 54 HA THR 9 HA THR 9 11.828 -8.549 10.167 55 HB THR 9 HB THR 9 9.122 -7.928 8.928 56 HG1 THR 9 HG1 THR 9 9.408 -5.944 9.789 57 HG21 THR 9 HG21 THR 9 8.353 -7.809 11.276 58 HG22 THR 9 HG22 THR 9 8.960 -9.431 10.918 59 HG23 THR 9 HG23 THR 9 9.963 -8.298 11.846 60 H LYS 10 H LYS 10 9.055 -9.878 8.269 61 HA LYS 10 HA LYS 10 10.378 -12.310 7.489 62 HB2 LYS 10 HB2 LYS 10 10.187 -12.660 9.920 63 HB3 LYS 10 HB3 LYS 10 8.472 -12.331 9.887 64 HG2 LYS 10 HG2 LYS 10 8.045 -14.390 8.623 65 HG3 LYS 10 HG3 LYS 10 9.797 -14.614 8.362 66 HD2 LYS 10 HD2 LYS 10 10.101 -14.673 10.830 67 HD3 LYS 10 HD3 LYS 10 8.338 -14.678 11.044 68 HE2 LYS 10 HE2 LYS 10 8.192 -16.860 9.963 69 HE3 LYS 10 HE3 LYS 10 9.893 -16.748 9.441 70 HZ1 LYS 10 HZ1 LYS 10 10.482 -16.642 11.814 71 HZ2 LYS 10 HZ2 LYS 10 8.963 -17.028 12.240 72 HZ3 LYS 10 HZ3 LYS 10 9.911 -18.082 11.368 73 H LYS 11 H LYS 11 8.904 -13.513 6.163 74 HA LYS 11 HA LYS 11 7.182 -14.144 4.956 75 HB2 LYS 11 HB2 LYS 11 5.598 -12.027 6.355 76 HB3 LYS 11 HB3 LYS 11 5.286 -12.142 4.649 77 HG2 LYS 11 HG2 LYS 11 3.790 -13.696 5.375 78 HG3 LYS 11 HG3 LYS 11 5.177 -14.744 5.097 79 HD2 LYS 11 HD2 LYS 11 4.310 -15.401 7.187 80 HD3 LYS 11 HD3 LYS 11 5.746 -14.418 7.580 81 HE2 LYS 11 HE2 LYS 11 4.266 -12.458 7.943 82 HE3 LYS 11 HE3 LYS 11 2.845 -13.447 7.567 83 HZ1 LYS 11 HZ1 LYS 11 4.380 -14.657 9.619 84 HZ2 LYS 11 HZ2 LYS 11 4.081 -13.077 9.973 85 HZ3 LYS 11 HZ3 LYS 11 2.815 -14.056 9.678 86 H ASP 12 H ASP 12 7.120 -13.893 2.705 87 HA ASP 12 HA ASP 12 9.113 -12.112 1.709 88 HB2 ASP 12 HB2 ASP 12 8.660 -13.027 -0.423 89 HB3 ASP 12 HB3 ASP 12 8.501 -14.357 0.723 90 H LYS 13 H LYS 13 5.573 -12.022 1.824 91 HA LYS 13 HA LYS 13 5.335 -9.712 0.126 92 HB2 LYS 13 HB2 LYS 13 3.449 -10.901 2.202 93 HB3 LYS 13 HB3 LYS 13 3.037 -9.606 1.064 94 HG2 LYS 13 HG2 LYS 13 3.633 -11.111 -0.836 95 HG3 LYS 13 HG3 LYS 13 3.904 -12.441 0.306 96 HD2 LYS 13 HD2 LYS 13 1.581 -12.694 0.685 97 HD3 LYS 13 HD3 LYS 13 1.293 -10.971 0.480 98 HE2 LYS 13 HE2 LYS 13 0.162 -11.830 -1.304 99 HE3 LYS 13 HE3 LYS 13 1.671 -11.268 -2.015 100 HZ1 LYS 13 HZ1 LYS 13 1.195 -13.347 -2.938 101 HZ2 LYS 13 HZ2 LYS 13 2.402 -13.664 -1.909 102 HZ3 LYS 13 HZ3 LYS 13 0.877 -14.075 -1.495 103 H LEU 14 H LEU 14 5.382 -10.091 3.716 104 HA LEU 14 HA LEU 14 5.142 -7.259 4.129 105 HB2 LEU 14 HB2 LEU 14 6.393 -9.327 5.942 106 HB3 LEU 14 HB3 LEU 14 5.861 -7.719 6.422 107 HG LEU 14 HG LEU 14 4.059 -9.969 5.414 108 HD11 LEU 14 HD11 LEU 14 4.961 -10.294 7.697 109 HD12 LEU 14 HD12 LEU 14 4.324 -8.718 8.181 110 HD13 LEU 14 HD13 LEU 14 3.209 -10.025 7.716 111 HD21 LEU 14 HD21 LEU 14 2.187 -8.477 6.142 112 HD22 LEU 14 HD22 LEU 14 3.370 -7.173 6.390 113 HD23 LEU 14 HD23 LEU 14 3.081 -7.829 4.761 114 H GLN 15 H GLN 15 7.936 -9.328 3.412 115 HA GLN 15 HA GLN 15 9.894 -7.383 4.185 116 HB2 GLN 15 HB2 GLN 15 10.390 -9.782 3.987 117 HB3 GLN 15 HB3 GLN 15 10.124 -9.715 2.239 118 HG2 GLN 15 HG2 GLN 15 12.024 -8.114 2.030 119 HG3 GLN 15 HG3 GLN 15 12.275 -8.186 3.766 120 HE21 GLN 15 HE21 GLN 15 12.963 -9.698 0.765 121 HE22 GLN 15 HE22 GLN 15 13.637 -11.199 1.374 122 H VAL 16 H VAL 16 8.391 -8.121 0.909 123 HA VAL 16 HA VAL 16 10.005 -6.110 -0.352 124 HB VAL 16 HB VAL 16 8.470 -6.190 -2.236 125 HG11 VAL 16 HG11 VAL 16 9.005 -8.968 -1.128 126 HG12 VAL 16 HG12 VAL 16 8.702 -8.541 -2.817 127 HG13 VAL 16 HG13 VAL 16 10.175 -7.954 -2.002 128 HG21 VAL 16 HG21 VAL 16 6.530 -7.698 -2.274 129 HG22 VAL 16 HG22 VAL 16 6.760 -8.054 -0.563 130 HG23 VAL 16 HG23 VAL 16 6.325 -6.407 -1.073 131 H ILE 17 H ILE 17 6.965 -5.863 1.458 132 HA ILE 17 HA ILE 17 6.521 -3.117 0.593 133 HB ILE 17 HB ILE 17 5.376 -4.495 3.043 134 HG12 ILE 17 HG12 ILE 17 4.070 -4.150 0.293 135 HG13 ILE 17 HG13 ILE 17 4.817 -5.636 0.830 136 HG21 ILE 17 HG21 ILE 17 5.185 -2.048 3.104 137 HG22 ILE 17 HG22 ILE 17 4.514 -2.023 1.464 138 HG23 ILE 17 HG23 ILE 17 3.587 -2.734 2.794 139 HD11 ILE 17 HD11 ILE 17 2.660 -6.097 1.489 140 HD12 ILE 17 HD12 ILE 17 3.251 -5.352 2.948 141 HD13 ILE 17 HD13 ILE 17 2.263 -4.389 1.797 142 H ASP 18 H ASP 18 8.263 -4.732 3.236 143 HA ASP 18 HA ASP 18 8.820 -2.346 4.764 144 HB2 ASP 18 HB2 ASP 18 9.307 -5.017 5.169 145 HB3 ASP 18 HB3 ASP 18 10.906 -4.485 4.725 146 H TRP 19 H TRP 19 10.406 -4.002 2.053 147 HA TRP 19 HA TRP 19 12.791 -2.498 1.933 148 HB2 TRP 19 HB2 TRP 19 12.589 -4.549 0.707 149 HB3 TRP 19 HB3 TRP 19 11.180 -3.979 -0.175 150 HD1 TRP 19 HD1 TRP 19 11.574 -2.883 -2.480 151 HE1 TRP 19 HE1 TRP 19 13.588 -1.915 -3.733 152 HE3 TRP 19 HE3 TRP 19 15.129 -3.258 1.201 153 HZ2 TRP 19 HZ2 TRP 19 16.378 -1.573 -3.304 154 HZ3 TRP 19 HZ3 TRP 19 17.415 -2.387 0.776 155 HH2 TRP 19 HH2 TRP 19 18.068 -1.601 -1.472 156 H LEU 20 H LEU 20 9.704 -1.988 0.051 157 HA LEU 20 HA LEU 20 10.644 0.480 -1.001 158 HB2 LEU 20 HB2 LEU 20 8.434 0.873 -1.814 159 HB3 LEU 20 HB3 LEU 20 8.982 -0.771 -2.104 160 HG LEU 20 HG LEU 20 7.601 -1.178 0.167 161 HD11 LEU 20 HD11 LEU 20 5.473 0.042 0.119 162 HD12 LEU 20 HD12 LEU 20 6.820 1.161 0.362 163 HD13 LEU 20 HD13 LEU 20 6.059 1.029 -1.239 164 HD21 LEU 20 HD21 LEU 20 7.336 -2.478 -1.803 165 HD22 LEU 20 HD22 LEU 20 5.756 -1.997 -1.212 166 HD23 LEU 20 HD23 LEU 20 6.450 -1.153 -2.620 167 H ILE 21 H ILE 21 9.018 -0.227 2.075 168 HA ILE 21 HA ILE 21 8.311 2.476 2.747 169 HB ILE 21 HB ILE 21 8.783 -0.087 4.288 170 HG12 ILE 21 HG12 ILE 21 6.274 1.623 4.107 171 HG13 ILE 21 HG13 ILE 21 6.633 0.347 2.984 172 HG21 ILE 21 HG21 ILE 21 8.183 2.571 5.626 173 HG22 ILE 21 HG22 ILE 21 8.096 0.966 6.392 174 HG23 ILE 21 HG23 ILE 21 9.628 1.564 5.834 175 HD11 ILE 21 HD11 ILE 21 6.680 -1.285 4.910 176 HD12 ILE 21 HD12 ILE 21 6.190 0.040 5.987 177 HD13 ILE 21 HD13 ILE 21 5.117 -0.461 4.697 178 H GLU 22 H GLU 22 11.195 0.453 3.479 179 HA GLU 22 HA GLU 22 12.638 2.466 4.900 180 HB2 GLU 22 HB2 GLU 22 12.839 -0.033 5.034 181 HB3 GLU 22 HB3 GLU 22 13.657 -0.020 3.470 182 HG2 GLU 22 HG2 GLU 22 15.480 1.342 4.423 183 HG3 GLU 22 HG3 GLU 22 14.606 1.478 5.959 184 H ASN 23 H ASN 23 12.515 1.520 1.506 185 HA ASN 23 HA ASN 23 14.861 2.881 0.594 186 HB2 ASN 23 HB2 ASN 23 12.386 1.755 -0.722 187 HB3 ASN 23 HB3 ASN 23 13.323 2.913 -1.621 188 HD21 ASN 23 HD21 ASN 23 14.163 0.153 0.533 189 HD22 ASN 23 HD22 ASN 23 15.357 -0.530 -0.548 190 H PHE 24 H PHE 24 11.419 3.994 0.700 191 HA PHE 24 HA PHE 24 12.463 6.773 0.275 192 HB2 PHE 24 HB2 PHE 24 10.100 5.389 -0.912 193 HB3 PHE 24 HB3 PHE 24 9.967 7.084 -0.492 194 HD1 PHE 24 HD1 PHE 24 11.538 8.816 -1.427 195 HD2 PHE 24 HD2 PHE 24 11.375 4.781 -2.900 196 HE1 PHE 24 HE1 PHE 24 12.425 9.581 -3.602 197 HE2 PHE 24 HE2 PHE 24 12.245 5.572 -5.108 198 HZ PHE 24 HZ PHE 24 12.770 7.959 -5.447 199 HA PRO 25 HA PRO 25 10.581 6.650 4.451 200 HB2 PRO 25 HB2 PRO 25 12.466 8.061 5.812 201 HB3 PRO 25 HB3 PRO 25 12.777 6.395 5.257 202 HG2 PRO 25 HG2 PRO 25 13.532 8.976 3.836 203 HG3 PRO 25 HG3 PRO 25 14.604 7.613 4.293 204 HD2 PRO 25 HD2 PRO 25 13.510 7.758 1.815 205 HD3 PRO 25 HD3 PRO 25 13.689 6.197 2.656 206 H ASN 26 H ASN 26 10.023 8.786 2.055 207 HA ASN 26 HA ASN 26 10.010 11.257 3.568 208 HB2 ASN 26 HB2 ASN 26 8.750 10.560 0.959 209 HB3 ASN 26 HB3 ASN 26 8.352 12.029 1.806 210 HD21 ASN 26 HD21 ASN 26 10.779 10.489 0.051 211 HD22 ASN 26 HD22 ASN 26 11.899 11.856 -0.126 212 H ALA 27 H ALA 27 7.778 8.539 3.074 213 HA ALA 27 HA ALA 27 5.904 9.295 5.126 214 HB1 ALA 27 HB1 ALA 27 5.288 9.563 2.110 215 HB2 ALA 27 HB2 ALA 27 4.013 9.426 3.361 216 HB3 ALA 27 HB3 ALA 27 5.103 10.825 3.346 217 H PHE 28 H PHE 28 5.614 7.138 5.845 218 HA PHE 28 HA PHE 28 4.233 5.232 4.324 219 HB2 PHE 28 HB2 PHE 28 7.193 5.055 4.156 220 HB3 PHE 28 HB3 PHE 28 6.436 3.596 4.719 221 HD1 PHE 28 HD1 PHE 28 3.937 3.305 3.214 222 HD2 PHE 28 HD2 PHE 28 7.773 4.774 1.871 223 HE1 PHE 28 HE1 PHE 28 3.320 2.802 0.879 224 HE2 PHE 28 HE2 PHE 28 7.151 4.245 -0.455 225 HZ PHE 28 HZ PHE 28 4.894 3.289 -0.967 226 H PHE 29 H PHE 29 4.003 3.078 5.666 227 HA PHE 29 HA PHE 29 4.749 3.340 8.488 228 HB2 PHE 29 HB2 PHE 29 1.879 3.284 7.478 229 HB3 PHE 29 HB3 PHE 29 2.339 2.946 9.140 230 HD1 PHE 29 HD1 PHE 29 1.581 5.567 6.748 231 HD2 PHE 29 HD2 PHE 29 3.638 4.778 10.454 232 HE1 PHE 29 HE1 PHE 29 1.714 8.003 7.211 233 HE2 PHE 29 HE2 PHE 29 3.749 7.203 10.906 234 HZ PHE 29 HZ PHE 29 2.813 8.820 9.279 235 H LYS 30 H LYS 30 4.587 1.304 9.575 236 HA LYS 30 HA LYS 30 4.590 -1.044 7.756 237 HB2 LYS 30 HB2 LYS 30 5.557 -0.739 10.627 238 HB3 LYS 30 HB3 LYS 30 5.561 -2.227 9.705 239 HG2 LYS 30 HG2 LYS 30 7.732 -1.445 9.619 240 HG3 LYS 30 HG3 LYS 30 7.072 -1.177 8.004 241 HD2 LYS 30 HD2 LYS 30 7.010 1.165 8.286 242 HD3 LYS 30 HD3 LYS 30 6.965 1.077 10.032 243 HE2 LYS 30 HE2 LYS 30 9.381 0.251 8.386 244 HE3 LYS 30 HE3 LYS 30 9.155 1.868 9.062 245 HZ1 LYS 30 HZ1 LYS 30 10.496 0.576 10.510 246 HZ2 LYS 30 HZ2 LYS 30 9.042 0.822 11.272 247 HZ3 LYS 30 HZ3 LYS 30 9.404 -0.634 10.623 248 H LYS 31 H LYS 31 2.680 0.286 10.434 249 HA LYS 31 HA LYS 31 1.150 -2.294 10.515 250 HB2 LYS 31 HB2 LYS 31 1.491 -0.219 12.719 251 HB3 LYS 31 HB3 LYS 31 0.315 -1.541 12.714 252 HG2 LYS 31 HG2 LYS 31 2.373 -3.099 12.323 253 HG3 LYS 31 HG3 LYS 31 3.335 -1.726 12.897 254 HD2 LYS 31 HD2 LYS 31 1.962 -1.699 14.992 255 HD3 LYS 31 HD3 LYS 31 1.013 -3.063 14.368 256 HE2 LYS 31 HE2 LYS 31 3.153 -4.398 14.188 257 HE3 LYS 31 HE3 LYS 31 3.999 -3.070 14.991 258 HZ1 LYS 31 HZ1 LYS 31 1.805 -4.684 16.105 259 HZ2 LYS 31 HZ2 LYS 31 3.390 -4.752 16.558 260 HZ3 LYS 31 HZ3 LYS 31 2.513 -3.402 16.893 261 H GLY 32 H GLY 32 -0.945 -2.268 10.104 262 HA2 GLY 32 HA2 GLY 32 -2.154 -0.334 8.537 263 HA3 GLY 32 HA3 GLY 32 -2.972 -1.590 9.451 264 H ASN 33 H ASN 33 -2.177 -0.684 12.116 265 HA ASN 33 HA ASN 33 -4.284 0.995 12.704 266 HB2 ASN 33 HB2 ASN 33 -3.271 1.217 14.937 267 HB3 ASN 33 HB3 ASN 33 -3.319 -0.439 14.341 268 HD21 ASN 33 HD21 ASN 33 -0.951 2.288 14.119 269 HD22 ASN 33 HD22 ASN 33 0.412 1.321 14.654 270 H GLN 34 H GLN 34 -1.073 2.032 11.721 271 HA GLN 34 HA GLN 34 -1.852 4.876 12.188 272 HB2 GLN 34 HB2 GLN 34 0.517 5.369 12.418 273 HB3 GLN 34 HB3 GLN 34 -0.033 4.222 13.643 274 HG2 GLN 34 HG2 GLN 34 0.940 2.367 12.163 275 HG3 GLN 34 HG3 GLN 34 1.645 3.640 11.177 276 HE21 GLN 34 HE21 GLN 34 2.306 5.400 13.563 277 HE22 GLN 34 HE22 GLN 34 3.606 4.594 14.394 278 H VAL 35 H VAL 35 -1.911 2.759 9.803 279 HA VAL 35 HA VAL 35 -0.254 3.791 7.789 280 HB VAL 35 HB VAL 35 -1.502 1.592 8.094 281 HG11 VAL 35 HG11 VAL 35 -3.660 2.829 6.369 282 HG12 VAL 35 HG12 VAL 35 -3.633 1.250 7.224 283 HG13 VAL 35 HG13 VAL 35 -3.814 2.754 8.118 284 HG21 VAL 35 HG21 VAL 35 -1.338 2.768 5.340 285 HG22 VAL 35 HG22 VAL 35 -0.028 1.969 6.253 286 HG23 VAL 35 HG23 VAL 35 -1.446 1.039 5.745 287 H LYS 36 H LYS 36 -0.688 4.982 5.891 288 HA LYS 36 HA LYS 36 -2.822 7.066 6.053 289 HB2 LYS 36 HB2 LYS 36 -0.630 7.929 6.749 290 HB3 LYS 36 HB3 LYS 36 0.126 7.219 5.319 291 HG2 LYS 36 HG2 LYS 36 -1.327 8.775 3.916 292 HG3 LYS 36 HG3 LYS 36 -1.777 9.586 5.419 293 HD2 LYS 36 HD2 LYS 36 1.109 9.189 4.513 294 HD3 LYS 36 HD3 LYS 36 0.125 10.523 3.927 295 HE2 LYS 36 HE2 LYS 36 0.522 10.047 6.898 296 HE3 LYS 36 HE3 LYS 36 1.667 10.987 5.918 297 HZ1 LYS 36 HZ1 LYS 36 0.155 12.503 6.828 298 HZ2 LYS 36 HZ2 LYS 36 -0.202 12.391 5.256 299 HZ3 LYS 36 HZ3 LYS 36 -1.181 11.659 6.353 300 HA PRO 37 HA PRO 37 -3.409 5.610 1.806 301 HB2 PRO 37 HB2 PRO 37 -4.903 7.571 0.690 302 HB3 PRO 37 HB3 PRO 37 -5.548 6.503 1.969 303 HG2 PRO 37 HG2 PRO 37 -4.448 9.313 2.309 304 HG3 PRO 37 HG3 PRO 37 -5.955 8.608 2.966 305 HD2 PRO 37 HD2 PRO 37 -3.615 8.782 4.398 306 HD3 PRO 37 HD3 PRO 37 -4.796 7.466 4.628 307 H LEU 38 H LEU 38 -1.879 5.678 0.171 308 HA LEU 38 HA LEU 38 -0.118 8.071 -0.057 309 HB2 LEU 38 HB2 LEU 38 0.122 5.176 -0.994 310 HB3 LEU 38 HB3 LEU 38 1.140 6.454 -1.592 311 HG LEU 38 HG LEU 38 2.447 5.392 -0.016 312 HD11 LEU 38 HD11 LEU 38 2.946 7.015 1.698 313 HD12 LEU 38 HD12 LEU 38 2.502 7.879 0.228 314 HD13 LEU 38 HD13 LEU 38 1.338 7.758 1.568 315 HD21 LEU 38 HD21 LEU 38 0.264 5.564 2.014 316 HD22 LEU 38 HD22 LEU 38 0.699 4.102 1.094 317 HD23 LEU 38 HD23 LEU 38 1.868 4.824 2.221 318 H LYS 39 H LYS 39 0.611 8.620 -2.277 319 HA LYS 39 HA LYS 39 -1.383 9.633 -3.917 320 HB2 LYS 39 HB2 LYS 39 1.097 10.134 -3.822 321 HB3 LYS 39 HB3 LYS 39 1.410 8.723 -4.809 322 HG2 LYS 39 HG2 LYS 39 -0.421 10.968 -5.712 323 HG3 LYS 39 HG3 LYS 39 1.322 11.142 -5.820 324 HD2 LYS 39 HD2 LYS 39 -0.343 9.145 -7.300 325 HD3 LYS 39 HD3 LYS 39 0.349 10.583 -7.959 326 HE2 LYS 39 HE2 LYS 39 2.185 8.452 -6.784 327 HE3 LYS 39 HE3 LYS 39 1.471 8.268 -8.383 328 HZ1 LYS 39 HZ1 LYS 39 3.458 9.215 -8.777 329 HZ2 LYS 39 HZ2 LYS 39 2.457 10.506 -8.899 330 HZ3 LYS 39 HZ3 LYS 39 3.447 10.282 -7.563 331 H ILE 40 H ILE 40 -2.459 8.896 -5.895 332 HA ILE 40 HA ILE 40 -3.125 6.182 -5.940 333 HB ILE 40 HB ILE 40 -4.543 7.895 -6.711 334 HG12 ILE 40 HG12 ILE 40 -4.598 5.522 -7.589 335 HG13 ILE 40 HG13 ILE 40 -5.601 6.743 -8.353 336 HG21 ILE 40 HG21 ILE 40 -4.222 9.056 -8.905 337 HG22 ILE 40 HG22 ILE 40 -3.033 9.534 -7.697 338 HG23 ILE 40 HG23 ILE 40 -2.567 8.394 -8.966 339 HD11 ILE 40 HD11 ILE 40 -4.317 5.121 -9.887 340 HD12 ILE 40 HD12 ILE 40 -4.229 6.854 -10.280 341 HD13 ILE 40 HD13 ILE 40 -2.874 6.049 -9.485 342 H GLY 41 H GLY 41 -2.349 4.461 -6.903 343 HA2 GLY 41 HA2 GLY 41 -0.807 3.079 -7.902 344 HA3 GLY 41 HA3 GLY 41 -0.814 4.276 -9.194 345 H ILE 42 H ILE 42 0.413 5.030 -5.926 346 HA ILE 42 HA ILE 42 2.808 6.187 -6.526 347 HB ILE 42 HB ILE 42 1.688 6.317 -4.434 348 HG12 ILE 42 HG12 ILE 42 4.397 5.120 -3.902 349 HG13 ILE 42 HG13 ILE 42 4.145 6.659 -4.706 350 HG21 ILE 42 HG21 ILE 42 2.421 3.398 -3.923 351 HG22 ILE 42 HG22 ILE 42 1.774 4.499 -2.714 352 HG23 ILE 42 HG23 ILE 42 0.779 4.060 -4.098 353 HD11 ILE 42 HD11 ILE 42 2.836 7.429 -2.683 354 HD12 ILE 42 HD12 ILE 42 3.384 5.919 -1.886 355 HD13 ILE 42 HD13 ILE 42 4.549 7.108 -2.399 356 H PHE 43 H PHE 43 2.099 2.716 -6.571 357 HA PHE 43 HA PHE 43 4.778 1.691 -6.181 358 HB2 PHE 43 HB2 PHE 43 3.721 -0.216 -6.192 359 HB3 PHE 43 HB3 PHE 43 2.223 0.589 -6.586 360 HD1 PHE 43 HD1 PHE 43 1.649 0.960 -9.055 361 HD2 PHE 43 HD2 PHE 43 4.856 -1.620 -7.798 362 HE1 PHE 43 HE1 PHE 43 1.651 -0.144 -11.307 363 HE2 PHE 43 HE2 PHE 43 4.739 -2.810 -9.993 364 HZ PHE 43 HZ PHE 43 3.139 -2.058 -11.736 365 H ASP 44 H ASP 44 3.009 3.000 -9.004 366 HA ASP 44 HA ASP 44 4.778 2.053 -11.026 367 HB2 ASP 44 HB2 ASP 44 2.376 2.982 -11.169 368 HB3 ASP 44 HB3 ASP 44 3.092 4.591 -11.045 369 H ASP 45 H ASP 45 4.842 4.815 -8.851 370 HA ASP 45 HA ASP 45 6.988 6.267 -10.209 371 HB2 ASP 45 HB2 ASP 45 5.531 6.522 -7.528 372 HB3 ASP 45 HB3 ASP 45 6.895 7.549 -7.995 373 H LEU 46 H LEU 46 6.588 4.133 -7.468 374 HA LEU 46 HA LEU 46 9.258 4.247 -6.394 375 HB2 LEU 46 HB2 LEU 46 7.174 3.941 -5.129 376 HB3 LEU 46 HB3 LEU 46 6.857 2.433 -5.950 377 HG LEU 46 HG LEU 46 7.701 2.425 -3.545 378 HD11 LEU 46 HD11 LEU 46 7.436 0.366 -4.474 379 HD12 LEU 46 HD12 LEU 46 8.683 0.574 -5.707 380 HD13 LEU 46 HD13 LEU 46 9.159 0.338 -4.039 381 HD21 LEU 46 HD21 LEU 46 9.998 2.495 -3.040 382 HD22 LEU 46 HD22 LEU 46 10.465 2.704 -4.733 383 HD23 LEU 46 HD23 LEU 46 9.572 3.988 -3.897 384 H ILE 47 H ILE 47 7.600 2.075 -8.657 385 HA ILE 47 HA ILE 47 9.264 -0.179 -8.395 386 HB ILE 47 HB ILE 47 7.071 0.141 -9.689 387 HG12 ILE 47 HG12 ILE 47 8.581 -1.904 -9.559 388 HG13 ILE 47 HG13 ILE 47 7.205 -1.821 -10.669 389 HG21 ILE 47 HG21 ILE 47 8.901 0.846 -12.024 390 HG22 ILE 47 HG22 ILE 47 7.136 0.582 -12.057 391 HG23 ILE 47 HG23 ILE 47 7.848 1.958 -11.185 392 HD11 ILE 47 HD11 ILE 47 10.031 -1.240 -11.570 393 HD12 ILE 47 HD12 ILE 47 9.278 -2.848 -11.610 394 HD13 ILE 47 HD13 ILE 47 8.582 -1.503 -12.548 395 H ASP 48 H ASP 48 9.711 2.942 -10.037 396 HA ASP 48 HA ASP 48 11.785 2.448 -11.797 397 HB2 ASP 48 HB2 ASP 48 11.148 4.867 -10.053 398 HB3 ASP 48 HB3 ASP 48 12.439 4.881 -11.241 399 H PHE 49 H PHE 49 11.843 2.903 -8.280 400 HA PHE 49 HA PHE 49 14.685 3.118 -8.066 401 HB2 PHE 49 HB2 PHE 49 12.806 3.813 -6.417 402 HB3 PHE 49 HB3 PHE 49 12.854 2.160 -5.847 403 HD1 PHE 49 HD1 PHE 49 13.151 3.750 -3.779 404 HD2 PHE 49 HD2 PHE 49 16.272 3.078 -6.683 405 HE1 PHE 49 HE1 PHE 49 14.830 4.729 -2.235 406 HE2 PHE 49 HE2 PHE 49 17.907 4.034 -5.150 407 HZ PHE 49 HZ PHE 49 17.191 4.870 -2.906 408 H TYR 50 H TYR 50 12.457 0.391 -8.291 409 HA TYR 50 HA TYR 50 14.245 -1.594 -7.182 410 HB2 TYR 50 HB2 TYR 50 12.250 -2.520 -7.051 411 HB3 TYR 50 HB3 TYR 50 11.548 -1.556 -8.308 412 HD1 TYR 50 HD1 TYR 50 12.917 -4.810 -7.470 413 HD2 TYR 50 HD2 TYR 50 11.866 -2.222 -10.744 414 HE1 TYR 50 HE1 TYR 50 12.674 -6.776 -8.937 415 HE2 TYR 50 HE2 TYR 50 11.704 -4.173 -12.249 416 HH TYR 50 HH TYR 50 12.253 -7.540 -11.042 417 H GLU 51 H GLU 51 13.747 -0.100 -10.381 418 HA GLU 51 HA GLU 51 15.381 -2.019 -11.803 419 HB2 GLU 51 HB2 GLU 51 14.410 0.777 -12.571 420 HB3 GLU 51 HB3 GLU 51 15.192 -0.394 -13.653 421 HG2 GLU 51 HG2 GLU 51 13.286 -2.034 -12.878 422 HG3 GLU 51 HG3 GLU 51 12.493 -0.580 -12.284 423 H ARG 52 H ARG 52 16.227 0.397 -9.620 424 HA ARG 52 HA ARG 52 18.830 1.078 -10.897 425 HB2 ARG 52 HB2 ARG 52 17.560 1.864 -8.233 426 HB3 ARG 52 HB3 ARG 52 19.092 2.478 -8.820 427 HG2 ARG 52 HG2 ARG 52 16.623 2.781 -10.548 428 HG3 ARG 52 HG3 ARG 52 16.816 3.839 -9.167 429 HD2 ARG 52 HD2 ARG 52 19.119 3.530 -11.096 430 HD3 ARG 52 HD3 ARG 52 17.721 4.500 -11.570 431 HE ARG 52 HE ARG 52 19.422 4.991 -9.153 432 HH11 ARG 52 HH11 ARG 52 17.192 6.346 -11.592 433 HH12 ARG 52 HH12 ARG 52 17.379 7.966 -10.964 434 HH21 ARG 52 HH21 ARG 52 19.589 6.998 -8.387 435 HH22 ARG 52 HH22 ARG 52 18.820 8.373 -9.117 436 H LEU 53 H LEU 53 17.452 -1.258 -8.766 437 HA LEU 53 HA LEU 53 19.674 -1.748 -7.089 438 HB2 LEU 53 HB2 LEU 53 17.417 -3.627 -7.853 439 HB3 LEU 53 HB3 LEU 53 18.449 -3.736 -6.426 440 HG LEU 53 HG LEU 53 16.439 -1.554 -7.071 441 HD11 LEU 53 HD11 LEU 53 15.389 -3.596 -6.355 442 HD12 LEU 53 HD12 LEU 53 16.429 -3.675 -4.922 443 HD13 LEU 53 HD13 LEU 53 15.229 -2.378 -5.108 444 HD21 LEU 53 HD21 LEU 53 18.364 -0.527 -5.954 445 HD22 LEU 53 HD22 LEU 53 16.932 -0.478 -4.992 446 HD23 LEU 53 HD23 LEU 53 18.219 -1.685 -4.623 447 H ASP 54 H ASP 54 21.351 -2.996 -7.254 448 HA ASP 54 HA ASP 54 22.302 -3.889 -9.819 449 HB2 ASP 54 HB2 ASP 54 23.738 -3.069 -7.949 450 HB3 ASP 54 HB3 ASP 54 23.257 -4.456 -6.972 451 H THR 55 H THR 55 20.512 -5.414 -7.193 452 HA THR 55 HA THR 55 20.107 -7.773 -8.766 453 HB THR 55 HB THR 55 22.062 -8.627 -8.160 454 HG1 THR 55 HG1 THR 55 20.215 -9.543 -6.241 455 HG21 THR 55 HG21 THR 55 22.755 -7.075 -6.612 456 HG22 THR 55 HG22 THR 55 21.462 -7.476 -5.467 457 HG23 THR 55 HG23 THR 55 22.816 -8.632 -5.760 458 HA PRO 56 HA PRO 56 16.615 -6.466 -6.032 459 HB2 PRO 56 HB2 PRO 56 14.672 -6.857 -7.948 460 HB3 PRO 56 HB3 PRO 56 15.506 -5.299 -7.673 461 HG2 PRO 56 HG2 PRO 56 15.999 -7.380 -9.778 462 HG3 PRO 56 HG3 PRO 56 16.040 -5.596 -9.937 463 HD2 PRO 56 HD2 PRO 56 18.300 -7.114 -9.687 464 HD3 PRO 56 HD3 PRO 56 18.183 -5.482 -8.982 465 HA PRO 57 HA PRO 57 16.312 -10.989 -5.798 466 HB2 PRO 57 HB2 PRO 57 15.455 -11.317 -3.220 467 HB3 PRO 57 HB3 PRO 57 17.116 -10.836 -3.659 468 HG2 PRO 57 HG2 PRO 57 14.845 -9.040 -2.789 469 HG3 PRO 57 HG3 PRO 57 16.535 -9.043 -2.211 470 HD2 PRO 57 HD2 PRO 57 15.608 -7.330 -4.161 471 HD3 PRO 57 HD3 PRO 57 17.286 -7.932 -4.117 472 H PHE 58 H PHE 58 13.606 -8.799 -5.336 473 HA PHE 58 HA PHE 58 11.641 -11.022 -5.459 474 HB2 PHE 58 HB2 PHE 58 10.024 -9.239 -4.774 475 HB3 PHE 58 HB3 PHE 58 11.291 -9.543 -3.602 476 HD1 PHE 58 HD1 PHE 58 12.995 -7.825 -3.085 477 HD2 PHE 58 HD2 PHE 58 10.035 -7.142 -6.147 478 HE1 PHE 58 HE1 PHE 58 13.664 -5.447 -3.200 479 HE2 PHE 58 HE2 PHE 58 10.709 -4.780 -6.255 480 HZ PHE 58 HZ PHE 58 12.527 -3.919 -4.798 481 H SER 59 H SER 59 9.681 -10.669 -6.791 482 HA SER 59 HA SER 59 10.393 -9.672 -9.472 483 HB2 SER 59 HB2 SER 59 8.557 -10.964 -10.259 484 HB3 SER 59 HB3 SER 59 9.406 -11.971 -9.069 485 HG SER 59 HG SER 59 7.490 -12.128 -8.231 486 H LYS 60 H LYS 60 8.710 -8.457 -10.711 487 HA LYS 60 HA LYS 60 7.905 -6.070 -9.330 488 HB2 LYS 60 HB2 LYS 60 6.879 -7.193 -11.984 489 HB3 LYS 60 HB3 LYS 60 6.583 -5.559 -11.360 490 HG2 LYS 60 HG2 LYS 60 9.010 -5.095 -11.391 491 HG3 LYS 60 HG3 LYS 60 9.336 -6.722 -11.989 492 HD2 LYS 60 HD2 LYS 60 9.430 -5.117 -13.794 493 HD3 LYS 60 HD3 LYS 60 8.121 -6.268 -14.060 494 HE2 LYS 60 HE2 LYS 60 6.427 -4.694 -13.638 495 HE3 LYS 60 HE3 LYS 60 7.481 -3.693 -12.635 496 HZ1 LYS 60 HZ1 LYS 60 8.629 -2.971 -14.588 497 HZ2 LYS 60 HZ2 LYS 60 7.636 -3.829 -15.587 498 HZ3 LYS 60 HZ3 LYS 60 7.018 -2.614 -14.672 499 H LYS 61 H LYS 61 5.882 -8.838 -10.519 500 HA LYS 61 HA LYS 61 3.500 -7.819 -9.361 501 HB2 LYS 61 HB2 LYS 61 4.324 -10.609 -10.202 502 HB3 LYS 61 HB3 LYS 61 2.843 -10.349 -9.269 503 HG2 LYS 61 HG2 LYS 61 2.026 -8.701 -10.897 504 HG3 LYS 61 HG3 LYS 61 3.459 -8.984 -11.906 505 HD2 LYS 61 HD2 LYS 61 2.786 -11.316 -12.260 506 HD3 LYS 61 HD3 LYS 61 1.494 -11.170 -11.070 507 HE2 LYS 61 HE2 LYS 61 0.611 -11.095 -13.348 508 HE3 LYS 61 HE3 LYS 61 0.289 -9.589 -12.478 509 HZ1 LYS 61 HZ1 LYS 61 2.082 -8.546 -13.650 510 HZ2 LYS 61 HZ2 LYS 61 2.470 -9.978 -14.410 511 HZ3 LYS 61 HZ3 LYS 61 1.066 -9.239 -14.752 512 H SER 62 H SER 62 6.128 -9.760 -7.822 513 HA SER 62 HA SER 62 4.677 -10.303 -5.462 514 HB2 SER 62 HB2 SER 62 6.731 -11.428 -6.109 515 HB3 SER 62 HB3 SER 62 7.649 -9.918 -6.022 516 HG SER 62 HG SER 62 6.364 -11.159 -3.819 517 H LEU 63 H LEU 63 6.888 -7.522 -6.226 518 HA LEU 63 HA LEU 63 6.579 -6.136 -3.803 519 HB2 LEU 63 HB2 LEU 63 8.247 -5.562 -5.498 520 HB3 LEU 63 HB3 LEU 63 7.000 -5.020 -6.602 521 HG LEU 63 HG LEU 63 6.698 -3.639 -4.047 522 HD11 LEU 63 HD11 LEU 63 9.139 -4.051 -3.792 523 HD12 LEU 63 HD12 LEU 63 9.401 -3.193 -5.344 524 HD13 LEU 63 HD13 LEU 63 8.719 -2.338 -3.960 525 HD21 LEU 63 HD21 LEU 63 6.761 -1.641 -5.310 526 HD22 LEU 63 HD22 LEU 63 7.637 -2.357 -6.665 527 HD23 LEU 63 HD23 LEU 63 5.941 -2.837 -6.336 528 H ARG 64 H ARG 64 4.671 -5.672 -6.834 529 HA ARG 64 HA ARG 64 2.918 -3.853 -5.539 530 HB2 ARG 64 HB2 ARG 64 3.285 -3.989 -8.001 531 HB3 ARG 64 HB3 ARG 64 2.375 -5.496 -8.061 532 HG2 ARG 64 HG2 ARG 64 1.119 -3.419 -8.742 533 HG3 ARG 64 HG3 ARG 64 0.311 -4.377 -7.499 534 HD2 ARG 64 HD2 ARG 64 0.844 -2.850 -5.771 535 HD3 ARG 64 HD3 ARG 64 2.114 -2.076 -6.718 536 HE ARG 64 HE ARG 64 -0.201 -1.599 -8.137 537 HH11 ARG 64 HH11 ARG 64 0.663 -1.101 -4.753 538 HH12 ARG 64 HH12 ARG 64 -0.269 0.345 -4.567 539 HH21 ARG 64 HH21 ARG 64 -1.249 0.416 -7.971 540 HH22 ARG 64 HH22 ARG 64 -1.361 1.263 -6.428 541 H GLU 65 H GLU 65 2.544 -7.396 -5.989 542 HA GLU 65 HA GLU 65 -0.175 -7.533 -5.236 543 HB2 GLU 65 HB2 GLU 65 1.125 -9.439 -6.225 544 HB3 GLU 65 HB3 GLU 65 2.083 -9.557 -4.751 545 HG2 GLU 65 HG2 GLU 65 0.117 -10.235 -3.478 546 HG3 GLU 65 HG3 GLU 65 -0.944 -9.889 -4.856 547 H ALA 66 H ALA 66 2.834 -7.609 -3.341 548 HA ALA 66 HA ALA 66 1.566 -8.075 -0.845 549 HB1 ALA 66 HB1 ALA 66 3.956 -8.503 -1.360 550 HB2 ALA 66 HB2 ALA 66 4.216 -6.750 -1.466 551 HB3 ALA 66 HB3 ALA 66 3.718 -7.503 0.072 552 H LEU 67 H LEU 67 2.753 -5.036 -2.382 553 HA LEU 67 HA LEU 67 1.961 -3.224 -0.410 554 HB2 LEU 67 HB2 LEU 67 3.226 -3.038 -2.789 555 HB3 LEU 67 HB3 LEU 67 1.666 -2.410 -3.290 556 HG LEU 67 HG LEU 67 3.490 -1.354 -1.084 557 HD11 LEU 67 HD11 LEU 67 4.225 -0.973 -3.449 558 HD12 LEU 67 HD12 LEU 67 2.698 -0.118 -3.766 559 HD13 LEU 67 HD13 LEU 67 3.860 0.522 -2.593 560 HD21 LEU 67 HD21 LEU 67 0.813 -0.230 -2.008 561 HD22 LEU 67 HD22 LEU 67 1.243 -0.800 -0.380 562 HD23 LEU 67 HD23 LEU 67 2.012 0.645 -1.010 563 H SER 68 H SER 68 -0.001 -4.534 -3.113 564 HA SER 68 HA SER 68 -2.285 -2.966 -2.882 565 HB2 SER 68 HB2 SER 68 -1.705 -4.733 -4.628 566 HB3 SER 68 HB3 SER 68 -2.244 -5.959 -3.468 567 HG SER 68 HG SER 68 -4.084 -5.584 -4.510 568 H TYR 69 H TYR 69 -1.216 -5.591 -0.777 569 HA TYR 69 HA TYR 69 -3.737 -6.015 0.570 570 HB2 TYR 69 HB2 TYR 69 -1.217 -7.245 0.409 571 HB3 TYR 69 HB3 TYR 69 -1.335 -6.735 2.084 572 HD1 TYR 69 HD1 TYR 69 -2.332 -8.302 3.564 573 HD2 TYR 69 HD2 TYR 69 -3.319 -8.385 -0.630 574 HE1 TYR 69 HE1 TYR 69 -3.608 -10.387 3.923 575 HE2 TYR 69 HE2 TYR 69 -4.618 -10.486 -0.267 576 HH TYR 69 HH TYR 69 -5.652 -11.774 1.517 577 H TYR 70 H TYR 70 -0.788 -4.011 1.289 578 HA TYR 70 HA TYR 70 -1.612 -3.313 3.948 579 HB2 TYR 70 HB2 TYR 70 0.336 -2.181 1.953 580 HB3 TYR 70 HB3 TYR 70 -0.241 -1.108 3.215 581 HD1 TYR 70 HD1 TYR 70 0.313 -4.797 3.664 582 HD2 TYR 70 HD2 TYR 70 1.783 -0.804 4.433 583 HE1 TYR 70 HE1 TYR 70 1.943 -5.706 5.241 584 HE2 TYR 70 HE2 TYR 70 3.427 -1.715 6.009 585 HH TYR 70 HH TYR 70 4.364 -3.712 6.942 586 H SER 71 H SER 71 -2.175 -1.777 0.814 587 HA SER 71 HA SER 71 -3.905 0.239 1.999 588 HB2 SER 71 HB2 SER 71 -4.458 0.774 -0.349 589 HB3 SER 71 HB3 SER 71 -2.773 0.909 0.161 590 HG SER 71 HG SER 71 -3.943 -1.134 -1.443 591 H ALA 72 H ALA 72 -4.544 -2.954 1.735 592 HA ALA 72 HA ALA 72 -7.473 -2.573 1.482 593 HB1 ALA 72 HB1 ALA 72 -7.601 -4.853 0.591 594 HB2 ALA 72 HB2 ALA 72 -6.600 -3.847 -0.463 595 HB3 ALA 72 HB3 ALA 72 -5.834 -5.005 0.654 596 H SER 73 H SER 73 -5.210 -2.574 3.646 597 HA SER 73 HA SER 73 -5.819 -4.931 5.271 598 HB2 SER 73 HB2 SER 73 -4.490 -3.851 7.043 599 HB3 SER 73 HB3 SER 73 -3.654 -3.849 5.490 600 HG SER 73 HG SER 73 -3.970 -1.741 5.274 601 HA PRO 74 HA PRO 74 -9.548 -3.707 7.178 602 HB2 PRO 74 HB2 PRO 74 -9.290 -4.289 9.888 603 HB3 PRO 74 HB3 PRO 74 -9.592 -5.514 8.618 604 HG2 PRO 74 HG2 PRO 74 -6.976 -4.667 9.850 605 HG3 PRO 74 HG3 PRO 74 -7.581 -6.332 9.564 606 HD2 PRO 74 HD2 PRO 74 -5.829 -5.211 7.845 607 HD3 PRO 74 HD3 PRO 74 -7.202 -6.146 7.206 608 H ALA 75 H ALA 75 -6.726 -2.723 9.231 609 HA ALA 75 HA ALA 75 -8.012 -0.511 10.391 610 HB1 ALA 75 HB1 ALA 75 -6.063 -1.577 11.340 611 HB2 ALA 75 HB2 ALA 75 -5.088 -1.118 9.922 612 HB3 ALA 75 HB3 ALA 75 -5.718 0.134 11.022 613 H TYR 76 H TYR 76 -6.186 -0.749 7.286 614 HA TYR 76 HA TYR 76 -5.965 2.080 6.849 615 HB2 TYR 76 HB2 TYR 76 -4.678 0.420 5.504 616 HB3 TYR 76 HB3 TYR 76 -6.163 -0.285 4.905 617 HD1 TYR 76 HD1 TYR 76 -3.573 2.107 4.242 618 HD2 TYR 76 HD2 TYR 76 -7.679 1.150 3.374 619 HE1 TYR 76 HE1 TYR 76 -3.510 3.546 2.205 620 HE2 TYR 76 HE2 TYR 76 -7.648 2.627 1.438 621 HH TYR 76 HH TYR 76 -6.428 4.302 0.335 622 H LEU 77 H LEU 77 -8.353 -0.310 5.738 623 HA LEU 77 HA LEU 77 -10.021 1.609 4.457 624 HB2 LEU 77 HB2 LEU 77 -10.775 -1.106 5.612 625 HB3 LEU 77 HB3 LEU 77 -11.701 -0.206 4.422 626 HG LEU 77 HG LEU 77 -8.798 -1.018 3.859 627 HD11 LEU 77 HD11 LEU 77 -9.991 -2.988 4.563 628 HD12 LEU 77 HD12 LEU 77 -11.271 -2.642 3.394 629 HD13 LEU 77 HD13 LEU 77 -9.641 -3.046 2.814 630 HD21 LEU 77 HD21 LEU 77 -11.119 -0.325 2.045 631 HD22 LEU 77 HD22 LEU 77 -9.693 0.665 2.357 632 HD23 LEU 77 HD23 LEU 77 -9.514 -0.890 1.524 633 H SER 78 H SER 78 -10.130 0.144 7.682 634 HA SER 78 HA SER 78 -12.406 1.552 8.609 635 HB2 SER 78 HB2 SER 78 -11.157 -0.495 9.581 636 HB3 SER 78 HB3 SER 78 -10.093 0.689 10.372 637 HG SER 78 HG SER 78 -12.319 1.596 11.061 638 H CYS 79 H CYS 79 -9.237 2.801 7.925 639 HA CYS 79 HA CYS 79 -9.446 5.062 9.770 640 HB2 CYS 79 HB2 CYS 79 -7.318 3.760 9.263 641 HB3 CYS 79 HB3 CYS 79 -7.314 4.560 7.677 642 HG CYS 79 HG CYS 79 -7.224 6.934 8.533 643 H GLN 80 H GLN 80 -11.027 4.381 7.019 644 HA GLN 80 HA GLN 80 -10.825 6.183 5.053 645 HB2 GLN 80 HB2 GLN 80 -13.324 6.066 4.881 646 HB3 GLN 80 HB3 GLN 80 -12.473 4.542 4.952 647 HG2 GLN 80 HG2 GLN 80 -13.135 4.366 7.400 648 HG3 GLN 80 HG3 GLN 80 -14.111 5.816 7.190 649 HE21 GLN 80 HE21 GLN 80 -16.255 5.428 6.679 650 HE22 GLN 80 HE22 GLN 80 -16.853 4.002 5.866 651 H LYS 81 H LYS 81 -10.016 8.194 5.510 652 HA LYS 81 HA LYS 81 -11.885 10.146 6.764 653 HB2 LYS 81 HB2 LYS 81 -8.934 9.750 7.263 654 HB3 LYS 81 HB3 LYS 81 -9.733 11.288 7.576 655 HG2 LYS 81 HG2 LYS 81 -11.106 10.421 9.294 656 HG3 LYS 81 HG3 LYS 81 -10.867 8.748 8.780 657 HD2 LYS 81 HD2 LYS 81 -8.440 8.944 9.371 658 HD3 LYS 81 HD3 LYS 81 -8.765 10.523 10.091 659 HE2 LYS 81 HE2 LYS 81 -10.260 7.976 10.884 660 HE3 LYS 81 HE3 LYS 81 -8.721 8.436 11.614 661 HZ1 LYS 81 HZ1 LYS 81 -10.389 9.235 13.003 662 HZ2 LYS 81 HZ2 LYS 81 -9.782 10.564 12.248 663 HZ3 LYS 81 HZ3 LYS 81 -11.245 9.956 11.818 664 HA PRO 82 HA PRO 82 -10.788 11.815 2.656 665 HB2 PRO 82 HB2 PRO 82 -12.803 13.667 2.431 666 HB3 PRO 82 HB3 PRO 82 -13.077 11.919 2.212 667 HG2 PRO 82 HG2 PRO 82 -13.583 13.602 4.672 668 HG3 PRO 82 HG3 PRO 82 -14.658 12.371 3.934 669 HD2 PRO 82 HD2 PRO 82 -13.014 11.859 6.080 670 HD3 PRO 82 HD3 PRO 82 -13.438 10.614 4.873 671 H ASP 83 H ASP 83 -10.475 14.218 1.962 672 HA ASP 83 HA ASP 83 -9.379 16.202 2.164 673 HB2 ASP 83 HB2 ASP 83 -10.146 16.482 5.038 674 HB3 ASP 83 HB3 ASP 83 -9.972 17.720 3.803 675 H THR 84 H THR 84 -8.221 13.629 3.632 676 HA THR 84 HA THR 84 -6.308 14.558 5.506 677 HB THR 84 HB THR 84 -7.481 12.373 5.388 678 HG1 THR 84 HG1 THR 84 -6.075 11.818 6.718 679 HG21 THR 84 HG21 THR 84 -7.143 11.869 2.977 680 HG22 THR 84 HG22 THR 84 -5.405 11.632 3.288 681 HG23 THR 84 HG23 THR 84 -6.603 10.564 4.044 682 H ALA 85 H ALA 85 -6.025 14.601 2.063 683 HA ALA 85 HA ALA 85 -4.338 15.216 0.643 684 HB1 ALA 85 HB1 ALA 85 -2.984 16.363 3.088 685 HB2 ALA 85 HB2 ALA 85 -2.600 16.700 1.395 686 HB3 ALA 85 HB3 ALA 85 -4.180 17.181 2.069 687 H ARG 86 H ARG 86 -3.730 13.312 -0.143 688 HA ARG 86 HA ARG 86 -1.938 11.527 1.329 689 HB2 ARG 86 HB2 ARG 86 -2.513 11.499 -1.649 690 HB3 ARG 86 HB3 ARG 86 -1.890 10.184 -0.706 691 HG2 ARG 86 HG2 ARG 86 -3.970 9.628 0.137 692 HG3 ARG 86 HG3 ARG 86 -4.646 11.243 -0.006 693 HD2 ARG 86 HD2 ARG 86 -3.993 9.445 -2.376 694 HD3 ARG 86 HD3 ARG 86 -5.579 9.583 -1.621 695 HE ARG 86 HE ARG 86 -4.296 12.088 -2.570 696 HH11 ARG 86 HH11 ARG 86 -6.748 9.636 -3.388 697 HH12 ARG 86 HH12 ARG 86 -7.696 10.789 -4.274 698 HH21 ARG 86 HH21 ARG 86 -5.285 13.281 -4.259 699 HH22 ARG 86 HH22 ARG 86 -6.815 12.745 -4.844 700 H VAL 87 H VAL 87 0.209 10.875 0.149 701 HA VAL 87 HA VAL 87 1.680 13.102 -1.098 702 HB VAL 87 HB VAL 87 3.615 12.400 0.471 703 HG11 VAL 87 HG11 VAL 87 2.885 14.005 2.264 704 HG12 VAL 87 HG12 VAL 87 2.800 14.600 0.615 705 HG13 VAL 87 HG13 VAL 87 1.308 14.108 1.458 706 HG21 VAL 87 HG21 VAL 87 2.541 10.444 1.533 707 HG22 VAL 87 HG22 VAL 87 3.007 11.674 2.725 708 HG23 VAL 87 HG23 VAL 87 1.314 11.511 2.261 709 H ASP 88 H ASP 88 3.609 12.339 -2.136 710 HA ASP 88 HA ASP 88 3.336 9.568 -3.148 711 HB2 ASP 88 HB2 ASP 88 3.159 11.387 -4.718 712 HB3 ASP 88 HB3 ASP 88 4.786 11.969 -4.298 713 H ILE 89 H ILE 89 5.778 8.731 -3.784 714 HA ILE 89 HA ILE 89 7.110 8.258 -1.320 715 HB ILE 89 HB ILE 89 8.885 7.210 -2.696 716 HG12 ILE 89 HG12 ILE 89 7.562 8.679 -4.999 717 HG13 ILE 89 HG13 ILE 89 9.238 8.748 -4.442 718 HG21 ILE 89 HG21 ILE 89 6.614 6.088 -2.338 719 HG22 ILE 89 HG22 ILE 89 6.321 6.480 -4.062 720 HG23 ILE 89 HG23 ILE 89 7.683 5.457 -3.602 721 HD11 ILE 89 HD11 ILE 89 9.116 7.579 -6.509 722 HD12 ILE 89 HD12 ILE 89 9.550 6.408 -5.244 723 HD13 ILE 89 HD13 ILE 89 7.890 6.464 -5.897 724 H TYR 90 H TYR 90 7.556 10.835 -3.585 725 HA TYR 90 HA TYR 90 10.150 11.698 -2.535 726 HB2 TYR 90 HB2 TYR 90 8.152 12.804 -4.524 727 HB3 TYR 90 HB3 TYR 90 9.672 13.614 -4.146 728 HD1 TYR 90 HD1 TYR 90 11.868 12.483 -4.644 729 HD2 TYR 90 HD2 TYR 90 8.110 10.825 -6.026 730 HE1 TYR 90 HE1 TYR 90 13.061 11.013 -6.224 731 HE2 TYR 90 HE2 TYR 90 9.291 9.477 -7.641 732 HH TYR 90 HH TYR 90 11.311 8.801 -8.459 733 H GLY 91 H GLY 91 7.078 11.796 -1.202 734 HA2 GLY 91 HA2 GLY 91 6.314 12.911 0.622 735 HA3 GLY 91 HA3 GLY 91 7.744 13.958 0.611 736 H ASN 92 H ASN 92 6.597 14.126 -2.517 737 HA ASN 92 HA ASN 92 5.637 16.776 -2.276 738 HB2 ASN 92 HB2 ASN 92 5.069 14.851 -4.540 739 HB3 ASN 92 HB3 ASN 92 5.103 16.613 -4.612 740 HD21 ASN 92 HD21 ASN 92 6.674 14.536 -6.210 741 HD22 ASN 92 HD22 ASN 92 8.338 14.958 -5.878 742 H GLU 93 H GLU 93 3.637 17.465 -1.700 743 HA GLU 93 HA GLU 93 1.582 15.663 -0.805 744 HB2 GLU 93 HB2 GLU 93 2.129 18.621 -0.963 745 HB3 GLU 93 HB3 GLU 93 0.462 18.101 -0.807 746 HG2 GLU 93 HG2 GLU 93 0.803 17.069 1.283 747 HG3 GLU 93 HG3 GLU 93 2.555 16.952 1.050 748 H VAL 94 H VAL 94 -0.401 15.372 -1.628 749 HA VAL 94 HA VAL 94 -0.969 16.297 -4.344 750 HB VAL 94 HB VAL 94 -1.804 14.223 -5.080 751 HG11 VAL 94 HG11 VAL 94 0.273 13.108 -5.464 752 HG12 VAL 94 HG12 VAL 94 0.581 14.840 -5.391 753 HG13 VAL 94 HG13 VAL 94 1.009 13.799 -3.999 754 HG21 VAL 94 HG21 VAL 94 -0.642 12.802 -2.681 755 HG22 VAL 94 HG22 VAL 94 -2.363 13.270 -2.806 756 HG23 VAL 94 HG23 VAL 94 -1.648 12.143 -3.981 757 H ASP 95 H ASP 95 -3.432 15.493 -4.715 758 HA ASP 95 HA ASP 95 -4.830 17.250 -2.894 759 HB2 ASP 95 HB2 ASP 95 -6.721 16.801 -4.467 760 HB3 ASP 95 HB3 ASP 95 -5.269 17.431 -5.232 761 H VAL 96 H VAL 96 -7.304 16.137 -2.536 762 HA VAL 96 HA VAL 96 -6.613 13.880 -0.711 763 HB VAL 96 HB VAL 96 -8.397 14.729 0.653 764 HG11 VAL 96 HG11 VAL 96 -7.020 16.198 1.577 765 HG12 VAL 96 HG12 VAL 96 -6.061 16.304 0.102 766 HG13 VAL 96 HG13 VAL 96 -7.392 17.413 0.356 767 HG21 VAL 96 HG21 VAL 96 -9.703 16.767 0.104 768 HG22 VAL 96 HG22 VAL 96 -8.924 16.862 -1.481 769 HG23 VAL 96 HG23 VAL 96 -9.997 15.510 -1.087 770 H VAL 97 H VAL 97 -8.388 12.597 0.032 771 HA VAL 97 HA VAL 97 -9.739 11.306 -2.239 772 HB VAL 97 HB VAL 97 -9.893 10.600 0.732 773 HG11 VAL 97 HG11 VAL 97 -11.585 9.551 -0.746 774 HG12 VAL 97 HG12 VAL 97 -10.296 8.927 -1.795 775 HG13 VAL 97 HG13 VAL 97 -10.444 8.346 -0.124 776 HG21 VAL 97 HG21 VAL 97 -8.135 8.918 0.363 777 HG22 VAL 97 HG22 VAL 97 -7.892 9.514 -1.286 778 HG23 VAL 97 HG23 VAL 97 -7.492 10.541 0.112 779 H THR 98 H THR 98 -11.867 11.766 -2.718 780 HA THR 98 HA THR 98 -13.229 13.940 -1.412 781 HB THR 98 HB THR 98 -15.158 12.976 -2.932 782 HG1 THR 98 HG1 THR 98 -12.886 11.827 -4.173 783 HG21 THR 98 HG21 THR 98 -12.589 14.151 -4.063 784 HG22 THR 98 HG22 THR 98 -14.160 14.107 -4.902 785 HG23 THR 98 HG23 THR 98 -13.963 15.039 -3.408 786 HA PRO 99 HA PRO 99 -15.268 11.777 1.812 787 HB2 PRO 99 HB2 PRO 99 -17.905 12.729 1.743 788 HB3 PRO 99 HB3 PRO 99 -16.503 13.511 2.530 789 HG2 PRO 99 HG2 PRO 99 -17.717 14.078 -0.156 790 HG3 PRO 99 HG3 PRO 99 -17.051 15.233 1.029 791 HD2 PRO 99 HD2 PRO 99 -15.643 14.467 -1.177 792 HD3 PRO 99 HD3 PRO 99 -14.844 14.788 0.387 793 H GLU 100 H GLU 100 -16.973 11.607 -1.347 794 HA GLU 100 HA GLU 100 -18.524 9.298 -0.653 795 HB2 GLU 100 HB2 GLU 100 -17.692 10.574 -3.261 796 HB3 GLU 100 HB3 GLU 100 -18.488 9.002 -3.266 797 HG2 GLU 100 HG2 GLU 100 -19.605 11.389 -1.780 798 HG3 GLU 100 HG3 GLU 100 -20.060 10.995 -3.454 799 H GLN 101 H GLN 101 -15.314 9.721 -2.193 800 HA GLN 101 HA GLN 101 -14.937 6.880 -2.624 801 HB2 GLN 101 HB2 GLN 101 -13.022 9.239 -2.832 802 HB3 GLN 101 HB3 GLN 101 -12.635 7.562 -3.263 803 HG2 GLN 101 HG2 GLN 101 -14.647 7.602 -4.824 804 HG3 GLN 101 HG3 GLN 101 -14.799 9.325 -4.527 805 HE21 GLN 101 HE21 GLN 101 -13.478 10.717 -5.748 806 HE22 GLN 101 HE22 GLN 101 -12.169 10.153 -6.776 807 H ALA 102 H ALA 102 -14.150 9.113 0.024 808 HA ALA 102 HA ALA 102 -12.188 7.372 1.218 809 HB1 ALA 102 HB1 ALA 102 -12.495 8.778 3.229 810 HB2 ALA 102 HB2 ALA 102 -12.305 9.762 1.768 811 HB3 ALA 102 HB3 ALA 102 -13.916 9.546 2.495 812 H LYS 103 H LYS 103 -15.643 7.920 1.991 813 HA LYS 103 HA LYS 103 -15.893 5.845 3.889 814 HB2 LYS 103 HB2 LYS 103 -18.271 6.102 3.706 815 HB3 LYS 103 HB3 LYS 103 -17.538 7.707 3.577 816 HG2 LYS 103 HG2 LYS 103 -17.754 7.577 1.114 817 HG3 LYS 103 HG3 LYS 103 -18.564 6.018 1.241 818 HD2 LYS 103 HD2 LYS 103 -19.617 8.648 2.353 819 HD3 LYS 103 HD3 LYS 103 -20.074 7.891 0.816 820 HE2 LYS 103 HE2 LYS 103 -20.723 5.816 2.169 821 HE3 LYS 103 HE3 LYS 103 -20.569 6.829 3.614 822 HZ1 LYS 103 HZ1 LYS 103 -22.411 7.254 1.336 823 HZ2 LYS 103 HZ2 LYS 103 -22.805 6.779 2.875 824 HZ3 LYS 103 HZ3 LYS 103 -22.254 8.305 2.589 825 H TYR 104 H TYR 104 -15.967 5.683 0.396 826 HA TYR 104 HA TYR 104 -17.233 3.310 -0.149 827 HB2 TYR 104 HB2 TYR 104 -15.879 5.134 -1.576 828 HB3 TYR 104 HB3 TYR 104 -14.589 3.959 -1.460 829 HD1 TYR 104 HD1 TYR 104 -17.847 4.821 -2.856 830 HD2 TYR 104 HD2 TYR 104 -14.844 1.718 -2.640 831 HE1 TYR 104 HE1 TYR 104 -18.830 3.754 -4.828 832 HE2 TYR 104 HE2 TYR 104 -15.813 0.655 -4.657 833 HH TYR 104 HH TYR 104 -18.727 2.028 -6.274 834 H ALA 105 H ALA 105 -14.088 3.812 1.365 835 HA ALA 105 HA ALA 105 -12.833 1.352 0.911 836 HB1 ALA 105 HB1 ALA 105 -12.824 3.194 3.324 837 HB2 ALA 105 HB2 ALA 105 -11.632 1.915 3.037 838 HB3 ALA 105 HB3 ALA 105 -11.752 3.286 1.912 839 H TYR 106 H TYR 106 -15.494 2.125 3.169 840 HA TYR 106 HA TYR 106 -15.299 -0.107 4.820 841 HB2 TYR 106 HB2 TYR 106 -17.257 0.569 5.711 842 HB3 TYR 106 HB3 TYR 106 -16.859 2.043 4.852 843 HD1 TYR 106 HD1 TYR 106 -17.773 1.864 2.177 844 HD2 TYR 106 HD2 TYR 106 -19.509 -0.047 5.640 845 HE1 TYR 106 HE1 TYR 106 -19.944 1.907 1.084 846 HE2 TYR 106 HE2 TYR 106 -21.689 -0.109 4.494 847 HH TYR 106 HH TYR 106 -22.139 1.257 1.179 848 H GLN 107 H GLN 107 -16.525 0.052 1.521 849 HA GLN 107 HA GLN 107 -18.019 -2.382 1.508 850 HB2 GLN 107 HB2 GLN 107 -16.500 -1.005 -0.737 851 HB3 GLN 107 HB3 GLN 107 -17.717 -2.289 -0.919 852 HG2 GLN 107 HG2 GLN 107 -19.362 -0.754 0.265 853 HG3 GLN 107 HG3 GLN 107 -18.154 0.527 0.108 854 HE21 GLN 107 HE21 GLN 107 -17.576 -0.910 -2.808 855 HE22 GLN 107 HE22 GLN 107 -18.829 -0.075 -3.700 856 H ARG 108 H ARG 108 -14.613 -1.580 0.876 857 HA ARG 108 HA ARG 108 -13.814 -4.273 0.200 858 HB2 ARG 108 HB2 ARG 108 -11.856 -2.248 1.223 859 HB3 ARG 108 HB3 ARG 108 -11.654 -3.455 -0.023 860 HG2 ARG 108 HG2 ARG 108 -13.153 -0.810 -0.216 861 HG3 ARG 108 HG3 ARG 108 -11.608 -1.200 -0.940 862 HD2 ARG 108 HD2 ARG 108 -14.152 -2.674 -1.692 863 HD3 ARG 108 HD3 ARG 108 -13.689 -1.163 -2.454 864 HE ARG 108 HE ARG 108 -12.550 -3.813 -2.846 865 HH11 ARG 108 HH11 ARG 108 -11.801 -0.345 -3.299 866 HH12 ARG 108 HH12 ARG 108 -11.168 -0.561 -4.884 867 HH21 ARG 108 HH21 ARG 108 -11.637 -4.096 -4.926 868 HH22 ARG 108 HH22 ARG 108 -10.934 -2.773 -5.779 869 H TYR 109 H TYR 109 -14.107 -2.424 3.232 870 HA TYR 109 HA TYR 109 -12.490 -4.244 4.786 871 HB2 TYR 109 HB2 TYR 109 -12.958 -2.020 5.612 872 HB3 TYR 109 HB3 TYR 109 -14.673 -2.269 5.642 873 HD1 TYR 109 HD1 TYR 109 -15.702 -4.016 7.253 874 HD2 TYR 109 HD2 TYR 109 -11.612 -2.610 7.528 875 HE1 TYR 109 HE1 TYR 109 -15.527 -4.971 9.508 876 HE2 TYR 109 HE2 TYR 109 -11.485 -3.504 9.835 877 HH TYR 109 HH TYR 109 -14.166 -5.325 11.392 878 H GLN 110 H GLN 110 -16.048 -3.863 4.371 879 HA GLN 110 HA GLN 110 -16.692 -6.161 5.826 880 HB2 GLN 110 HB2 GLN 110 -18.920 -5.993 5.023 881 HB3 GLN 110 HB3 GLN 110 -18.302 -4.389 5.416 882 HG2 GLN 110 HG2 GLN 110 -18.002 -3.915 3.032 883 HG3 GLN 110 HG3 GLN 110 -18.520 -5.546 2.607 884 HE21 GLN 110 HE21 GLN 110 -19.575 -2.400 3.937 885 HE22 GLN 110 HE22 GLN 110 -21.289 -2.772 3.892 886 H GLU 111 H GLU 111 -15.562 -5.882 2.563 887 HA GLU 111 HA GLU 111 -16.603 -8.239 1.366 888 HB2 GLU 111 HB2 GLU 111 -14.388 -6.321 0.984 889 HB3 GLU 111 HB3 GLU 111 -13.946 -7.916 0.463 890 HG2 GLU 111 HG2 GLU 111 -16.502 -6.512 -0.378 891 HG3 GLU 111 HG3 GLU 111 -14.971 -6.347 -1.250 892 H ARG 112 H ARG 112 -13.749 -7.747 3.445 893 HA ARG 112 HA ARG 112 -13.434 -10.726 3.646 894 HB2 ARG 112 HB2 ARG 112 -11.498 -8.429 4.121 895 HB3 ARG 112 HB3 ARG 112 -11.133 -10.077 4.611 896 HG2 ARG 112 HG2 ARG 112 -11.940 -9.566 1.729 897 HG3 ARG 112 HG3 ARG 112 -10.331 -9.117 2.277 898 HD2 ARG 112 HD2 ARG 112 -10.252 -11.323 1.293 899 HD3 ARG 112 HD3 ARG 112 -9.847 -11.376 3.010 900 HE ARG 112 HE ARG 112 -12.648 -11.946 2.280 901 HH11 ARG 112 HH11 ARG 112 -9.438 -13.368 3.021 902 HH12 ARG 112 HH12 ARG 112 -10.064 -14.941 3.281 903 HH21 ARG 112 HH21 ARG 112 -13.463 -13.952 3.040 904 HH22 ARG 112 HH22 ARG 112 -12.397 -15.276 3.385 905 H TYR 113 H TYR 113 -13.422 -7.839 5.701 906 HA TYR 113 HA TYR 113 -13.609 -9.390 8.158 907 HB2 TYR 113 HB2 TYR 113 -13.448 -6.406 7.870 908 HB3 TYR 113 HB3 TYR 113 -12.851 -7.410 9.185 909 HD1 TYR 113 HD1 TYR 113 -11.875 -5.432 6.514 910 HD2 TYR 113 HD2 TYR 113 -10.987 -9.273 8.229 911 HE1 TYR 113 HE1 TYR 113 -9.761 -5.509 5.203 912 HE2 TYR 113 HE2 TYR 113 -8.884 -9.370 6.939 913 HH TYR 113 HH TYR 113 -7.505 -8.281 5.385 914 H GLY 114 H GLY 114 -15.907 -9.369 6.286 915 HA2 GLY 114 HA2 GLY 114 -18.031 -8.647 8.105 916 HA3 GLY 114 HA3 GLY 114 -17.986 -7.704 6.605 917 H ASN 115 H ASN 115 -20.097 -8.815 6.096 918 HA ASN 115 HA ASN 115 -19.576 -11.260 4.580 919 HB2 ASN 115 HB2 ASN 115 -20.249 -12.083 6.816 920 HB3 ASN 115 HB3 ASN 115 -21.730 -11.113 6.734 921 HD21 ASN 115 HD21 ASN 115 -23.298 -12.754 6.593 922 HD22 ASN 115 HD22 ASN 115 -23.365 -13.896 5.280 923 H LYS 116 H LYS 116 -21.112 -11.605 2.930 924 HA LYS 116 HA LYS 116 -22.941 -9.327 2.318 925 HB2 LYS 116 HB2 LYS 116 -22.403 -9.740 -0.045 926 HB3 LYS 116 HB3 LYS 116 -20.984 -9.274 0.859 927 HG2 LYS 116 HG2 LYS 116 -19.989 -11.370 0.710 928 HG3 LYS 116 HG3 LYS 116 -21.526 -12.223 0.545 929 HD2 LYS 116 HD2 LYS 116 -21.840 -11.268 -1.712 930 HD3 LYS 116 HD3 LYS 116 -20.246 -10.493 -1.615 931 HE2 LYS 116 HE2 LYS 116 -19.128 -12.628 -1.497 932 HE3 LYS 116 HE3 LYS 116 -20.635 -13.469 -1.124 933 HZ1 LYS 116 HZ1 LYS 116 -20.201 -13.936 -3.323 934 HZ2 LYS 116 HZ2 LYS 116 -21.372 -12.803 -3.420 935 HZ3 LYS 116 HZ3 LYS 116 -19.806 -12.388 -3.726 936 H LYS 117 H LYS 117 -24.445 -10.033 0.461 937 HA LYS 117 HA LYS 117 -25.770 -12.642 1.071 938 HB2 LYS 117 HB2 LYS 117 -27.884 -11.440 0.641 939 HB3 LYS 117 HB3 LYS 117 -26.997 -10.628 1.932 940 HG2 LYS 117 HG2 LYS 117 -26.207 -8.899 0.448 941 HG3 LYS 117 HG3 LYS 117 -26.743 -9.782 -0.980 942 HD2 LYS 117 HD2 LYS 117 -29.118 -9.457 -0.253 943 HD3 LYS 117 HD3 LYS 117 -28.494 -8.386 1.041 944 HE2 LYS 117 HE2 LYS 117 -27.145 -7.206 -0.796 945 HE3 LYS 117 HE3 LYS 117 -28.058 -8.155 -1.987 946 HZ1 LYS 117 HZ1 LYS 117 -29.178 -6.262 -0.032 947 HZ2 LYS 117 HZ2 LYS 117 -28.975 -5.990 -1.654 948 HZ3 LYS 117 HZ3 LYS 117 -30.055 -7.123 -1.208 949 H SER 118 H SER 118 -27.626 -12.224 -1.189 950 HA SER 118 HA SER 118 -25.884 -12.944 -3.439 951 HB2 SER 118 HB2 SER 118 -28.275 -13.395 -4.343 952 HB3 SER 118 HB3 SER 118 -27.592 -14.474 -3.109 953 HG SER 118 HG SER 118 -29.866 -13.572 -2.941 954 H GLN 119 H GLN 119 -26.364 -11.929 -5.563 955 HA GLN 119 HA GLN 119 -27.789 -9.358 -5.521 956 HB2 GLN 119 HB2 GLN 119 -24.854 -9.696 -6.292 957 HB3 GLN 119 HB3 GLN 119 -25.870 -8.366 -6.872 958 HG2 GLN 119 HG2 GLN 119 -26.345 -7.663 -4.554 959 HG3 GLN 119 HG3 GLN 119 -25.367 -8.992 -3.937 960 HE21 GLN 119 HE21 GLN 119 -24.699 -6.441 -6.530 961 HE22 GLN 119 HE22 GLN 119 -23.180 -6.015 -5.784 962 H ASP 120 H ASP 120 -28.627 -8.869 -7.546 963 HA ASP 120 HA ASP 120 -28.236 -10.695 -9.820 964 HB2 ASP 120 HB2 ASP 120 -30.608 -11.117 -10.002 965 HB3 ASP 120 HB3 ASP 120 -30.087 -11.633 -8.413 966 H LEU 121 H LEU 121 -29.573 -9.877 -11.676 967 HA LEU 121 HA LEU 121 -30.424 -7.183 -11.750 968 HB2 LEU 121 HB2 LEU 121 -27.807 -8.013 -13.123 969 HB3 LEU 121 HB3 LEU 121 -28.809 -6.768 -13.807 970 HG LEU 121 HG LEU 121 -28.570 -5.868 -11.192 971 HD11 LEU 121 HD11 LEU 121 -26.793 -7.592 -10.780 972 HD12 LEU 121 HD12 LEU 121 -25.852 -6.919 -12.126 973 HD13 LEU 121 HD13 LEU 121 -26.179 -5.934 -10.676 974 HD21 LEU 121 HD21 LEU 121 -26.844 -5.122 -13.571 975 HD22 LEU 121 HD22 LEU 121 -28.483 -4.525 -13.252 976 HD23 LEU 121 HD23 LEU 121 -27.195 -4.126 -12.115 977 H LYS 122 H LYS 122 -31.075 -6.735 -14.120 978 HA LYS 122 HA LYS 122 -32.619 -8.940 -15.134 979 HB2 LYS 122 HB2 LYS 122 -33.552 -6.752 -15.290 980 HB3 LYS 122 HB3 LYS 122 -32.107 -6.080 -16.046 981 HG2 LYS 122 HG2 LYS 122 -33.601 -8.283 -17.491 982 HG3 LYS 122 HG3 LYS 122 -34.311 -6.673 -17.444 983 HD2 LYS 122 HD2 LYS 122 -32.741 -5.689 -18.765 984 HD3 LYS 122 HD3 LYS 122 -31.436 -6.719 -18.213 985 HE2 LYS 122 HE2 LYS 122 -33.642 -7.835 -19.954 986 HE3 LYS 122 HE3 LYS 122 -32.257 -6.972 -20.657 987 HZ1 LYS 122 HZ1 LYS 122 -31.908 -9.426 -20.506 988 HZ2 LYS 122 HZ2 LYS 122 -30.779 -8.546 -19.705 989 HZ3 LYS 122 HZ3 LYS 122 -31.915 -9.289 -18.848 Start of MODEL 3 1 H1 GLY 1 H GLY 1 19.570 -4.070 19.490 2 HA2 GLY 1 HA2 GLY 1 17.391 -4.875 18.649 3 HA3 GLY 1 HA3 GLY 1 17.252 -3.312 17.796 4 H SER 2 H SER 2 17.202 -5.880 16.469 5 HA SER 2 HA SER 2 19.445 -5.513 14.646 6 HB2 SER 2 HB2 SER 2 19.976 -7.960 14.773 7 HB3 SER 2 HB3 SER 2 20.374 -7.073 16.258 8 HG SER 2 HG SER 2 19.283 -9.114 16.548 9 H ASN 3 H ASN 3 19.059 -6.834 12.683 10 HA ASN 3 HA ASN 3 16.173 -6.895 12.024 11 HB2 ASN 3 HB2 ASN 3 18.693 -7.147 10.343 12 HB3 ASN 3 HB3 ASN 3 17.094 -7.490 9.703 13 HD21 ASN 3 HD21 ASN 3 15.447 -5.734 9.846 14 HD22 ASN 3 HD22 ASN 3 15.984 -4.062 9.834 15 H GLN 4 H GLN 4 18.927 -9.130 11.408 16 HA GLN 4 HA GLN 4 19.169 -11.326 11.474 17 HB2 GLN 4 HB2 GLN 4 18.401 -10.764 13.920 18 HB3 GLN 4 HB3 GLN 4 16.956 -11.695 13.492 19 HG2 GLN 4 HG2 GLN 4 18.445 -13.614 12.857 20 HG3 GLN 4 HG3 GLN 4 19.853 -12.663 13.325 21 HE21 GLN 4 HE21 GLN 4 18.394 -15.213 14.385 22 HE22 GLN 4 HE22 GLN 4 18.517 -14.947 16.128 23 H GLN 5 H GLN 5 16.618 -9.987 10.098 24 HA GLN 5 HA GLN 5 15.505 -12.447 8.906 25 HB2 GLN 5 HB2 GLN 5 14.197 -10.036 10.072 26 HB3 GLN 5 HB3 GLN 5 13.680 -10.389 8.426 27 HG2 GLN 5 HG2 GLN 5 12.187 -11.564 9.735 28 HG3 GLN 5 HG3 GLN 5 13.302 -12.803 9.156 29 HE21 GLN 5 HE21 GLN 5 14.532 -13.971 10.819 30 HE22 GLN 5 HE22 GLN 5 14.304 -13.651 12.514 31 H LEU 6 H LEU 6 14.552 -11.682 6.617 32 HA LEU 6 HA LEU 6 16.941 -10.562 5.268 33 HB2 LEU 6 HB2 LEU 6 14.564 -12.158 4.206 34 HB3 LEU 6 HB3 LEU 6 15.894 -11.510 3.249 35 HG LEU 6 HG LEU 6 17.390 -12.776 5.109 36 HD11 LEU 6 HD11 LEU 6 15.483 -13.716 6.410 37 HD12 LEU 6 HD12 LEU 6 14.910 -14.516 4.943 38 HD13 LEU 6 HD13 LEU 6 16.460 -14.976 5.673 39 HD21 LEU 6 HD21 LEU 6 16.034 -14.172 2.772 40 HD22 LEU 6 HD22 LEU 6 17.441 -13.096 2.652 41 HD23 LEU 6 HD23 LEU 6 17.588 -14.630 3.530 42 H ASN 7 H ASN 7 13.752 -9.539 6.088 43 HA ASN 7 HA ASN 7 14.007 -6.909 5.297 44 HB2 ASN 7 HB2 ASN 7 12.811 -8.584 3.086 45 HB3 ASN 7 HB3 ASN 7 12.010 -7.071 3.503 46 HD21 ASN 7 HD21 ASN 7 14.745 -8.325 1.817 47 HD22 ASN 7 HD22 ASN 7 15.359 -6.756 1.402 48 H ALA 8 H ALA 8 11.046 -8.542 4.529 49 HA ALA 8 HA ALA 8 9.631 -7.368 6.630 50 HB1 ALA 8 HB1 ALA 8 7.724 -8.778 5.856 51 HB2 ALA 8 HB2 ALA 8 8.554 -7.925 4.560 52 HB3 ALA 8 HB3 ALA 8 8.842 -9.664 4.779 53 H THR 9 H THR 9 9.184 -10.858 6.397 54 HA THR 9 HA THR 9 10.251 -11.416 9.021 55 HB THR 9 HB THR 9 7.836 -12.223 9.744 56 HG1 THR 9 HG1 THR 9 7.283 -9.867 8.283 57 HG21 THR 9 HG21 THR 9 9.308 -10.552 10.958 58 HG22 THR 9 HG22 THR 9 8.333 -9.284 10.180 59 HG23 THR 9 HG23 THR 9 7.557 -10.492 11.217 60 H LYS 10 H LYS 10 7.449 -12.638 7.229 61 HA LYS 10 HA LYS 10 8.968 -15.094 6.461 62 HB2 LYS 10 HB2 LYS 10 7.183 -16.563 7.159 63 HB3 LYS 10 HB3 LYS 10 7.823 -15.708 8.560 64 HG2 LYS 10 HG2 LYS 10 5.367 -14.580 7.206 65 HG3 LYS 10 HG3 LYS 10 5.178 -16.103 8.017 66 HD2 LYS 10 HD2 LYS 10 6.447 -13.826 9.517 67 HD3 LYS 10 HD3 LYS 10 4.696 -13.835 9.226 68 HE2 LYS 10 HE2 LYS 10 4.634 -16.201 10.149 69 HE3 LYS 10 HE3 LYS 10 6.324 -15.982 10.639 70 HZ1 LYS 10 HZ1 LYS 10 4.807 -15.481 12.419 71 HZ2 LYS 10 HZ2 LYS 10 5.589 -14.098 11.988 72 HZ3 LYS 10 HZ3 LYS 10 4.010 -14.368 11.532 73 H LYS 11 H LYS 11 6.391 -12.838 5.708 74 HA LYS 11 HA LYS 11 5.399 -14.605 3.557 75 HB2 LYS 11 HB2 LYS 11 4.387 -11.862 4.357 76 HB3 LYS 11 HB3 LYS 11 3.624 -13.023 3.276 77 HG2 LYS 11 HG2 LYS 11 3.776 -14.605 5.468 78 HG3 LYS 11 HG3 LYS 11 3.853 -13.035 6.287 79 HD2 LYS 11 HD2 LYS 11 1.560 -13.600 6.259 80 HD3 LYS 11 HD3 LYS 11 1.744 -12.416 4.940 81 HE2 LYS 11 HE2 LYS 11 1.949 -14.308 3.315 82 HE3 LYS 11 HE3 LYS 11 1.837 -15.451 4.648 83 HZ1 LYS 11 HZ1 LYS 11 -0.248 -15.196 3.484 84 HZ2 LYS 11 HZ2 LYS 11 -0.432 -14.682 5.036 85 HZ3 LYS 11 HZ3 LYS 11 -0.312 -13.569 3.835 86 H ASP 12 H ASP 12 5.836 -14.399 1.536 87 HA ASP 12 HA ASP 12 7.851 -12.749 0.476 88 HB2 ASP 12 HB2 ASP 12 6.077 -13.718 -1.596 89 HB3 ASP 12 HB3 ASP 12 7.714 -14.215 -1.193 90 H LYS 13 H LYS 13 4.334 -12.462 0.681 91 HA LYS 13 HA LYS 13 4.014 -10.230 -1.109 92 HB2 LYS 13 HB2 LYS 13 2.343 -11.234 1.233 93 HB3 LYS 13 HB3 LYS 13 1.807 -10.019 0.075 94 HG2 LYS 13 HG2 LYS 13 2.542 -12.894 -0.686 95 HG3 LYS 13 HG3 LYS 13 0.925 -12.330 -0.334 96 HD2 LYS 13 HD2 LYS 13 0.765 -12.037 -2.567 97 HD3 LYS 13 HD3 LYS 13 1.502 -10.493 -2.200 98 HE2 LYS 13 HE2 LYS 13 2.840 -11.170 -3.945 99 HE3 LYS 13 HE3 LYS 13 3.787 -11.787 -2.588 100 HZ1 LYS 13 HZ1 LYS 13 3.512 -13.456 -4.354 101 HZ2 LYS 13 HZ2 LYS 13 2.781 -13.974 -2.995 102 HZ3 LYS 13 HZ3 LYS 13 1.888 -13.373 -4.232 103 H LEU 14 H LEU 14 4.619 -10.489 2.447 104 HA LEU 14 HA LEU 14 4.444 -7.606 2.757 105 HB2 LEU 14 HB2 LEU 14 5.677 -9.732 4.553 106 HB3 LEU 14 HB3 LEU 14 5.439 -8.041 4.996 107 HG LEU 14 HG LEU 14 3.175 -9.950 4.272 108 HD11 LEU 14 HD11 LEU 14 4.100 -8.937 7.000 109 HD12 LEU 14 HD12 LEU 14 2.717 -10.002 6.693 110 HD13 LEU 14 HD13 LEU 14 4.365 -10.576 6.381 111 HD21 LEU 14 HD21 LEU 14 3.147 -7.140 5.442 112 HD22 LEU 14 HD22 LEU 14 2.526 -7.636 3.844 113 HD23 LEU 14 HD23 LEU 14 1.728 -8.214 5.308 114 H GLN 15 H GLN 15 7.008 -9.874 1.886 115 HA GLN 15 HA GLN 15 9.285 -8.410 2.546 116 HB2 GLN 15 HB2 GLN 15 9.139 -10.756 1.657 117 HB3 GLN 15 HB3 GLN 15 8.837 -10.085 0.048 118 HG2 GLN 15 HG2 GLN 15 11.053 -8.908 0.179 119 HG3 GLN 15 HG3 GLN 15 11.368 -9.789 1.682 120 HE21 GLN 15 HE21 GLN 15 12.765 -9.921 -0.985 121 HE22 GLN 15 HE22 GLN 15 12.711 -11.636 -1.392 122 H VAL 16 H VAL 16 7.416 -8.180 -0.544 123 HA VAL 16 HA VAL 16 9.145 -6.168 -1.593 124 HB VAL 16 HB VAL 16 7.455 -5.874 -3.333 125 HG11 VAL 16 HG11 VAL 16 7.780 -8.814 -2.630 126 HG12 VAL 16 HG12 VAL 16 7.485 -8.114 -4.231 127 HG13 VAL 16 HG13 VAL 16 9.019 -7.795 -3.395 128 HG21 VAL 16 HG21 VAL 16 5.358 -5.974 -2.174 129 HG22 VAL 16 HG22 VAL 16 5.393 -7.323 -3.324 130 HG23 VAL 16 HG23 VAL 16 5.684 -7.642 -1.632 131 H ILE 17 H ILE 17 6.201 -5.901 0.417 132 HA ILE 17 HA ILE 17 5.969 -3.048 0.081 133 HB ILE 17 HB ILE 17 4.902 -4.696 2.394 134 HG12 ILE 17 HG12 ILE 17 3.462 -4.135 -0.234 135 HG13 ILE 17 HG13 ILE 17 4.169 -5.684 0.211 136 HG21 ILE 17 HG21 ILE 17 3.201 -2.873 2.531 137 HG22 ILE 17 HG22 ILE 17 4.825 -2.246 2.731 138 HG23 ILE 17 HG23 ILE 17 4.001 -2.050 1.180 139 HD11 ILE 17 HD11 ILE 17 1.919 -5.959 0.763 140 HD12 ILE 17 HD12 ILE 17 2.675 -5.615 2.317 141 HD13 ILE 17 HD13 ILE 17 1.774 -4.342 1.459 142 H ASP 18 H ASP 18 7.591 -5.178 2.416 143 HA ASP 18 HA ASP 18 8.370 -3.161 4.292 144 HB2 ASP 18 HB2 ASP 18 8.213 -5.660 4.605 145 HB3 ASP 18 HB3 ASP 18 9.723 -5.822 3.697 146 H TRP 19 H TRP 19 9.870 -4.508 1.366 147 HA TRP 19 HA TRP 19 12.404 -3.240 1.555 148 HB2 TRP 19 HB2 TRP 19 12.025 -5.148 0.142 149 HB3 TRP 19 HB3 TRP 19 10.741 -4.349 -0.732 150 HD1 TRP 19 HD1 TRP 19 11.448 -2.483 -2.594 151 HE1 TRP 19 HE1 TRP 19 13.531 -2.289 -4.032 152 HE3 TRP 19 HE3 TRP 19 14.643 -5.332 0.178 153 HZ2 TRP 19 HZ2 TRP 19 16.117 -3.540 -4.222 154 HZ3 TRP 19 HZ3 TRP 19 16.902 -5.941 -0.728 155 HH2 TRP 19 HH2 TRP 19 17.642 -5.045 -2.925 156 H LEU 20 H LEU 20 9.465 -2.282 -0.412 157 HA LEU 20 HA LEU 20 10.653 0.134 -1.266 158 HB2 LEU 20 HB2 LEU 20 8.484 0.802 -2.025 159 HB3 LEU 20 HB3 LEU 20 8.876 -0.848 -2.444 160 HG LEU 20 HG LEU 20 7.457 -1.356 -0.238 161 HD11 LEU 20 HD11 LEU 20 6.128 1.160 -1.305 162 HD12 LEU 20 HD12 LEU 20 5.496 0.083 -0.038 163 HD13 LEU 20 HD13 LEU 20 6.951 1.047 0.260 164 HD21 LEU 20 HD21 LEU 20 5.486 -1.723 -1.665 165 HD22 LEU 20 HD22 LEU 20 6.285 -0.791 -2.968 166 HD23 LEU 20 HD23 LEU 20 6.988 -2.314 -2.365 167 H ILE 21 H ILE 21 8.926 -0.550 1.773 168 HA ILE 21 HA ILE 21 8.618 2.213 2.551 169 HB ILE 21 HB ILE 21 8.707 -0.416 4.076 170 HG12 ILE 21 HG12 ILE 21 6.344 1.492 3.815 171 HG13 ILE 21 HG13 ILE 21 6.679 0.248 2.622 172 HG21 ILE 21 HG21 ILE 21 7.900 0.861 6.085 173 HG22 ILE 21 HG22 ILE 21 9.558 1.163 5.670 174 HG23 ILE 21 HG23 ILE 21 8.332 2.366 5.260 175 HD11 ILE 21 HD11 ILE 21 6.558 -1.474 4.468 176 HD12 ILE 21 HD12 ILE 21 6.066 -0.181 5.576 177 HD13 ILE 21 HD13 ILE 21 5.042 -0.585 4.216 178 H GLU 22 H GLU 22 11.243 -0.209 3.009 179 HA GLU 22 HA GLU 22 12.824 1.549 4.681 180 HB2 GLU 22 HB2 GLU 22 12.753 -1.012 4.631 181 HB3 GLU 22 HB3 GLU 22 13.743 -0.920 3.168 182 HG2 GLU 22 HG2 GLU 22 15.461 0.370 4.483 183 HG3 GLU 22 HG3 GLU 22 14.429 0.258 5.908 184 H ASN 23 H ASN 23 12.457 1.067 1.261 185 HA ASN 23 HA ASN 23 15.016 2.162 0.401 186 HB2 ASN 23 HB2 ASN 23 12.449 1.301 -0.903 187 HB3 ASN 23 HB3 ASN 23 13.392 2.525 -1.732 188 HD21 ASN 23 HD21 ASN 23 14.627 -0.393 0.139 189 HD22 ASN 23 HD22 ASN 23 15.593 -0.882 -1.245 190 H PHE 24 H PHE 24 11.703 3.513 0.857 191 HA PHE 24 HA PHE 24 12.889 6.232 0.511 192 HB2 PHE 24 HB2 PHE 24 10.448 5.071 -0.707 193 HB3 PHE 24 HB3 PHE 24 10.331 6.715 -0.112 194 HD1 PHE 24 HD1 PHE 24 11.997 8.485 -0.826 195 HD2 PHE 24 HD2 PHE 24 11.590 4.683 -2.776 196 HE1 PHE 24 HE1 PHE 24 12.892 9.477 -2.923 197 HE2 PHE 24 HE2 PHE 24 12.401 5.707 -4.897 198 HZ PHE 24 HZ PHE 24 13.082 8.091 -4.963 199 HA PRO 25 HA PRO 25 11.180 6.065 4.750 200 HB2 PRO 25 HB2 PRO 25 13.335 7.031 6.121 201 HB3 PRO 25 HB3 PRO 25 13.263 5.349 5.526 202 HG2 PRO 25 HG2 PRO 25 14.562 7.733 4.160 203 HG3 PRO 25 HG3 PRO 25 15.308 6.141 4.550 204 HD2 PRO 25 HD2 PRO 25 14.247 6.667 2.109 205 HD3 PRO 25 HD3 PRO 25 14.078 5.055 2.866 206 H ASN 26 H ASN 26 10.994 8.183 2.469 207 HA ASN 26 HA ASN 26 11.202 10.739 3.986 208 HB2 ASN 26 HB2 ASN 26 10.308 10.309 1.127 209 HB3 ASN 26 HB3 ASN 26 10.641 11.843 1.895 210 HD21 ASN 26 HD21 ASN 26 13.068 10.609 3.330 211 HD22 ASN 26 HD22 ASN 26 14.300 10.576 2.089 212 H ALA 27 H ALA 27 8.934 8.322 3.159 213 HA ALA 27 HA ALA 27 6.824 9.228 4.859 214 HB1 ALA 27 HB1 ALA 27 6.264 10.889 3.136 215 HB2 ALA 27 HB2 ALA 27 6.481 9.690 1.838 216 HB3 ALA 27 HB3 ALA 27 5.120 9.546 2.974 217 H PHE 28 H PHE 28 6.198 7.196 5.472 218 HA PHE 28 HA PHE 28 4.816 5.470 3.901 219 HB2 PHE 28 HB2 PHE 28 7.709 4.870 3.731 220 HB3 PHE 28 HB3 PHE 28 6.746 3.532 4.301 221 HD1 PHE 28 HD1 PHE 28 4.226 3.623 2.876 222 HD2 PHE 28 HD2 PHE 28 8.161 4.606 1.401 223 HE1 PHE 28 HE1 PHE 28 3.458 3.193 0.568 224 HE2 PHE 28 HE2 PHE 28 7.392 4.185 -0.891 225 HZ PHE 28 HZ PHE 28 5.021 3.456 -1.332 226 H PHE 29 H PHE 29 4.261 3.333 5.186 227 HA PHE 29 HA PHE 29 4.991 3.510 8.021 228 HB2 PHE 29 HB2 PHE 29 2.149 3.826 7.042 229 HB3 PHE 29 HB3 PHE 29 2.546 3.283 8.666 230 HD1 PHE 29 HD1 PHE 29 2.080 6.186 6.588 231 HD2 PHE 29 HD2 PHE 29 4.208 4.748 10.053 232 HE1 PHE 29 HE1 PHE 29 2.551 8.517 7.263 233 HE2 PHE 29 HE2 PHE 29 4.542 7.096 10.796 234 HZ PHE 29 HZ PHE 29 3.731 8.979 9.406 235 H LYS 30 H LYS 30 4.522 1.610 9.160 236 HA LYS 30 HA LYS 30 4.346 -0.808 7.411 237 HB2 LYS 30 HB2 LYS 30 5.677 -0.320 10.085 238 HB3 LYS 30 HB3 LYS 30 5.712 -1.838 9.186 239 HG2 LYS 30 HG2 LYS 30 7.071 -0.936 7.469 240 HG3 LYS 30 HG3 LYS 30 6.680 0.728 7.890 241 HD2 LYS 30 HD2 LYS 30 8.825 0.537 8.656 242 HD3 LYS 30 HD3 LYS 30 7.814 0.383 10.112 243 HE2 LYS 30 HE2 LYS 30 8.041 -2.103 9.978 244 HE3 LYS 30 HE3 LYS 30 8.925 -1.955 8.452 245 HZ1 LYS 30 HZ1 LYS 30 10.713 -0.860 9.670 246 HZ2 LYS 30 HZ2 LYS 30 9.892 -1.076 11.088 247 HZ3 LYS 30 HZ3 LYS 30 10.387 -2.374 10.224 248 H LYS 31 H LYS 31 3.635 0.318 10.728 249 HA LYS 31 HA LYS 31 2.272 -1.920 11.616 250 HB2 LYS 31 HB2 LYS 31 1.931 0.948 12.528 251 HB3 LYS 31 HB3 LYS 31 1.461 -0.479 13.449 252 HG2 LYS 31 HG2 LYS 31 3.874 -1.261 13.367 253 HG3 LYS 31 HG3 LYS 31 4.290 0.257 12.565 254 HD2 LYS 31 HD2 LYS 31 3.047 1.309 14.683 255 HD3 LYS 31 HD3 LYS 31 3.508 -0.252 15.398 256 HE2 LYS 31 HE2 LYS 31 5.876 0.208 14.549 257 HE3 LYS 31 HE3 LYS 31 5.328 1.826 14.101 258 HZ1 LYS 31 HZ1 LYS 31 6.341 1.952 16.186 259 HZ2 LYS 31 HZ2 LYS 31 4.722 2.096 16.505 260 HZ3 LYS 31 HZ3 LYS 31 5.524 0.683 16.815 261 H GLY 32 H GLY 32 0.797 -0.021 9.185 262 HA2 GLY 32 HA2 GLY 32 -1.311 -0.310 8.279 263 HA3 GLY 32 HA3 GLY 32 -1.687 -1.478 9.526 264 H ASN 33 H ASN 33 -1.658 -0.211 11.765 265 HA ASN 33 HA ASN 33 -4.036 1.224 12.006 266 HB2 ASN 33 HB2 ASN 33 -3.367 1.692 14.349 267 HB3 ASN 33 HB3 ASN 33 -3.284 0.013 13.869 268 HD21 ASN 33 HD21 ASN 33 -0.684 2.597 13.400 269 HD22 ASN 33 HD22 ASN 33 0.380 1.738 14.497 270 H GLN 34 H GLN 34 -0.933 2.481 11.264 271 HA GLN 34 HA GLN 34 -1.884 5.284 11.631 272 HB2 GLN 34 HB2 GLN 34 0.504 5.898 11.933 273 HB3 GLN 34 HB3 GLN 34 -0.182 4.876 13.191 274 HG2 GLN 34 HG2 GLN 34 0.939 2.901 11.776 275 HG3 GLN 34 HG3 GLN 34 1.849 4.201 11.055 276 HE21 GLN 34 HE21 GLN 34 0.936 4.097 14.652 277 HE22 GLN 34 HE22 GLN 34 2.535 3.667 15.138 278 H VAL 35 H VAL 35 -1.567 3.074 9.173 279 HA VAL 35 HA VAL 35 0.056 4.498 7.313 280 HB VAL 35 HB VAL 35 -1.109 3.356 5.510 281 HG11 VAL 35 HG11 VAL 35 0.639 2.190 6.618 282 HG12 VAL 35 HG12 VAL 35 -0.440 1.658 7.917 283 HG13 VAL 35 HG13 VAL 35 -0.645 1.046 6.258 284 HG21 VAL 35 HG21 VAL 35 -3.370 3.356 5.907 285 HG22 VAL 35 HG22 VAL 35 -2.939 1.657 6.193 286 HG23 VAL 35 HG23 VAL 35 -3.247 2.768 7.545 287 H LYS 36 H LYS 36 -0.258 5.935 5.603 288 HA LYS 36 HA LYS 36 -2.662 7.660 5.819 289 HB2 LYS 36 HB2 LYS 36 -1.467 9.544 5.964 290 HB3 LYS 36 HB3 LYS 36 -0.277 8.498 6.670 291 HG2 LYS 36 HG2 LYS 36 1.220 9.249 5.180 292 HG3 LYS 36 HG3 LYS 36 0.350 8.452 3.894 293 HD2 LYS 36 HD2 LYS 36 0.435 10.633 3.099 294 HD3 LYS 36 HD3 LYS 36 -1.142 10.646 3.868 295 HE2 LYS 36 HE2 LYS 36 0.227 11.453 6.000 296 HE3 LYS 36 HE3 LYS 36 1.471 11.863 4.812 297 HZ1 LYS 36 HZ1 LYS 36 -1.228 12.991 5.119 298 HZ2 LYS 36 HZ2 LYS 36 0.206 13.760 5.180 299 HZ3 LYS 36 HZ3 LYS 36 -0.383 13.278 3.717 300 HA PRO 37 HA PRO 37 -3.175 6.873 1.523 301 HB2 PRO 37 HB2 PRO 37 -4.335 9.123 0.518 302 HB3 PRO 37 HB3 PRO 37 -5.156 8.083 1.717 303 HG2 PRO 37 HG2 PRO 37 -3.633 10.651 2.269 304 HG3 PRO 37 HG3 PRO 37 -5.257 10.159 2.850 305 HD2 PRO 37 HD2 PRO 37 -2.996 9.832 4.348 306 HD3 PRO 37 HD3 PRO 37 -4.336 8.667 4.408 307 H LEU 38 H LEU 38 -1.350 6.625 0.242 308 HA LEU 38 HA LEU 38 0.622 8.809 -0.066 309 HB2 LEU 38 HB2 LEU 38 0.438 5.970 -1.193 310 HB3 LEU 38 HB3 LEU 38 1.638 7.138 -1.673 311 HG LEU 38 HG LEU 38 2.781 5.805 -0.215 312 HD11 LEU 38 HD11 LEU 38 3.047 8.256 0.278 313 HD12 LEU 38 HD12 LEU 38 1.928 8.071 1.644 314 HD13 LEU 38 HD13 LEU 38 3.486 7.191 1.598 315 HD21 LEU 38 HD21 LEU 38 0.834 4.625 0.736 316 HD22 LEU 38 HD22 LEU 38 2.086 5.010 1.922 317 HD23 LEU 38 HD23 LEU 38 0.606 5.989 1.856 318 H LYS 39 H LYS 39 1.281 9.377 -2.327 319 HA LYS 39 HA LYS 39 -0.624 10.665 -3.822 320 HB2 LYS 39 HB2 LYS 39 1.670 11.210 -4.057 321 HB3 LYS 39 HB3 LYS 39 2.121 9.553 -4.431 322 HG2 LYS 39 HG2 LYS 39 1.091 9.721 -6.655 323 HG3 LYS 39 HG3 LYS 39 0.614 11.411 -6.326 324 HD2 LYS 39 HD2 LYS 39 2.958 12.031 -6.142 325 HD3 LYS 39 HD3 LYS 39 3.427 10.315 -6.169 326 HE2 LYS 39 HE2 LYS 39 2.706 10.152 -8.517 327 HE3 LYS 39 HE3 LYS 39 2.293 11.878 -8.496 328 HZ1 LYS 39 HZ1 LYS 39 4.528 11.496 -9.371 329 HZ2 LYS 39 HZ2 LYS 39 4.638 12.345 -7.972 330 HZ3 LYS 39 HZ3 LYS 39 5.004 10.748 -8.017 331 H ILE 40 H ILE 40 -1.626 10.371 -5.850 332 HA ILE 40 HA ILE 40 -2.808 7.827 -6.202 333 HB ILE 40 HB ILE 40 -3.977 9.877 -6.777 334 HG12 ILE 40 HG12 ILE 40 -4.811 9.362 -9.046 335 HG13 ILE 40 HG13 ILE 40 -3.477 8.234 -9.300 336 HG21 ILE 40 HG21 ILE 40 -2.037 11.250 -7.575 337 HG22 ILE 40 HG22 ILE 40 -2.001 10.268 -9.046 338 HG23 ILE 40 HG23 ILE 40 -3.407 11.282 -8.691 339 HD11 ILE 40 HD11 ILE 40 -4.329 6.802 -7.483 340 HD12 ILE 40 HD12 ILE 40 -5.613 7.988 -7.132 341 HD13 ILE 40 HD13 ILE 40 -5.591 7.100 -8.676 342 H GLY 41 H GLY 41 -2.101 6.165 -7.258 343 HA2 GLY 41 HA2 GLY 41 -0.764 4.761 -8.595 344 HA3 GLY 41 HA3 GLY 41 -0.531 6.177 -9.627 345 H ILE 42 H ILE 42 0.597 6.365 -6.284 346 HA ILE 42 HA ILE 42 3.161 7.166 -6.773 347 HB ILE 42 HB ILE 42 2.055 7.282 -4.620 348 HG12 ILE 42 HG12 ILE 42 4.671 5.739 -4.425 349 HG13 ILE 42 HG13 ILE 42 4.520 7.447 -4.861 350 HG21 ILE 42 HG21 ILE 42 1.855 5.371 -3.093 351 HG22 ILE 42 HG22 ILE 42 0.948 5.045 -4.549 352 HG23 ILE 42 HG23 ILE 42 2.535 4.287 -4.283 353 HD11 ILE 42 HD11 ILE 42 5.156 7.224 -2.552 354 HD12 ILE 42 HD12 ILE 42 3.522 7.905 -2.632 355 HD13 ILE 42 HD13 ILE 42 3.786 6.182 -2.203 356 H PHE 43 H PHE 43 2.019 3.759 -6.764 357 HA PHE 43 HA PHE 43 4.481 2.429 -6.516 358 HB2 PHE 43 HB2 PHE 43 2.844 0.862 -6.550 359 HB3 PHE 43 HB3 PHE 43 1.804 1.799 -7.618 360 HD1 PHE 43 HD1 PHE 43 1.832 1.508 -10.006 361 HD2 PHE 43 HD2 PHE 43 4.685 -0.561 -7.554 362 HE1 PHE 43 HE1 PHE 43 2.473 0.104 -11.948 363 HE2 PHE 43 HE2 PHE 43 5.334 -1.973 -9.480 364 HZ PHE 43 HZ PHE 43 4.241 -1.630 -11.696 365 H ASP 44 H ASP 44 2.976 3.993 -9.313 366 HA ASP 44 HA ASP 44 4.768 2.898 -11.246 367 HB2 ASP 44 HB2 ASP 44 2.419 4.272 -11.366 368 HB3 ASP 44 HB3 ASP 44 3.552 5.531 -11.855 369 H ASP 45 H ASP 45 5.136 5.545 -9.029 370 HA ASP 45 HA ASP 45 7.444 6.797 -10.397 371 HB2 ASP 45 HB2 ASP 45 5.824 7.354 -7.888 372 HB3 ASP 45 HB3 ASP 45 7.465 7.975 -8.058 373 H LEU 46 H LEU 46 6.640 4.919 -7.614 374 HA LEU 46 HA LEU 46 9.069 4.591 -6.254 375 HB2 LEU 46 HB2 LEU 46 6.759 4.229 -5.364 376 HB3 LEU 46 HB3 LEU 46 6.554 2.899 -6.451 377 HG LEU 46 HG LEU 46 6.692 2.112 -4.285 378 HD11 LEU 46 HD11 LEU 46 7.732 0.716 -6.097 379 HD12 LEU 46 HD12 LEU 46 9.326 1.183 -5.440 380 HD13 LEU 46 HD13 LEU 46 8.172 0.317 -4.432 381 HD21 LEU 46 HD21 LEU 46 9.389 2.431 -3.410 382 HD22 LEU 46 HD22 LEU 46 8.721 4.026 -3.751 383 HD23 LEU 46 HD23 LEU 46 7.894 2.939 -2.650 384 H ILE 47 H ILE 47 7.433 2.449 -8.578 385 HA ILE 47 HA ILE 47 9.133 0.255 -8.419 386 HB ILE 47 HB ILE 47 6.913 0.461 -9.514 387 HG12 ILE 47 HG12 ILE 47 8.554 -1.488 -9.801 388 HG13 ILE 47 HG13 ILE 47 7.093 -1.368 -10.772 389 HG21 ILE 47 HG21 ILE 47 7.307 2.462 -10.891 390 HG22 ILE 47 HG22 ILE 47 8.450 1.589 -11.912 391 HG23 ILE 47 HG23 ILE 47 6.727 1.117 -11.879 392 HD11 ILE 47 HD11 ILE 47 9.191 -2.057 -12.016 393 HD12 ILE 47 HD12 ILE 47 8.256 -0.716 -12.717 394 HD13 ILE 47 HD13 ILE 47 9.713 -0.386 -11.844 395 H ASP 48 H ASP 48 9.657 3.344 -10.122 396 HA ASP 48 HA ASP 48 11.552 2.549 -12.020 397 HB2 ASP 48 HB2 ASP 48 10.540 4.826 -11.709 398 HB3 ASP 48 HB3 ASP 48 11.615 5.107 -10.352 399 H PHE 49 H PHE 49 11.979 3.416 -8.673 400 HA PHE 49 HA PHE 49 14.788 3.223 -8.396 401 HB2 PHE 49 HB2 PHE 49 12.817 4.054 -6.831 402 HB3 PHE 49 HB3 PHE 49 12.900 2.424 -6.171 403 HD1 PHE 49 HD1 PHE 49 14.219 5.780 -6.131 404 HD2 PHE 49 HD2 PHE 49 15.187 1.703 -5.128 405 HE1 PHE 49 HE1 PHE 49 15.995 6.575 -4.646 406 HE2 PHE 49 HE2 PHE 49 16.916 2.502 -3.556 407 HZ PHE 49 HZ PHE 49 17.355 4.931 -3.314 408 H TYR 50 H TYR 50 12.332 0.695 -8.464 409 HA TYR 50 HA TYR 50 14.018 -1.444 -7.402 410 HB2 TYR 50 HB2 TYR 50 11.890 -1.978 -6.930 411 HB3 TYR 50 HB3 TYR 50 11.204 -1.157 -8.311 412 HD1 TYR 50 HD1 TYR 50 12.501 -4.321 -7.016 413 HD2 TYR 50 HD2 TYR 50 11.214 -2.227 -10.557 414 HE1 TYR 50 HE1 TYR 50 12.235 -6.459 -8.170 415 HE2 TYR 50 HE2 TYR 50 11.000 -4.385 -11.767 416 HH TYR 50 HH TYR 50 11.501 -7.491 -10.046 417 H GLU 51 H GLU 51 13.256 -0.035 -10.577 418 HA GLU 51 HA GLU 51 14.418 -2.317 -11.997 419 HB2 GLU 51 HB2 GLU 51 13.655 0.419 -13.040 420 HB3 GLU 51 HB3 GLU 51 14.097 -1.009 -14.024 421 HG2 GLU 51 HG2 GLU 51 12.193 -2.221 -12.677 422 HG3 GLU 51 HG3 GLU 51 11.725 -0.602 -12.217 423 H ARG 52 H ARG 52 15.628 0.283 -10.273 424 HA ARG 52 HA ARG 52 18.178 0.596 -11.670 425 HB2 ARG 52 HB2 ARG 52 16.763 1.877 -9.427 426 HB3 ARG 52 HB3 ARG 52 18.410 1.452 -8.957 427 HG2 ARG 52 HG2 ARG 52 18.412 3.672 -9.801 428 HG3 ARG 52 HG3 ARG 52 19.279 2.618 -10.922 429 HD2 ARG 52 HD2 ARG 52 17.150 2.530 -12.336 430 HD3 ARG 52 HD3 ARG 52 16.439 3.717 -11.226 431 HE ARG 52 HE ARG 52 19.030 4.164 -12.630 432 HH11 ARG 52 HH11 ARG 52 15.625 5.294 -12.251 433 HH12 ARG 52 HH12 ARG 52 15.981 6.871 -12.793 434 HH21 ARG 52 HH21 ARG 52 19.498 6.273 -13.115 435 HH22 ARG 52 HH22 ARG 52 18.260 7.461 -13.388 436 H LEU 53 H LEU 53 16.832 -1.866 -9.498 437 HA LEU 53 HA LEU 53 19.345 -2.587 -8.289 438 HB2 LEU 53 HB2 LEU 53 16.890 -4.308 -8.816 439 HB3 LEU 53 HB3 LEU 53 18.084 -4.525 -7.542 440 HG LEU 53 HG LEU 53 16.116 -2.192 -7.680 441 HD11 LEU 53 HD11 LEU 53 14.794 -3.395 -6.035 442 HD12 LEU 53 HD12 LEU 53 14.965 -4.345 -7.507 443 HD13 LEU 53 HD13 LEU 53 15.942 -4.768 -6.091 444 HD21 LEU 53 HD21 LEU 53 18.053 -1.582 -6.487 445 HD22 LEU 53 HD22 LEU 53 16.673 -1.726 -5.419 446 HD23 LEU 53 HD23 LEU 53 17.930 -3.010 -5.439 447 H ASP 54 H ASP 54 20.885 -3.818 -9.179 448 HA ASP 54 HA ASP 54 20.619 -4.667 -11.969 449 HB2 ASP 54 HB2 ASP 54 22.722 -3.767 -11.253 450 HB3 ASP 54 HB3 ASP 54 22.784 -4.807 -9.838 451 H THR 55 H THR 55 20.168 -5.955 -8.817 452 HA THR 55 HA THR 55 19.548 -8.666 -9.865 453 HB THR 55 HB THR 55 20.475 -9.274 -7.445 454 HG1 THR 55 HG1 THR 55 22.513 -7.510 -7.985 455 HG21 THR 55 HG21 THR 55 22.325 -8.703 -9.803 456 HG22 THR 55 HG22 THR 55 22.647 -9.831 -8.464 457 HG23 THR 55 HG23 THR 55 21.325 -10.148 -9.603 458 HA PRO 56 HA PRO 56 15.990 -6.650 -7.785 459 HB2 PRO 56 HB2 PRO 56 14.107 -7.497 -9.626 460 HB3 PRO 56 HB3 PRO 56 14.989 -5.938 -9.711 461 HG2 PRO 56 HG2 PRO 56 15.528 -8.534 -11.159 462 HG3 PRO 56 HG3 PRO 56 15.602 -6.858 -11.794 463 HD2 PRO 56 HD2 PRO 56 17.830 -8.235 -11.042 464 HD3 PRO 56 HD3 PRO 56 17.683 -6.474 -10.797 465 HA PRO 57 HA PRO 57 15.368 -10.810 -6.135 466 HB2 PRO 57 HB2 PRO 57 13.834 -10.219 -3.928 467 HB3 PRO 57 HB3 PRO 57 15.595 -9.924 -4.035 468 HG2 PRO 57 HG2 PRO 57 13.333 -7.954 -4.446 469 HG3 PRO 57 HG3 PRO 57 14.853 -7.723 -3.525 470 HD2 PRO 57 HD2 PRO 57 14.491 -6.832 -6.106 471 HD3 PRO 57 HD3 PRO 57 16.086 -7.354 -5.478 472 H PHE 58 H PHE 58 12.436 -8.680 -6.061 473 HA PHE 58 HA PHE 58 10.781 -10.971 -6.959 474 HB2 PHE 58 HB2 PHE 58 10.425 -8.840 -4.983 475 HB3 PHE 58 HB3 PHE 58 9.125 -8.821 -6.150 476 HD1 PHE 58 HD1 PHE 58 7.733 -10.856 -6.586 477 HD2 PHE 58 HD2 PHE 58 10.570 -10.654 -3.331 478 HE1 PHE 58 HE1 PHE 58 6.694 -12.820 -5.551 479 HE2 PHE 58 HE2 PHE 58 9.509 -12.642 -2.296 480 HZ PHE 58 HZ PHE 58 7.581 -13.760 -3.444 481 H SER 59 H SER 59 8.729 -10.072 -8.145 482 HA SER 59 HA SER 59 9.625 -8.738 -10.642 483 HB2 SER 59 HB2 SER 59 7.292 -10.552 -9.908 484 HB3 SER 59 HB3 SER 59 7.433 -9.697 -11.443 485 HG SER 59 HG SER 59 9.765 -10.831 -11.190 486 H LYS 60 H LYS 60 8.846 -6.702 -11.151 487 HA LYS 60 HA LYS 60 7.572 -5.103 -9.226 488 HB2 LYS 60 HB2 LYS 60 7.015 -3.550 -11.121 489 HB3 LYS 60 HB3 LYS 60 8.689 -3.936 -10.831 490 HG2 LYS 60 HG2 LYS 60 8.898 -4.255 -13.013 491 HG3 LYS 60 HG3 LYS 60 8.071 -5.764 -12.818 492 HD2 LYS 60 HD2 LYS 60 6.983 -4.701 -14.592 493 HD3 LYS 60 HD3 LYS 60 5.879 -4.437 -13.239 494 HE2 LYS 60 HE2 LYS 60 6.787 -2.160 -12.922 495 HE3 LYS 60 HE3 LYS 60 8.039 -2.467 -14.130 496 HZ1 LYS 60 HZ1 LYS 60 6.313 -2.594 -15.805 497 HZ2 LYS 60 HZ2 LYS 60 5.149 -2.194 -14.701 498 HZ3 LYS 60 HZ3 LYS 60 6.337 -1.150 -15.115 499 H LYS 61 H LYS 61 6.008 -7.118 -11.671 500 HA LYS 61 HA LYS 61 3.392 -6.083 -11.391 501 HB2 LYS 61 HB2 LYS 61 4.172 -7.690 -13.106 502 HB3 LYS 61 HB3 LYS 61 4.356 -8.940 -11.866 503 HG2 LYS 61 HG2 LYS 61 1.899 -8.762 -11.400 504 HG3 LYS 61 HG3 LYS 61 1.746 -7.614 -12.742 505 HD2 LYS 61 HD2 LYS 61 2.830 -10.460 -12.932 506 HD3 LYS 61 HD3 LYS 61 1.189 -10.021 -13.306 507 HE2 LYS 61 HE2 LYS 61 3.645 -8.961 -14.785 508 HE3 LYS 61 HE3 LYS 61 2.626 -10.302 -15.302 509 HZ1 LYS 61 HZ1 LYS 61 1.947 -7.458 -15.261 510 HZ2 LYS 61 HZ2 LYS 61 1.765 -8.565 -16.443 511 HZ3 LYS 61 HZ3 LYS 61 0.750 -8.616 -15.161 512 H SER 62 H SER 62 5.162 -8.546 -9.390 513 HA SER 62 HA SER 62 2.987 -9.141 -7.664 514 HB2 SER 62 HB2 SER 62 5.948 -9.421 -7.068 515 HB3 SER 62 HB3 SER 62 4.610 -10.419 -6.476 516 HG SER 62 HG SER 62 4.295 -11.139 -8.648 517 H LEU 63 H LEU 63 5.780 -6.844 -7.453 518 HA LEU 63 HA LEU 63 5.382 -5.917 -4.828 519 HB2 LEU 63 HB2 LEU 63 7.364 -5.415 -6.019 520 HB3 LEU 63 HB3 LEU 63 6.513 -4.540 -7.275 521 HG LEU 63 HG LEU 63 6.038 -3.371 -4.611 522 HD11 LEU 63 HD11 LEU 63 8.306 -2.312 -4.399 523 HD12 LEU 63 HD12 LEU 63 8.301 -4.033 -4.025 524 HD13 LEU 63 HD13 LEU 63 8.928 -3.465 -5.579 525 HD21 LEU 63 HD21 LEU 63 7.387 -2.053 -7.033 526 HD22 LEU 63 HD22 LEU 63 5.634 -2.332 -6.890 527 HD23 LEU 63 HD23 LEU 63 6.488 -1.315 -5.698 528 H ARG 64 H ARG 64 3.950 -4.674 -7.847 529 HA ARG 64 HA ARG 64 2.316 -2.695 -6.689 530 HB2 ARG 64 HB2 ARG 64 2.779 -2.909 -9.101 531 HB3 ARG 64 HB3 ARG 64 1.978 -4.452 -9.173 532 HG2 ARG 64 HG2 ARG 64 0.748 -2.643 -10.235 533 HG3 ARG 64 HG3 ARG 64 -0.199 -3.466 -9.002 534 HD2 ARG 64 HD2 ARG 64 -0.267 -1.603 -7.622 535 HD3 ARG 64 HD3 ARG 64 1.278 -0.991 -8.184 536 HE ARG 64 HE ARG 64 -0.258 -0.802 -10.424 537 HH11 ARG 64 HH11 ARG 64 -0.465 0.608 -7.184 538 HH12 ARG 64 HH12 ARG 64 -1.592 1.845 -7.614 539 HH21 ARG 64 HH21 ARG 64 -1.349 0.997 -11.101 540 HH22 ARG 64 HH22 ARG 64 -1.934 2.206 -10.018 541 H GLU 65 H GLU 65 1.634 -6.183 -7.142 542 HA GLU 65 HA GLU 65 -1.136 -5.945 -6.422 543 HB2 GLU 65 HB2 GLU 65 -0.039 -7.817 -7.774 544 HB3 GLU 65 HB3 GLU 65 0.601 -8.423 -6.247 545 HG2 GLU 65 HG2 GLU 65 -1.938 -8.268 -5.460 546 HG3 GLU 65 HG3 GLU 65 -2.265 -8.211 -7.176 547 H ALA 66 H ALA 66 1.799 -6.965 -4.553 548 HA ALA 66 HA ALA 66 0.360 -7.594 -2.180 549 HB1 ALA 66 HB1 ALA 66 3.210 -6.594 -2.408 550 HB2 ALA 66 HB2 ALA 66 2.486 -7.489 -1.052 551 HB3 ALA 66 HB3 ALA 66 2.716 -8.296 -2.609 552 H LEU 67 H LEU 67 1.794 -4.491 -3.287 553 HA LEU 67 HA LEU 67 1.343 -2.932 -0.995 554 HB2 LEU 67 HB2 LEU 67 2.423 -2.569 -3.470 555 HB3 LEU 67 HB3 LEU 67 0.931 -1.692 -3.706 556 HG LEU 67 HG LEU 67 2.922 -1.188 -1.437 557 HD11 LEU 67 HD11 LEU 67 2.693 0.301 -4.112 558 HD12 LEU 67 HD12 LEU 67 3.817 0.655 -2.788 559 HD13 LEU 67 HD13 LEU 67 3.964 -0.855 -3.689 560 HD21 LEU 67 HD21 LEU 67 1.889 1.073 -1.346 561 HD22 LEU 67 HD22 LEU 67 0.690 0.587 -2.575 562 HD23 LEU 67 HD23 LEU 67 0.718 -0.192 -0.978 563 H SER 68 H SER 68 -0.954 -4.142 -3.409 564 HA SER 68 HA SER 68 -3.037 -2.264 -2.799 565 HB2 SER 68 HB2 SER 68 -2.753 -3.881 -4.876 566 HB3 SER 68 HB3 SER 68 -3.623 -5.038 -3.855 567 HG SER 68 HG SER 68 -4.864 -2.676 -3.676 568 H TYR 69 H TYR 69 -1.995 -5.315 -1.287 569 HA TYR 69 HA TYR 69 -4.448 -5.738 0.165 570 HB2 TYR 69 HB2 TYR 69 -1.840 -7.008 0.022 571 HB3 TYR 69 HB3 TYR 69 -2.298 -6.778 1.697 572 HD1 TYR 69 HD1 TYR 69 -3.644 -8.421 2.724 573 HD2 TYR 69 HD2 TYR 69 -3.806 -7.953 -1.569 574 HE1 TYR 69 HE1 TYR 69 -5.016 -10.445 2.568 575 HE2 TYR 69 HE2 TYR 69 -5.217 -9.975 -1.726 576 HH TYR 69 HH TYR 69 -6.163 -11.896 1.177 577 H TYR 70 H TYR 70 -1.382 -4.037 0.956 578 HA TYR 70 HA TYR 70 -2.138 -3.215 3.595 579 HB2 TYR 70 HB2 TYR 70 -0.025 -2.550 1.595 580 HB3 TYR 70 HB3 TYR 70 -0.490 -1.218 2.633 581 HD1 TYR 70 HD1 TYR 70 -0.177 -4.911 3.441 582 HD2 TYR 70 HD2 TYR 70 1.208 -0.889 4.133 583 HE1 TYR 70 HE1 TYR 70 1.222 -5.723 5.292 584 HE2 TYR 70 HE2 TYR 70 2.604 -1.688 6.013 585 HH TYR 70 HH TYR 70 3.064 -5.116 6.819 586 H SER 71 H SER 71 -2.511 -1.717 0.393 587 HA SER 71 HA SER 71 -3.818 0.655 1.337 588 HB2 SER 71 HB2 SER 71 -3.932 -0.622 -1.406 589 HB3 SER 71 HB3 SER 71 -4.252 1.081 -0.988 590 HG SER 71 HG SER 71 -1.792 -0.353 -0.968 591 H ALA 72 H ALA 72 -4.957 -2.481 1.442 592 HA ALA 72 HA ALA 72 -7.809 -1.717 1.358 593 HB1 ALA 72 HB1 ALA 72 -6.610 -4.437 0.713 594 HB2 ALA 72 HB2 ALA 72 -8.321 -3.962 0.626 595 HB3 ALA 72 HB3 ALA 72 -7.150 -3.264 -0.504 596 H SER 73 H SER 73 -5.439 -1.821 3.450 597 HA SER 73 HA SER 73 -6.175 -3.930 5.277 598 HB2 SER 73 HB2 SER 73 -4.803 -2.661 6.933 599 HB3 SER 73 HB3 SER 73 -3.977 -2.997 5.409 600 HG SER 73 HG SER 73 -4.198 -0.924 4.793 601 HA PRO 74 HA PRO 74 -9.809 -2.280 6.991 602 HB2 PRO 74 HB2 PRO 74 -9.578 -2.721 9.737 603 HB3 PRO 74 HB3 PRO 74 -10.091 -3.931 8.508 604 HG2 PRO 74 HG2 PRO 74 -7.430 -3.530 9.832 605 HG3 PRO 74 HG3 PRO 74 -8.204 -5.070 9.355 606 HD2 PRO 74 HD2 PRO 74 -6.183 -3.847 7.932 607 HD3 PRO 74 HD3 PRO 74 -7.424 -4.875 7.162 608 H ALA 75 H ALA 75 -6.987 -1.416 9.071 609 HA ALA 75 HA ALA 75 -8.022 0.970 10.049 610 HB1 ALA 75 HB1 ALA 75 -6.113 -0.168 10.988 611 HB2 ALA 75 HB2 ALA 75 -5.144 0.149 9.520 612 HB3 ALA 75 HB3 ALA 75 -5.670 1.505 10.554 613 H TYR 76 H TYR 76 -6.251 0.482 6.917 614 HA TYR 76 HA TYR 76 -5.825 3.245 6.375 615 HB2 TYR 76 HB2 TYR 76 -4.859 1.413 4.925 616 HB3 TYR 76 HB3 TYR 76 -6.461 0.994 4.381 617 HD1 TYR 76 HD1 TYR 76 -3.539 2.812 3.585 618 HD2 TYR 76 HD2 TYR 76 -7.817 2.989 3.143 619 HE1 TYR 76 HE1 TYR 76 -3.310 4.527 1.802 620 HE2 TYR 76 HE2 TYR 76 -7.615 4.755 1.492 621 HH TYR 76 HH TYR 76 -6.200 6.065 0.280 622 H LEU 77 H LEU 77 -8.512 1.088 5.449 623 HA LEU 77 HA LEU 77 -10.037 3.178 4.211 624 HB2 LEU 77 HB2 LEU 77 -11.027 0.488 5.198 625 HB3 LEU 77 HB3 LEU 77 -11.778 1.490 3.981 626 HG LEU 77 HG LEU 77 -8.958 0.389 3.577 627 HD11 LEU 77 HD11 LEU 77 -10.342 -1.488 4.170 628 HD12 LEU 77 HD12 LEU 77 -11.548 -1.000 2.969 629 HD13 LEU 77 HD13 LEU 77 -9.940 -1.548 2.445 630 HD21 LEU 77 HD21 LEU 77 -9.436 0.548 1.229 631 HD22 LEU 77 HD22 LEU 77 -11.047 1.205 1.572 632 HD23 LEU 77 HD23 LEU 77 -9.593 2.124 2.016 633 H SER 78 H SER 78 -10.368 1.531 7.382 634 HA SER 78 HA SER 78 -12.650 2.936 8.194 635 HB2 SER 78 HB2 SER 78 -11.341 0.865 9.138 636 HB3 SER 78 HB3 SER 78 -10.567 2.060 10.200 637 HG SER 78 HG SER 78 -12.408 1.147 11.125 638 H CYS 79 H CYS 79 -9.301 4.171 8.132 639 HA CYS 79 HA CYS 79 -10.059 6.355 9.952 640 HB2 CYS 79 HB2 CYS 79 -7.861 6.984 10.009 641 HB3 CYS 79 HB3 CYS 79 -7.894 5.209 10.069 642 HG CYS 79 HG CYS 79 -7.378 7.081 7.378 643 H GLN 80 H GLN 80 -10.706 5.771 6.756 644 HA GLN 80 HA GLN 80 -10.382 7.562 5.008 645 HB2 GLN 80 HB2 GLN 80 -12.865 7.647 4.546 646 HB3 GLN 80 HB3 GLN 80 -12.099 6.074 4.651 647 HG2 GLN 80 HG2 GLN 80 -13.019 6.075 7.139 648 HG3 GLN 80 HG3 GLN 80 -14.022 7.414 6.587 649 HE21 GLN 80 HE21 GLN 80 -15.632 5.716 7.386 650 HE22 GLN 80 HE22 GLN 80 -16.106 4.414 6.298 651 H LYS 81 H LYS 81 -9.522 9.556 5.454 652 HA LYS 81 HA LYS 81 -11.493 11.553 6.350 653 HB2 LYS 81 HB2 LYS 81 -9.763 12.793 7.582 654 HB3 LYS 81 HB3 LYS 81 -10.321 11.273 8.291 655 HG2 LYS 81 HG2 LYS 81 -8.349 10.126 7.320 656 HG3 LYS 81 HG3 LYS 81 -7.786 11.716 6.730 657 HD2 LYS 81 HD2 LYS 81 -7.439 12.484 9.000 658 HD3 LYS 81 HD3 LYS 81 -8.294 11.076 9.674 659 HE2 LYS 81 HE2 LYS 81 -6.581 9.547 8.852 660 HE3 LYS 81 HE3 LYS 81 -5.760 10.868 8.011 661 HZ1 LYS 81 HZ1 LYS 81 -6.022 10.703 10.949 662 HZ2 LYS 81 HZ2 LYS 81 -4.670 10.341 10.102 663 HZ3 LYS 81 HZ3 LYS 81 -5.234 11.870 10.075 664 HA PRO 82 HA PRO 82 -10.043 13.209 2.371 665 HB2 PRO 82 HB2 PRO 82 -11.920 15.187 2.133 666 HB3 PRO 82 HB3 PRO 82 -12.272 13.456 1.907 667 HG2 PRO 82 HG2 PRO 82 -12.794 15.152 4.360 668 HG3 PRO 82 HG3 PRO 82 -13.872 13.945 3.614 669 HD2 PRO 82 HD2 PRO 82 -12.158 13.437 5.791 670 HD3 PRO 82 HD3 PRO 82 -12.742 12.180 4.669 671 H ASP 83 H ASP 83 -9.667 15.688 1.697 672 HA ASP 83 HA ASP 83 -8.000 17.270 1.901 673 HB2 ASP 83 HB2 ASP 83 -10.161 18.378 2.551 674 HB3 ASP 83 HB3 ASP 83 -9.555 18.379 4.211 675 H THR 84 H THR 84 -6.518 15.556 2.507 676 HA THR 84 HA THR 84 -5.324 16.093 5.164 677 HB THR 84 HB THR 84 -6.885 14.101 5.061 678 HG1 THR 84 HG1 THR 84 -5.240 14.349 6.614 679 HG21 THR 84 HG21 THR 84 -4.626 12.808 3.477 680 HG22 THR 84 HG22 THR 84 -6.115 12.030 4.074 681 HG23 THR 84 HG23 THR 84 -6.215 13.267 2.810 682 H ALA 85 H ALA 85 -4.786 16.007 1.870 683 HA ALA 85 HA ALA 85 -2.984 16.235 0.519 684 HB1 ALA 85 HB1 ALA 85 -2.513 18.083 1.926 685 HB2 ALA 85 HB2 ALA 85 -1.526 17.057 3.006 686 HB3 ALA 85 HB3 ALA 85 -1.025 17.324 1.324 687 H ARG 86 H ARG 86 -2.499 14.482 -0.501 688 HA ARG 86 HA ARG 86 -1.256 12.207 0.925 689 HB2 ARG 86 HB2 ARG 86 -1.819 12.562 -2.060 690 HB3 ARG 86 HB3 ARG 86 -1.336 11.084 -1.242 691 HG2 ARG 86 HG2 ARG 86 -3.457 11.273 0.122 692 HG3 ARG 86 HG3 ARG 86 -3.954 12.627 -0.889 693 HD2 ARG 86 HD2 ARG 86 -3.276 9.887 -2.013 694 HD3 ARG 86 HD3 ARG 86 -4.876 10.318 -1.464 695 HE ARG 86 HE ARG 86 -3.662 12.134 -3.433 696 HH11 ARG 86 HH11 ARG 86 -5.775 9.251 -3.110 697 HH12 ARG 86 HH12 ARG 86 -6.814 9.794 -4.413 698 HH21 ARG 86 HH21 ARG 86 -4.803 12.533 -5.355 699 HH22 ARG 86 HH22 ARG 86 -5.969 11.390 -5.918 700 H VAL 87 H VAL 87 0.907 11.342 -0.036 701 HA VAL 87 HA VAL 87 2.635 13.448 -1.061 702 HB VAL 87 HB VAL 87 4.434 12.932 0.518 703 HG11 VAL 87 HG11 VAL 87 1.946 13.935 1.962 704 HG12 VAL 87 HG12 VAL 87 3.645 14.237 2.396 705 HG13 VAL 87 HG13 VAL 87 2.994 14.892 0.892 706 HG21 VAL 87 HG21 VAL 87 2.363 11.374 2.119 707 HG22 VAL 87 HG22 VAL 87 3.787 10.699 1.282 708 HG23 VAL 87 HG23 VAL 87 4.009 11.803 2.646 709 H ASP 88 H ASP 88 4.693 12.562 -1.965 710 HA ASP 88 HA ASP 88 4.232 9.990 -3.312 711 HB2 ASP 88 HB2 ASP 88 4.437 12.006 -4.620 712 HB3 ASP 88 HB3 ASP 88 5.902 12.483 -3.755 713 H ILE 89 H ILE 89 6.634 9.101 -3.965 714 HA ILE 89 HA ILE 89 7.754 7.945 -1.631 715 HB ILE 89 HB ILE 89 9.526 7.109 -3.191 716 HG12 ILE 89 HG12 ILE 89 8.428 9.089 -5.205 717 HG13 ILE 89 HG13 ILE 89 10.051 9.034 -4.508 718 HG21 ILE 89 HG21 ILE 89 6.822 7.104 -4.589 719 HG22 ILE 89 HG22 ILE 89 8.087 5.890 -4.670 720 HG23 ILE 89 HG23 ILE 89 7.211 6.111 -3.150 721 HD11 ILE 89 HD11 ILE 89 10.372 6.811 -5.659 722 HD12 ILE 89 HD12 ILE 89 8.825 7.088 -6.469 723 HD13 ILE 89 HD13 ILE 89 10.165 8.204 -6.737 724 H TYR 90 H TYR 90 8.592 10.880 -3.474 725 HA TYR 90 HA TYR 90 11.023 11.383 -1.895 726 HB2 TYR 90 HB2 TYR 90 9.449 12.931 -3.973 727 HB3 TYR 90 HB3 TYR 90 10.896 13.561 -3.204 728 HD1 TYR 90 HD1 TYR 90 13.134 12.600 -3.674 729 HD2 TYR 90 HD2 TYR 90 9.607 11.349 -5.817 730 HE1 TYR 90 HE1 TYR 90 14.537 11.802 -5.533 731 HE2 TYR 90 HE2 TYR 90 10.998 10.519 -7.662 732 HH TYR 90 HH TYR 90 14.270 11.414 -8.020 733 H GLY 91 H GLY 91 7.788 11.579 -1.065 734 HA2 GLY 91 HA2 GLY 91 6.779 12.602 0.727 735 HA3 GLY 91 HA3 GLY 91 8.269 13.502 1.052 736 H ASN 92 H ASN 92 7.294 13.833 -2.268 737 HA ASN 92 HA ASN 92 6.948 16.591 -2.205 738 HB2 ASN 92 HB2 ASN 92 5.548 14.742 -4.189 739 HB3 ASN 92 HB3 ASN 92 6.010 16.412 -4.430 740 HD21 ASN 92 HD21 ASN 92 6.690 14.094 -6.126 741 HD22 ASN 92 HD22 ASN 92 8.413 13.870 -5.976 742 H GLU 93 H GLU 93 5.206 17.911 -1.759 743 HA GLU 93 HA GLU 93 2.865 16.732 -0.546 744 HB2 GLU 93 HB2 GLU 93 4.081 19.427 -0.922 745 HB3 GLU 93 HB3 GLU 93 2.331 19.452 -1.054 746 HG2 GLU 93 HG2 GLU 93 1.965 18.699 1.130 747 HG3 GLU 93 HG3 GLU 93 3.602 18.030 1.278 748 H VAL 94 H VAL 94 1.191 15.905 -1.743 749 HA VAL 94 HA VAL 94 0.665 17.099 -4.396 750 HB VAL 94 HB VAL 94 -0.127 15.030 -5.216 751 HG11 VAL 94 HG11 VAL 94 2.347 15.599 -5.372 752 HG12 VAL 94 HG12 VAL 94 2.637 14.505 -4.027 753 HG13 VAL 94 HG13 VAL 94 1.940 13.897 -5.550 754 HG21 VAL 94 HG21 VAL 94 -0.727 14.119 -2.893 755 HG22 VAL 94 HG22 VAL 94 -0.145 12.980 -4.131 756 HG23 VAL 94 HG23 VAL 94 0.948 13.522 -2.836 757 H ASP 95 H ASP 95 -1.861 16.462 -4.930 758 HA ASP 95 HA ASP 95 -3.206 18.208 -3.063 759 HB2 ASP 95 HB2 ASP 95 -3.561 18.232 -5.491 760 HB3 ASP 95 HB3 ASP 95 -4.181 16.587 -5.439 761 H VAL 96 H VAL 96 -5.718 17.355 -2.606 762 HA VAL 96 HA VAL 96 -5.268 15.070 -0.770 763 HB VAL 96 HB VAL 96 -6.851 16.159 0.580 764 HG11 VAL 96 HG11 VAL 96 -4.672 17.501 0.446 765 HG12 VAL 96 HG12 VAL 96 -5.476 18.568 -0.698 766 HG13 VAL 96 HG13 VAL 96 -6.093 18.425 0.939 767 HG21 VAL 96 HG21 VAL 96 -7.651 17.883 -1.819 768 HG22 VAL 96 HG22 VAL 96 -8.676 16.719 -0.959 769 HG23 VAL 96 HG23 VAL 96 -8.180 18.207 -0.169 770 H VAL 97 H VAL 97 -7.165 13.919 -0.066 771 HA VAL 97 HA VAL 97 -8.552 12.714 -2.375 772 HB VAL 97 HB VAL 97 -8.861 11.989 0.580 773 HG11 VAL 97 HG11 VAL 97 -9.584 9.796 -0.339 774 HG12 VAL 97 HG12 VAL 97 -10.618 11.097 -0.932 775 HG13 VAL 97 HG13 VAL 97 -9.379 10.411 -1.991 776 HG21 VAL 97 HG21 VAL 97 -6.480 11.734 0.003 777 HG22 VAL 97 HG22 VAL 97 -7.251 10.152 0.153 778 HG23 VAL 97 HG23 VAL 97 -6.947 10.831 -1.459 779 H THR 98 H THR 98 -10.669 13.248 -2.944 780 HA THR 98 HA THR 98 -11.907 15.486 -1.642 781 HB THR 98 HB THR 98 -13.707 15.129 -3.259 782 HG1 THR 98 HG1 THR 98 -13.689 13.392 -4.635 783 HG21 THR 98 HG21 THR 98 -11.613 16.190 -4.066 784 HG22 THR 98 HG22 THR 98 -11.046 14.606 -4.633 785 HG23 THR 98 HG23 THR 98 -12.496 15.337 -5.340 786 HA PRO 99 HA PRO 99 -14.314 13.633 1.523 787 HB2 PRO 99 HB2 PRO 99 -16.897 14.595 1.229 788 HB3 PRO 99 HB3 PRO 99 -15.497 15.494 1.911 789 HG2 PRO 99 HG2 PRO 99 -16.522 15.519 -0.942 790 HG3 PRO 99 HG3 PRO 99 -16.142 16.918 0.117 791 HD2 PRO 99 HD2 PRO 99 -14.348 16.125 -1.662 792 HD3 PRO 99 HD3 PRO 99 -13.808 16.487 -0.005 793 H GLU 100 H GLU 100 -15.987 13.257 -1.647 794 HA GLU 100 HA GLU 100 -17.471 10.969 -0.653 795 HB2 GLU 100 HB2 GLU 100 -17.044 12.088 -3.436 796 HB3 GLU 100 HB3 GLU 100 -17.881 10.554 -3.115 797 HG2 GLU 100 HG2 GLU 100 -19.326 11.864 -1.413 798 HG3 GLU 100 HG3 GLU 100 -18.651 13.334 -2.125 799 H GLN 101 H GLN 101 -14.487 11.358 -2.677 800 HA GLN 101 HA GLN 101 -14.155 8.543 -3.013 801 HB2 GLN 101 HB2 GLN 101 -12.117 10.798 -3.145 802 HB3 GLN 101 HB3 GLN 101 -11.832 9.110 -3.629 803 HG2 GLN 101 HG2 GLN 101 -13.611 9.220 -5.308 804 HG3 GLN 101 HG3 GLN 101 -14.023 10.860 -4.827 805 HE21 GLN 101 HE21 GLN 101 -13.331 12.326 -6.299 806 HE22 GLN 101 HE22 GLN 101 -11.776 12.314 -7.090 807 H ALA 102 H ALA 102 -13.245 10.746 -0.355 808 HA ALA 102 HA ALA 102 -11.488 8.891 0.943 809 HB1 ALA 102 HB1 ALA 102 -13.159 11.162 2.111 810 HB2 ALA 102 HB2 ALA 102 -11.853 10.296 2.949 811 HB3 ALA 102 HB3 ALA 102 -11.489 11.264 1.509 812 H LYS 103 H LYS 103 -14.995 9.632 1.534 813 HA LYS 103 HA LYS 103 -15.288 7.521 3.444 814 HB2 LYS 103 HB2 LYS 103 -17.614 7.970 3.459 815 HB3 LYS 103 HB3 LYS 103 -16.756 9.514 3.355 816 HG2 LYS 103 HG2 LYS 103 -17.245 9.604 0.922 817 HG3 LYS 103 HG3 LYS 103 -18.075 8.041 1.023 818 HD2 LYS 103 HD2 LYS 103 -19.745 9.712 0.961 819 HD3 LYS 103 HD3 LYS 103 -19.702 9.020 2.589 820 HE2 LYS 103 HE2 LYS 103 -18.267 11.020 3.280 821 HE3 LYS 103 HE3 LYS 103 -18.587 11.717 1.681 822 HZ1 LYS 103 HZ1 LYS 103 -20.584 10.990 3.735 823 HZ2 LYS 103 HZ2 LYS 103 -20.181 12.518 3.359 824 HZ3 LYS 103 HZ3 LYS 103 -20.984 11.558 2.258 825 H TYR 104 H TYR 104 -15.513 7.490 -0.034 826 HA TYR 104 HA TYR 104 -16.954 5.128 -0.417 827 HB2 TYR 104 HB2 TYR 104 -15.109 6.810 -2.040 828 HB3 TYR 104 HB3 TYR 104 -15.261 5.146 -2.544 829 HD1 TYR 104 HD1 TYR 104 -18.122 6.993 -0.934 830 HD2 TYR 104 HD2 TYR 104 -16.374 5.648 -4.645 831 HE1 TYR 104 HE1 TYR 104 -20.315 7.170 -2.017 832 HE2 TYR 104 HE2 TYR 104 -18.605 5.831 -5.732 833 HH TYR 104 HH TYR 104 -20.782 6.777 -5.482 834 H ALA 105 H ALA 105 -13.727 5.493 0.843 835 HA ALA 105 HA ALA 105 -12.584 2.993 0.260 836 HB1 ALA 105 HB1 ALA 105 -11.374 4.807 1.355 837 HB2 ALA 105 HB2 ALA 105 -12.501 4.751 2.748 838 HB3 ALA 105 HB3 ALA 105 -11.404 3.404 2.451 839 H TYR 106 H TYR 106 -15.168 3.871 2.590 840 HA TYR 106 HA TYR 106 -15.150 1.626 4.195 841 HB2 TYR 106 HB2 TYR 106 -17.039 2.408 5.038 842 HB3 TYR 106 HB3 TYR 106 -16.578 3.858 4.204 843 HD1 TYR 106 HD1 TYR 106 -17.547 3.626 1.445 844 HD2 TYR 106 HD2 TYR 106 -19.239 2.074 5.087 845 HE1 TYR 106 HE1 TYR 106 -19.846 3.696 0.434 846 HE2 TYR 106 HE2 TYR 106 -21.490 2.123 4.115 847 HH TYR 106 HH TYR 106 -22.210 2.981 0.745 848 H GLN 107 H GLN 107 -16.296 1.840 0.873 849 HA GLN 107 HA GLN 107 -18.043 -0.404 0.735 850 HB2 GLN 107 HB2 GLN 107 -16.143 0.774 -1.349 851 HB3 GLN 107 HB3 GLN 107 -17.408 -0.399 -1.699 852 HG2 GLN 107 HG2 GLN 107 -19.152 1.161 -1.108 853 HG3 GLN 107 HG3 GLN 107 -17.994 2.317 -0.464 854 HE21 GLN 107 HE21 GLN 107 -16.249 3.010 -2.105 855 HE22 GLN 107 HE22 GLN 107 -16.907 3.546 -3.640 856 H ARG 108 H ARG 108 -14.576 -0.035 0.142 857 HA ARG 108 HA ARG 108 -13.954 -2.762 -0.397 858 HB2 ARG 108 HB2 ARG 108 -12.087 -0.679 0.801 859 HB3 ARG 108 HB3 ARG 108 -11.648 -2.021 -0.236 860 HG2 ARG 108 HG2 ARG 108 -13.227 0.489 -1.072 861 HG3 ARG 108 HG3 ARG 108 -11.516 0.148 -1.372 862 HD2 ARG 108 HD2 ARG 108 -12.319 -2.022 -2.547 863 HD3 ARG 108 HD3 ARG 108 -13.916 -1.259 -2.561 864 HE ARG 108 HE ARG 108 -11.897 0.512 -3.612 865 HH11 ARG 108 HH11 ARG 108 -13.776 -2.386 -4.510 866 HH12 ARG 108 HH12 ARG 108 -13.754 -2.010 -6.206 867 HH21 ARG 108 HH21 ARG 108 -11.770 0.910 -5.840 868 HH22 ARG 108 HH22 ARG 108 -12.580 -0.114 -6.979 869 H TYR 109 H TYR 109 -14.193 -0.937 2.649 870 HA TYR 109 HA TYR 109 -12.928 -2.965 4.266 871 HB2 TYR 109 HB2 TYR 109 -13.082 -0.589 4.871 872 HB3 TYR 109 HB3 TYR 109 -14.799 -0.672 5.053 873 HD1 TYR 109 HD1 TYR 109 -15.760 -2.468 6.794 874 HD2 TYR 109 HD2 TYR 109 -11.730 -0.876 6.813 875 HE1 TYR 109 HE1 TYR 109 -15.490 -3.144 9.138 876 HE2 TYR 109 HE2 TYR 109 -11.512 -1.487 9.195 877 HH TYR 109 HH TYR 109 -14.133 -2.938 11.104 878 H GLN 110 H GLN 110 -16.394 -2.023 3.732 879 HA GLN 110 HA GLN 110 -17.388 -4.137 5.292 880 HB2 GLN 110 HB2 GLN 110 -19.586 -3.689 4.429 881 HB3 GLN 110 HB3 GLN 110 -18.747 -2.186 4.805 882 HG2 GLN 110 HG2 GLN 110 -18.267 -1.864 2.393 883 HG3 GLN 110 HG3 GLN 110 -19.089 -3.378 2.013 884 HE21 GLN 110 HE21 GLN 110 -20.343 -0.838 4.386 885 HE22 GLN 110 HE22 GLN 110 -21.671 -0.448 3.313 886 H GLU 111 H GLU 111 -16.307 -4.081 1.968 887 HA GLU 111 HA GLU 111 -17.630 -6.339 0.906 888 HB2 GLU 111 HB2 GLU 111 -15.109 -4.816 0.383 889 HB3 GLU 111 HB3 GLU 111 -15.022 -6.486 -0.124 890 HG2 GLU 111 HG2 GLU 111 -17.539 -5.195 -0.974 891 HG3 GLU 111 HG3 GLU 111 -16.112 -4.339 -1.538 892 H ARG 112 H ARG 112 -14.703 -6.233 2.959 893 HA ARG 112 HA ARG 112 -14.836 -9.223 3.163 894 HB2 ARG 112 HB2 ARG 112 -12.457 -7.355 3.539 895 HB3 ARG 112 HB3 ARG 112 -12.467 -9.084 3.932 896 HG2 ARG 112 HG2 ARG 112 -13.233 -9.551 1.552 897 HG3 ARG 112 HG3 ARG 112 -12.952 -7.832 1.193 898 HD2 ARG 112 HD2 ARG 112 -10.560 -8.125 1.849 899 HD3 ARG 112 HD3 ARG 112 -10.870 -9.849 2.133 900 HE ARG 112 HE ARG 112 -11.171 -8.391 -0.455 901 HH11 ARG 112 HH11 ARG 112 -10.399 -11.518 1.114 902 HH12 ARG 112 HH12 ARG 112 -10.668 -12.422 -0.344 903 HH21 ARG 112 HH21 ARG 112 -11.527 -9.568 -2.286 904 HH22 ARG 112 HH22 ARG 112 -11.300 -11.292 -2.326 905 H TYR 113 H TYR 113 -14.352 -6.305 5.115 906 HA TYR 113 HA TYR 113 -14.601 -7.797 7.613 907 HB2 TYR 113 HB2 TYR 113 -14.167 -4.852 7.310 908 HB3 TYR 113 HB3 TYR 113 -13.626 -5.905 8.596 909 HD1 TYR 113 HD1 TYR 113 -12.440 -3.831 6.259 910 HD2 TYR 113 HD2 TYR 113 -11.973 -7.961 7.338 911 HE1 TYR 113 HE1 TYR 113 -10.223 -3.825 5.184 912 HE2 TYR 113 HE2 TYR 113 -9.717 -7.969 6.309 913 HH TYR 113 HH TYR 113 -8.364 -5.039 4.701 914 H GLY 114 H GLY 114 -17.002 -7.416 5.796 915 HA2 GLY 114 HA2 GLY 114 -18.898 -6.473 7.771 916 HA3 GLY 114 HA3 GLY 114 -18.863 -5.551 6.249 917 H ASN 115 H ASN 115 -21.154 -6.517 6.142 918 HA ASN 115 HA ASN 115 -21.490 -9.353 5.737 919 HB2 ASN 115 HB2 ASN 115 -23.206 -6.975 4.966 920 HB3 ASN 115 HB3 ASN 115 -23.671 -8.644 4.634 921 HD21 ASN 115 HD21 ASN 115 -24.665 -6.380 6.576 922 HD22 ASN 115 HD22 ASN 115 -24.829 -7.259 8.100 923 H LYS 116 H LYS 116 -21.184 -10.537 3.945 924 HA LYS 116 HA LYS 116 -19.966 -9.348 1.608 925 HB2 LYS 116 HB2 LYS 116 -20.932 -12.196 1.633 926 HB3 LYS 116 HB3 LYS 116 -19.493 -11.476 0.890 927 HG2 LYS 116 HG2 LYS 116 -18.540 -11.229 3.231 928 HG3 LYS 116 HG3 LYS 116 -19.951 -12.149 3.793 929 HD2 LYS 116 HD2 LYS 116 -19.269 -13.986 2.121 930 HD3 LYS 116 HD3 LYS 116 -17.755 -13.099 1.931 931 HE2 LYS 116 HE2 LYS 116 -17.249 -14.658 3.614 932 HE3 LYS 116 HE3 LYS 116 -17.589 -13.173 4.525 933 HZ1 LYS 116 HZ1 LYS 116 -19.398 -15.481 4.120 934 HZ2 LYS 116 HZ2 LYS 116 -18.740 -14.960 5.550 935 HZ3 LYS 116 HZ3 LYS 116 -19.887 -14.084 4.818 936 H LYS 117 H LYS 117 -21.121 -11.067 -0.451 937 HA LYS 117 HA LYS 117 -23.710 -9.656 -0.909 938 HB2 LYS 117 HB2 LYS 117 -21.461 -9.406 -2.424 939 HB3 LYS 117 HB3 LYS 117 -22.095 -10.887 -3.129 940 HG2 LYS 117 HG2 LYS 117 -22.933 -9.138 -4.467 941 HG3 LYS 117 HG3 LYS 117 -24.297 -9.646 -3.472 942 HD2 LYS 117 HD2 LYS 117 -23.715 -7.693 -1.892 943 HD3 LYS 117 HD3 LYS 117 -22.498 -7.207 -3.083 944 HE2 LYS 117 HE2 LYS 117 -24.363 -7.103 -4.807 945 HE3 LYS 117 HE3 LYS 117 -25.507 -7.424 -3.503 946 HZ1 LYS 117 HZ1 LYS 117 -25.429 -5.146 -3.852 947 HZ2 LYS 117 HZ2 LYS 117 -24.638 -5.374 -2.419 948 HZ3 LYS 117 HZ3 LYS 117 -23.793 -5.049 -3.807 949 H SER 118 H SER 118 -25.439 -10.952 -1.872 950 HA SER 118 HA SER 118 -25.460 -13.709 -0.940 951 HB2 SER 118 HB2 SER 118 -27.385 -12.137 -0.743 952 HB3 SER 118 HB3 SER 118 -27.527 -12.103 -2.511 953 HG SER 118 HG SER 118 -28.599 -13.901 -2.375 954 H GLN 119 H GLN 119 -23.383 -13.853 -2.613 955 HA GLN 119 HA GLN 119 -24.436 -15.294 -4.966 956 HB2 GLN 119 HB2 GLN 119 -22.533 -12.926 -5.117 957 HB3 GLN 119 HB3 GLN 119 -22.628 -14.173 -6.357 958 HG2 GLN 119 HG2 GLN 119 -25.108 -13.677 -6.574 959 HG3 GLN 119 HG3 GLN 119 -24.867 -12.304 -5.481 960 HE21 GLN 119 HE21 GLN 119 -23.226 -13.673 -8.449 961 HE22 GLN 119 HE22 GLN 119 -23.175 -12.130 -9.264 962 H ASP 120 H ASP 120 -23.714 -17.271 -4.489 963 HA ASP 120 HA ASP 120 -20.931 -17.857 -4.689 964 HB2 ASP 120 HB2 ASP 120 -20.850 -17.470 -2.301 965 HB3 ASP 120 HB3 ASP 120 -22.287 -18.474 -2.032 966 H LEU 121 H LEU 121 -20.701 -19.918 -5.341 967 HA LEU 121 HA LEU 121 -22.556 -21.960 -5.107 968 HB2 LEU 121 HB2 LEU 121 -23.257 -22.330 -7.348 969 HB3 LEU 121 HB3 LEU 121 -23.798 -20.726 -6.903 970 HG LEU 121 HG LEU 121 -21.400 -21.375 -8.690 971 HD11 LEU 121 HD11 LEU 121 -23.516 -21.955 -9.740 972 HD12 LEU 121 HD12 LEU 121 -24.191 -20.357 -9.361 973 HD13 LEU 121 HD13 LEU 121 -22.833 -20.519 -10.501 974 HD21 LEU 121 HD21 LEU 121 -21.441 -18.981 -9.290 975 HD22 LEU 121 HD22 LEU 121 -22.704 -18.683 -8.057 976 HD23 LEU 121 HD23 LEU 121 -21.064 -19.187 -7.596 977 H LYS 122 H LYS 122 -21.306 -23.821 -5.430 978 HA LYS 122 HA LYS 122 -18.417 -23.392 -5.697 979 HB2 LYS 122 HB2 LYS 122 -20.229 -25.633 -4.878 980 HB3 LYS 122 HB3 LYS 122 -18.821 -26.114 -5.803 981 HG2 LYS 122 HG2 LYS 122 -18.151 -26.270 -3.579 982 HG3 LYS 122 HG3 LYS 122 -17.347 -24.854 -4.202 983 HD2 LYS 122 HD2 LYS 122 -19.793 -24.926 -2.402 984 HD3 LYS 122 HD3 LYS 122 -18.160 -24.602 -1.873 985 HE2 LYS 122 HE2 LYS 122 -19.779 -22.787 -3.712 986 HE3 LYS 122 HE3 LYS 122 -19.617 -22.592 -1.987 987 HZ1 LYS 122 HZ1 LYS 122 -17.368 -22.364 -3.882 988 HZ2 LYS 122 HZ2 LYS 122 -18.187 -21.151 -3.135 989 HZ3 LYS 122 HZ3 LYS 122 -17.288 -22.212 -2.241 Start of MODEL 4 1 H1 GLY 1 H GLY 1 20.860 -6.731 18.939 2 HA2 GLY 1 HA2 GLY 1 20.791 -4.502 17.797 3 HA3 GLY 1 HA3 GLY 1 21.917 -4.598 19.166 4 H SER 2 H SER 2 21.627 -3.725 15.939 5 HA SER 2 HA SER 2 24.287 -2.983 15.526 6 HB2 SER 2 HB2 SER 2 24.577 -4.472 13.439 7 HB3 SER 2 HB3 SER 2 24.975 -5.162 15.015 8 HG SER 2 HG SER 2 23.748 -6.578 13.714 9 H ASN 3 H ASN 3 23.840 -1.127 14.401 10 HA ASN 3 HA ASN 3 21.202 -0.926 13.110 11 HB2 ASN 3 HB2 ASN 3 23.283 1.120 13.883 12 HB3 ASN 3 HB3 ASN 3 22.002 1.509 12.733 13 HD21 ASN 3 HD21 ASN 3 22.452 2.462 15.651 14 HD22 ASN 3 HD22 ASN 3 20.943 2.026 16.442 15 H GLN 4 H GLN 4 21.301 -2.203 11.388 16 HA GLN 4 HA GLN 4 22.784 -1.284 9.044 17 HB2 GLN 4 HB2 GLN 4 23.031 -4.017 10.398 18 HB3 GLN 4 HB3 GLN 4 23.186 -3.890 8.661 19 HG2 GLN 4 HG2 GLN 4 25.293 -3.301 8.771 20 HG3 GLN 4 HG3 GLN 4 24.919 -1.899 9.758 21 HE21 GLN 4 HE21 GLN 4 26.387 -1.922 11.399 22 HE22 GLN 4 HE22 GLN 4 26.789 -3.324 12.406 23 H GLN 5 H GLN 5 21.979 -2.575 7.200 24 HA GLN 5 HA GLN 5 19.179 -2.425 6.849 25 HB2 GLN 5 HB2 GLN 5 19.759 -3.776 4.763 26 HB3 GLN 5 HB3 GLN 5 20.704 -2.302 4.975 27 HG2 GLN 5 HG2 GLN 5 22.639 -3.561 5.791 28 HG3 GLN 5 HG3 GLN 5 21.732 -5.060 5.810 29 HE21 GLN 5 HE21 GLN 5 20.959 -5.913 3.665 30 HE22 GLN 5 HE22 GLN 5 22.083 -5.703 2.336 31 H LEU 6 H LEU 6 17.614 -4.233 6.686 32 HA LEU 6 HA LEU 6 18.492 -6.916 7.514 33 HB2 LEU 6 HB2 LEU 6 17.699 -4.991 9.480 34 HB3 LEU 6 HB3 LEU 6 16.379 -6.131 9.389 35 HG LEU 6 HG LEU 6 19.265 -7.074 9.596 36 HD11 LEU 6 HD11 LEU 6 17.379 -6.427 11.891 37 HD12 LEU 6 HD12 LEU 6 18.971 -7.222 12.017 38 HD13 LEU 6 HD13 LEU 6 18.863 -5.548 11.452 39 HD21 LEU 6 HD21 LEU 6 16.595 -8.345 10.349 40 HD22 LEU 6 HD22 LEU 6 17.583 -8.753 8.924 41 HD23 LEU 6 HD23 LEU 6 18.198 -9.068 10.560 42 H ASN 7 H ASN 7 17.719 -7.213 5.277 43 HA ASN 7 HA ASN 7 14.948 -6.738 4.666 44 HB2 ASN 7 HB2 ASN 7 15.289 -8.011 2.656 45 HB3 ASN 7 HB3 ASN 7 16.680 -6.979 2.908 46 HD21 ASN 7 HD21 ASN 7 15.578 -10.476 3.368 47 HD22 ASN 7 HD22 ASN 7 17.171 -11.087 3.082 48 H ALA 8 H ALA 8 13.286 -8.345 4.331 49 HA ALA 8 HA ALA 8 12.959 -10.059 6.546 50 HB1 ALA 8 HB1 ALA 8 10.846 -10.625 5.497 51 HB2 ALA 8 HB2 ALA 8 11.164 -8.934 5.057 52 HB3 ALA 8 HB3 ALA 8 11.481 -10.232 3.901 53 H THR 9 H THR 9 13.132 -12.329 6.742 54 HA THR 9 HA THR 9 14.726 -13.724 4.653 55 HB THR 9 HB THR 9 14.675 -15.510 6.602 56 HG1 THR 9 HG1 THR 9 14.499 -13.135 8.119 57 HG21 THR 9 HG21 THR 9 16.679 -14.552 7.563 58 HG22 THR 9 HG22 THR 9 16.672 -14.240 5.821 59 HG23 THR 9 HG23 THR 9 16.243 -12.947 6.946 60 H LYS 10 H LYS 10 11.526 -13.600 6.008 61 HA LYS 10 HA LYS 10 10.578 -15.713 4.156 62 HB2 LYS 10 HB2 LYS 10 9.049 -16.578 5.812 63 HB3 LYS 10 HB3 LYS 10 10.679 -16.730 6.423 64 HG2 LYS 10 HG2 LYS 10 9.147 -14.244 7.212 65 HG3 LYS 10 HG3 LYS 10 8.572 -15.765 7.866 66 HD2 LYS 10 HD2 LYS 10 11.486 -14.923 8.113 67 HD3 LYS 10 HD3 LYS 10 10.242 -14.434 9.279 68 HE2 LYS 10 HE2 LYS 10 9.658 -16.763 9.740 69 HE3 LYS 10 HE3 LYS 10 10.875 -17.315 8.564 70 HZ1 LYS 10 HZ1 LYS 10 11.716 -17.390 10.795 71 HZ2 LYS 10 HZ2 LYS 10 12.573 -16.317 9.909 72 HZ3 LYS 10 HZ3 LYS 10 11.484 -15.768 11.008 73 H LYS 11 H LYS 11 7.923 -15.449 4.450 74 HA LYS 11 HA LYS 11 6.158 -14.232 3.726 75 HB2 LYS 11 HB2 LYS 11 7.389 -12.076 5.488 76 HB3 LYS 11 HB3 LYS 11 5.761 -12.035 4.830 77 HG2 LYS 11 HG2 LYS 11 6.718 -14.280 6.649 78 HG3 LYS 11 HG3 LYS 11 6.042 -12.775 7.254 79 HD2 LYS 11 HD2 LYS 11 3.940 -13.159 6.033 80 HD3 LYS 11 HD3 LYS 11 4.618 -14.663 5.347 81 HE2 LYS 11 HE2 LYS 11 4.996 -15.479 7.686 82 HE3 LYS 11 HE3 LYS 11 4.121 -14.070 8.299 83 HZ1 LYS 11 HZ1 LYS 11 2.977 -16.052 6.418 84 HZ2 LYS 11 HZ2 LYS 11 2.824 -16.129 8.049 85 HZ3 LYS 11 HZ3 LYS 11 2.134 -14.883 7.255 86 H ASP 12 H ASP 12 7.043 -14.368 1.557 87 HA ASP 12 HA ASP 12 8.664 -12.443 0.316 88 HB2 ASP 12 HB2 ASP 12 7.789 -13.321 -1.745 89 HB3 ASP 12 HB3 ASP 12 7.892 -14.674 -0.611 90 H LYS 13 H LYS 13 5.307 -12.359 1.164 91 HA LYS 13 HA LYS 13 4.523 -10.099 -0.473 92 HB2 LYS 13 HB2 LYS 13 3.326 -11.366 2.045 93 HB3 LYS 13 HB3 LYS 13 2.515 -10.127 1.076 94 HG2 LYS 13 HG2 LYS 13 3.474 -12.727 -0.181 95 HG3 LYS 13 HG3 LYS 13 1.954 -12.656 0.692 96 HD2 LYS 13 HD2 LYS 13 2.417 -10.515 -1.379 97 HD3 LYS 13 HD3 LYS 13 2.122 -12.148 -1.967 98 HE2 LYS 13 HE2 LYS 13 0.325 -11.174 0.249 99 HE3 LYS 13 HE3 LYS 13 0.130 -10.413 -1.354 100 HZ1 LYS 13 HZ1 LYS 13 0.169 -13.332 -1.084 101 HZ2 LYS 13 HZ2 LYS 13 -1.222 -12.488 -0.955 102 HZ3 LYS 13 HZ3 LYS 13 -0.356 -12.355 -2.340 103 H LEU 14 H LEU 14 5.373 -10.495 3.035 104 HA LEU 14 HA LEU 14 5.174 -7.630 3.453 105 HB2 LEU 14 HB2 LEU 14 6.548 -9.748 5.145 106 HB3 LEU 14 HB3 LEU 14 6.185 -8.098 5.641 107 HG LEU 14 HG LEU 14 4.103 -10.217 4.941 108 HD11 LEU 14 HD11 LEU 14 4.878 -8.999 7.614 109 HD12 LEU 14 HD12 LEU 14 3.659 -10.263 7.329 110 HD13 LEU 14 HD13 LEU 14 5.372 -10.602 7.028 111 HD21 LEU 14 HD21 LEU 14 2.469 -8.602 5.896 112 HD22 LEU 14 HD22 LEU 14 3.744 -7.374 5.992 113 HD23 LEU 14 HD23 LEU 14 3.207 -7.996 4.413 114 H GLN 15 H GLN 15 7.767 -9.831 2.469 115 HA GLN 15 HA GLN 15 9.993 -8.266 3.050 116 HB2 GLN 15 HB2 GLN 15 10.022 -10.626 2.307 117 HB3 GLN 15 HB3 GLN 15 9.480 -10.164 0.710 118 HG2 GLN 15 HG2 GLN 15 12.051 -8.971 1.776 119 HG3 GLN 15 HG3 GLN 15 12.020 -10.640 1.212 120 HE21 GLN 15 HE21 GLN 15 11.806 -7.262 0.135 121 HE22 GLN 15 HE22 GLN 15 11.962 -7.675 -1.566 122 H VAL 16 H VAL 16 7.977 -8.231 0.035 123 HA VAL 16 HA VAL 16 9.622 -6.173 -1.135 124 HB VAL 16 HB VAL 16 7.771 -5.950 -2.762 125 HG11 VAL 16 HG11 VAL 16 8.059 -8.181 -3.786 126 HG12 VAL 16 HG12 VAL 16 9.586 -7.637 -3.059 127 HG13 VAL 16 HG13 VAL 16 8.591 -8.839 -2.221 128 HG21 VAL 16 HG21 VAL 16 5.937 -7.510 -2.829 129 HG22 VAL 16 HG22 VAL 16 6.414 -8.233 -1.291 130 HG23 VAL 16 HG23 VAL 16 5.842 -6.559 -1.330 131 H ILE 17 H ILE 17 6.719 -6.086 0.902 132 HA ILE 17 HA ILE 17 6.285 -3.260 0.531 133 HB ILE 17 HB ILE 17 5.273 -4.982 2.806 134 HG12 ILE 17 HG12 ILE 17 3.835 -4.266 0.203 135 HG13 ILE 17 HG13 ILE 17 4.604 -5.812 0.490 136 HG21 ILE 17 HG21 ILE 17 3.461 -3.247 2.933 137 HG22 ILE 17 HG22 ILE 17 5.051 -2.564 3.224 138 HG23 ILE 17 HG23 ILE 17 4.261 -2.332 1.648 139 HD11 ILE 17 HD11 ILE 17 3.070 -5.891 2.651 140 HD12 ILE 17 HD12 ILE 17 2.101 -4.717 1.715 141 HD13 ILE 17 HD13 ILE 17 2.449 -6.320 1.051 142 H ASP 18 H ASP 18 8.050 -5.154 2.982 143 HA ASP 18 HA ASP 18 8.757 -2.891 4.626 144 HB2 ASP 18 HB2 ASP 18 9.167 -5.688 4.722 145 HB3 ASP 18 HB3 ASP 18 10.782 -5.033 4.612 146 H TRP 19 H TRP 19 10.215 -4.415 1.747 147 HA TRP 19 HA TRP 19 12.667 -3.011 1.919 148 HB2 TRP 19 HB2 TRP 19 12.416 -5.010 0.547 149 HB3 TRP 19 HB3 TRP 19 11.300 -4.172 -0.531 150 HD1 TRP 19 HD1 TRP 19 12.479 -1.871 -1.765 151 HE1 TRP 19 HE1 TRP 19 14.807 -1.534 -2.661 152 HE3 TRP 19 HE3 TRP 19 14.837 -5.787 0.581 153 HZ2 TRP 19 HZ2 TRP 19 17.278 -3.057 -2.808 154 HZ3 TRP 19 HZ3 TRP 19 17.186 -6.342 -0.011 155 HH2 TRP 19 HH2 TRP 19 18.389 -5.015 -1.732 156 H LEU 20 H LEU 20 9.752 -2.316 -0.131 157 HA LEU 20 HA LEU 20 10.786 0.142 -1.117 158 HB2 LEU 20 HB2 LEU 20 8.556 0.659 -1.872 159 HB3 LEU 20 HB3 LEU 20 8.976 -1.003 -2.233 160 HG LEU 20 HG LEU 20 7.695 -1.405 0.090 161 HD11 LEU 20 HD11 LEU 20 6.258 1.000 -1.090 162 HD12 LEU 20 HD12 LEU 20 5.668 -0.016 0.245 163 HD13 LEU 20 HD13 LEU 20 7.105 0.987 0.463 164 HD21 LEU 20 HD21 LEU 20 5.749 -2.065 -1.071 165 HD22 LEU 20 HD22 LEU 20 6.121 -1.041 -2.451 166 HD23 LEU 20 HD23 LEU 20 7.153 -2.456 -2.072 167 H ILE 21 H ILE 21 9.149 -0.604 1.949 168 HA ILE 21 HA ILE 21 8.547 2.095 2.684 169 HB ILE 21 HB ILE 21 8.880 -0.538 4.119 170 HG12 ILE 21 HG12 ILE 21 6.512 1.376 3.988 171 HG13 ILE 21 HG13 ILE 21 6.801 0.151 2.777 172 HG21 ILE 21 HG21 ILE 21 8.563 2.153 5.483 173 HG22 ILE 21 HG22 ILE 21 8.161 0.608 6.234 174 HG23 ILE 21 HG23 ILE 21 9.808 0.922 5.763 175 HD11 ILE 21 HD11 ILE 21 5.200 -0.709 4.353 176 HD12 ILE 21 HD12 ILE 21 6.724 -1.597 4.643 177 HD13 ILE 21 HD13 ILE 21 6.200 -0.289 5.705 178 H GLU 22 H GLU 22 11.444 0.014 3.420 179 HA GLU 22 HA GLU 22 12.693 2.238 4.781 180 HB2 GLU 22 HB2 GLU 22 13.037 -0.275 5.192 181 HB3 GLU 22 HB3 GLU 22 14.146 -0.238 3.814 182 HG2 GLU 22 HG2 GLU 22 15.483 1.528 4.959 183 HG3 GLU 22 HG3 GLU 22 14.320 1.545 6.288 184 H ASN 23 H ASN 23 12.712 1.155 1.423 185 HA ASN 23 HA ASN 23 15.129 2.496 0.616 186 HB2 ASN 23 HB2 ASN 23 12.696 1.423 -0.814 187 HB3 ASN 23 HB3 ASN 23 13.681 2.602 -1.664 188 HD21 ASN 23 HD21 ASN 23 15.231 0.450 0.593 189 HD22 ASN 23 HD22 ASN 23 16.069 -0.530 -0.588 190 H PHE 24 H PHE 24 11.838 3.751 1.090 191 HA PHE 24 HA PHE 24 12.889 6.436 0.299 192 HB2 PHE 24 HB2 PHE 24 9.999 5.675 0.135 193 HB3 PHE 24 HB3 PHE 24 10.853 6.993 -0.632 194 HD1 PHE 24 HD1 PHE 24 12.924 6.001 -2.463 195 HD2 PHE 24 HD2 PHE 24 9.325 3.940 -1.158 196 HE1 PHE 24 HE1 PHE 24 13.028 4.589 -4.345 197 HE2 PHE 24 HE2 PHE 24 9.480 2.509 -3.058 198 HZ PHE 24 HZ PHE 24 11.369 2.779 -4.726 199 HA PRO 25 HA PRO 25 11.788 6.514 4.783 200 HB2 PRO 25 HB2 PRO 25 14.050 7.582 5.816 201 HB3 PRO 25 HB3 PRO 25 13.998 5.891 5.232 202 HG2 PRO 25 HG2 PRO 25 14.971 8.342 3.709 203 HG3 PRO 25 HG3 PRO 25 15.817 6.777 3.977 204 HD2 PRO 25 HD2 PRO 25 14.356 7.300 1.715 205 HD3 PRO 25 HD3 PRO 25 14.487 5.668 2.428 206 H ASN 26 H ASN 26 10.578 8.212 2.960 207 HA ASN 26 HA ASN 26 10.898 10.912 4.228 208 HB2 ASN 26 HB2 ASN 26 10.141 10.328 1.343 209 HB3 ASN 26 HB3 ASN 26 10.106 11.900 2.123 210 HD21 ASN 26 HD21 ASN 26 12.735 10.929 3.602 211 HD22 ASN 26 HD22 ASN 26 13.929 11.438 2.379 212 H ALA 27 H ALA 27 8.807 8.302 3.419 213 HA ALA 27 HA ALA 27 6.664 9.120 5.175 214 HB1 ALA 27 HB1 ALA 27 4.982 9.289 3.272 215 HB2 ALA 27 HB2 ALA 27 6.117 10.655 3.275 216 HB3 ALA 27 HB3 ALA 27 6.309 9.336 2.102 217 H PHE 28 H PHE 28 6.265 7.035 5.917 218 HA PHE 28 HA PHE 28 4.867 5.231 4.422 219 HB2 PHE 28 HB2 PHE 28 7.751 4.746 4.130 220 HB3 PHE 28 HB3 PHE 28 6.906 3.370 4.777 221 HD1 PHE 28 HD1 PHE 28 4.292 3.258 3.502 222 HD2 PHE 28 HD2 PHE 28 8.094 4.416 1.791 223 HE1 PHE 28 HE1 PHE 28 3.428 2.769 1.247 224 HE2 PHE 28 HE2 PHE 28 7.219 3.860 -0.462 225 HZ PHE 28 HZ PHE 28 4.866 3.066 -0.741 226 H PHE 29 H PHE 29 4.585 3.012 5.641 227 HA PHE 29 HA PHE 29 5.060 3.173 8.505 228 HB2 PHE 29 HB2 PHE 29 2.307 3.337 7.212 229 HB3 PHE 29 HB3 PHE 29 2.544 2.801 8.875 230 HD1 PHE 29 HD1 PHE 29 2.405 5.707 6.651 231 HD2 PHE 29 HD2 PHE 29 3.539 4.366 10.562 232 HE1 PHE 29 HE1 PHE 29 2.448 8.055 7.432 233 HE2 PHE 29 HE2 PHE 29 3.447 6.718 11.397 234 HZ PHE 29 HZ PHE 29 2.919 8.563 9.816 235 H LYS 30 H LYS 30 4.758 1.120 9.440 236 HA LYS 30 HA LYS 30 4.442 -1.180 7.552 237 HB2 LYS 30 HB2 LYS 30 5.973 -0.968 10.187 238 HB3 LYS 30 HB3 LYS 30 5.934 -2.364 9.126 239 HG2 LYS 30 HG2 LYS 30 7.520 -1.516 7.740 240 HG3 LYS 30 HG3 LYS 30 6.710 0.031 7.665 241 HD2 LYS 30 HD2 LYS 30 8.749 0.584 8.458 242 HD3 LYS 30 HD3 LYS 30 7.698 0.681 9.864 243 HE2 LYS 30 HE2 LYS 30 8.664 -1.284 10.830 244 HE3 LYS 30 HE3 LYS 30 9.167 -1.884 9.239 245 HZ1 LYS 30 HZ1 LYS 30 10.441 0.445 10.511 246 HZ2 LYS 30 HZ2 LYS 30 11.032 -1.129 10.457 247 HZ3 LYS 30 HZ3 LYS 30 10.826 -0.316 9.078 248 H LYS 31 H LYS 31 3.859 -0.112 10.856 249 HA LYS 31 HA LYS 31 2.429 -2.228 11.863 250 HB2 LYS 31 HB2 LYS 31 2.991 0.569 12.564 251 HB3 LYS 31 HB3 LYS 31 1.478 0.061 13.260 252 HG2 LYS 31 HG2 LYS 31 4.011 -1.585 13.492 253 HG3 LYS 31 HG3 LYS 31 3.576 -0.315 14.655 254 HD2 LYS 31 HD2 LYS 31 1.464 -1.446 15.170 255 HD3 LYS 31 HD3 LYS 31 1.809 -2.709 13.974 256 HE2 LYS 31 HE2 LYS 31 3.836 -3.364 15.236 257 HE3 LYS 31 HE3 LYS 31 3.476 -2.129 16.462 258 HZ1 LYS 31 HZ1 LYS 31 1.725 -4.382 15.727 259 HZ2 LYS 31 HZ2 LYS 31 2.656 -4.355 17.062 260 HZ3 LYS 31 HZ3 LYS 31 1.427 -3.262 16.937 261 H GLY 32 H GLY 32 0.998 -0.995 9.231 262 HA2 GLY 32 HA2 GLY 32 -1.142 -1.148 8.431 263 HA3 GLY 32 HA3 GLY 32 -1.545 -2.078 9.858 264 H ASN 33 H ASN 33 -1.913 -0.710 11.829 265 HA ASN 33 HA ASN 33 -4.042 1.102 11.462 266 HB2 ASN 33 HB2 ASN 33 -4.356 1.064 13.711 267 HB3 ASN 33 HB3 ASN 33 -3.559 -0.481 13.460 268 HD21 ASN 33 HD21 ASN 33 -0.814 0.573 13.257 269 HD22 ASN 33 HD22 ASN 33 -0.457 1.408 14.787 270 H GLN 34 H GLN 34 -0.881 1.931 11.081 271 HA GLN 34 HA GLN 34 -1.466 4.767 11.789 272 HB2 GLN 34 HB2 GLN 34 1.033 5.082 12.013 273 HB3 GLN 34 HB3 GLN 34 0.176 4.278 13.315 274 HG2 GLN 34 HG2 GLN 34 0.953 2.089 12.524 275 HG3 GLN 34 HG3 GLN 34 1.795 2.846 11.182 276 HE21 GLN 34 HE21 GLN 34 1.577 3.233 14.815 277 HE22 GLN 34 HE22 GLN 34 3.324 3.275 15.034 278 H VAL 35 H VAL 35 -1.339 2.585 9.312 279 HA VAL 35 HA VAL 35 0.280 4.043 7.408 280 HB VAL 35 HB VAL 35 -0.936 2.928 5.629 281 HG11 VAL 35 HG11 VAL 35 -0.529 0.568 6.249 282 HG12 VAL 35 HG12 VAL 35 0.810 1.652 6.616 283 HG13 VAL 35 HG13 VAL 35 -0.232 1.082 7.925 284 HG21 VAL 35 HG21 VAL 35 -3.152 2.822 5.953 285 HG22 VAL 35 HG22 VAL 35 -2.769 1.177 6.489 286 HG23 VAL 35 HG23 VAL 35 -3.076 2.474 7.659 287 H LYS 36 H LYS 36 -0.307 5.456 5.652 288 HA LYS 36 HA LYS 36 -2.765 7.083 5.970 289 HB2 LYS 36 HB2 LYS 36 0.041 7.913 6.390 290 HB3 LYS 36 HB3 LYS 36 -0.656 8.736 5.007 291 HG2 LYS 36 HG2 LYS 36 -2.628 9.382 6.481 292 HG3 LYS 36 HG3 LYS 36 -1.710 8.753 7.858 293 HD2 LYS 36 HD2 LYS 36 0.050 10.383 7.525 294 HD3 LYS 36 HD3 LYS 36 -0.613 10.866 5.945 295 HE2 LYS 36 HE2 LYS 36 -2.650 11.733 7.018 296 HE3 LYS 36 HE3 LYS 36 -2.038 11.253 8.613 297 HZ1 LYS 36 HZ1 LYS 36 -0.248 12.809 8.364 298 HZ2 LYS 36 HZ2 LYS 36 -0.719 13.202 6.820 299 HZ3 LYS 36 HZ3 LYS 36 -1.653 13.593 8.111 300 HA PRO 37 HA PRO 37 -2.803 6.257 1.613 301 HB2 PRO 37 HB2 PRO 37 -3.950 8.444 0.434 302 HB3 PRO 37 HB3 PRO 37 -4.850 7.303 1.464 303 HG2 PRO 37 HG2 PRO 37 -3.678 9.983 2.253 304 HG3 PRO 37 HG3 PRO 37 -5.297 9.314 2.633 305 HD2 PRO 37 HD2 PRO 37 -3.157 9.244 4.357 306 HD3 PRO 37 HD3 PRO 37 -4.423 7.975 4.349 307 H LEU 38 H LEU 38 -1.393 6.256 0.027 308 HA LEU 38 HA LEU 38 0.855 8.208 0.017 309 HB2 LEU 38 HB2 LEU 38 0.470 5.449 -1.258 310 HB3 LEU 38 HB3 LEU 38 1.822 6.498 -1.584 311 HG LEU 38 HG LEU 38 2.688 4.969 -0.123 312 HD11 LEU 38 HD11 LEU 38 3.266 7.304 0.533 313 HD12 LEU 38 HD12 LEU 38 1.965 7.261 1.743 314 HD13 LEU 38 HD13 LEU 38 3.354 6.166 1.876 315 HD21 LEU 38 HD21 LEU 38 1.705 4.265 1.991 316 HD22 LEU 38 HD22 LEU 38 0.258 5.230 1.640 317 HD23 LEU 38 HD23 LEU 38 0.686 3.869 0.596 318 H LYS 39 H LYS 39 1.745 8.720 -2.181 319 HA LYS 39 HA LYS 39 -0.044 10.193 -3.732 320 HB2 LYS 39 HB2 LYS 39 2.481 10.335 -3.597 321 HB3 LYS 39 HB3 LYS 39 2.594 8.953 -4.684 322 HG2 LYS 39 HG2 LYS 39 0.867 11.066 -5.782 323 HG3 LYS 39 HG3 LYS 39 2.397 11.724 -5.282 324 HD2 LYS 39 HD2 LYS 39 2.371 9.286 -7.035 325 HD3 LYS 39 HD3 LYS 39 2.004 10.845 -7.732 326 HE2 LYS 39 HE2 LYS 39 4.567 10.153 -6.264 327 HE3 LYS 39 HE3 LYS 39 4.364 10.130 -8.004 328 HZ1 LYS 39 HZ1 LYS 39 5.376 12.085 -7.616 329 HZ2 LYS 39 HZ2 LYS 39 3.824 12.590 -7.766 330 HZ3 LYS 39 HZ3 LYS 39 4.609 12.492 -6.272 331 H ILE 40 H ILE 40 -0.794 9.942 -5.905 332 HA ILE 40 HA ILE 40 -2.224 7.611 -6.386 333 HB ILE 40 HB ILE 40 -2.802 9.825 -7.238 334 HG12 ILE 40 HG12 ILE 40 -3.417 9.271 -9.574 335 HG13 ILE 40 HG13 ILE 40 -2.398 7.834 -9.509 336 HG21 ILE 40 HG21 ILE 40 -1.678 10.919 -9.051 337 HG22 ILE 40 HG22 ILE 40 -0.446 10.576 -7.833 338 HG23 ILE 40 HG23 ILE 40 -0.557 9.559 -9.273 339 HD11 ILE 40 HD11 ILE 40 -4.792 8.363 -7.684 340 HD12 ILE 40 HD12 ILE 40 -4.828 7.370 -9.154 341 HD13 ILE 40 HD13 ILE 40 -3.847 6.856 -7.774 342 H GLY 41 H GLY 41 -1.732 5.728 -7.299 343 HA2 GLY 41 HA2 GLY 41 -0.442 3.977 -8.120 344 HA3 GLY 41 HA3 GLY 41 0.025 5.168 -9.349 345 H ILE 42 H ILE 42 1.002 5.485 -5.932 346 HA ILE 42 HA ILE 42 3.586 6.083 -6.331 347 HB ILE 42 HB ILE 42 2.414 6.256 -4.211 348 HG12 ILE 42 HG12 ILE 42 4.924 4.663 -3.597 349 HG13 ILE 42 HG13 ILE 42 5.019 6.152 -4.511 350 HG21 ILE 42 HG21 ILE 42 2.229 4.380 -2.630 351 HG22 ILE 42 HG22 ILE 42 1.373 3.970 -4.121 352 HG23 ILE 42 HG23 ILE 42 2.969 3.276 -3.786 353 HD11 ILE 42 HD11 ILE 42 3.789 7.332 -2.631 354 HD12 ILE 42 HD12 ILE 42 4.025 5.836 -1.682 355 HD13 ILE 42 HD13 ILE 42 5.412 6.752 -2.258 356 H PHE 43 H PHE 43 2.414 2.748 -6.459 357 HA PHE 43 HA PHE 43 4.928 1.434 -6.123 358 HB2 PHE 43 HB2 PHE 43 3.303 -0.170 -6.133 359 HB3 PHE 43 HB3 PHE 43 2.258 0.744 -7.211 360 HD1 PHE 43 HD1 PHE 43 2.189 0.370 -9.569 361 HD2 PHE 43 HD2 PHE 43 5.260 -1.536 -7.188 362 HE1 PHE 43 HE1 PHE 43 2.875 -0.959 -11.521 363 HE2 PHE 43 HE2 PHE 43 5.946 -2.856 -9.167 364 HZ PHE 43 HZ PHE 43 4.771 -2.569 -11.337 365 H ASP 44 H ASP 44 3.439 3.066 -8.891 366 HA ASP 44 HA ASP 44 5.196 2.135 -10.971 367 HB2 ASP 44 HB2 ASP 44 2.921 3.214 -11.217 368 HB3 ASP 44 HB3 ASP 44 3.623 4.743 -10.668 369 H ASP 45 H ASP 45 5.461 4.659 -8.532 370 HA ASP 45 HA ASP 45 7.690 6.001 -9.859 371 HB2 ASP 45 HB2 ASP 45 5.861 6.902 -8.142 372 HB3 ASP 45 HB3 ASP 45 7.017 6.341 -6.933 373 H LEU 46 H LEU 46 7.128 3.806 -7.173 374 HA LEU 46 HA LEU 46 9.731 3.507 -6.083 375 HB2 LEU 46 HB2 LEU 46 8.129 2.769 -4.692 376 HB3 LEU 46 HB3 LEU 46 7.061 2.240 -5.961 377 HG LEU 46 HG LEU 46 8.343 0.168 -6.328 378 HD11 LEU 46 HD11 LEU 46 9.803 0.605 -3.723 379 HD12 LEU 46 HD12 LEU 46 9.889 -0.766 -4.811 380 HD13 LEU 46 HD13 LEU 46 10.558 0.781 -5.287 381 HD21 LEU 46 HD21 LEU 46 7.115 0.671 -3.643 382 HD22 LEU 46 HD22 LEU 46 6.338 0.093 -5.130 383 HD23 LEU 46 HD23 LEU 46 7.501 -0.950 -4.307 384 H ILE 47 H ILE 47 7.933 1.796 -8.693 385 HA ILE 47 HA ILE 47 9.668 -0.329 -9.054 386 HB ILE 47 HB ILE 47 7.343 0.423 -10.147 387 HG12 ILE 47 HG12 ILE 47 8.378 -1.873 -9.992 388 HG13 ILE 47 HG13 ILE 47 7.234 -1.554 -11.291 389 HG21 ILE 47 HG21 ILE 47 8.398 2.074 -11.646 390 HG22 ILE 47 HG22 ILE 47 9.241 0.800 -12.492 391 HG23 ILE 47 HG23 ILE 47 7.451 0.845 -12.494 392 HD11 ILE 47 HD11 ILE 47 10.180 -1.250 -11.759 393 HD12 ILE 47 HD12 ILE 47 9.410 -2.826 -11.892 394 HD13 ILE 47 HD13 ILE 47 8.890 -1.491 -12.948 395 H ASP 48 H ASP 48 9.976 3.049 -10.190 396 HA ASP 48 HA ASP 48 12.083 2.605 -12.012 397 HB2 ASP 48 HB2 ASP 48 11.045 4.990 -10.590 398 HB3 ASP 48 HB3 ASP 48 12.743 5.066 -11.039 399 H PHE 49 H PHE 49 12.112 3.018 -8.504 400 HA PHE 49 HA PHE 49 15.025 3.133 -8.310 401 HB2 PHE 49 HB2 PHE 49 13.123 4.052 -6.585 402 HB3 PHE 49 HB3 PHE 49 13.289 2.425 -5.952 403 HD1 PHE 49 HD1 PHE 49 14.567 5.741 -5.922 404 HD2 PHE 49 HD2 PHE 49 15.761 1.624 -5.380 405 HE1 PHE 49 HE1 PHE 49 16.609 6.483 -4.762 406 HE2 PHE 49 HE2 PHE 49 17.808 2.374 -4.216 407 HZ PHE 49 HZ PHE 49 18.225 4.812 -3.892 408 H TYR 50 H TYR 50 12.421 0.727 -7.880 409 HA TYR 50 HA TYR 50 13.960 -1.386 -6.826 410 HB2 TYR 50 HB2 TYR 50 11.743 -1.757 -6.581 411 HB3 TYR 50 HB3 TYR 50 11.327 -1.046 -8.112 412 HD1 TYR 50 HD1 TYR 50 11.895 -4.190 -6.381 413 HD2 TYR 50 HD2 TYR 50 11.577 -2.300 -10.235 414 HE1 TYR 50 HE1 TYR 50 11.354 -6.390 -7.446 415 HE2 TYR 50 HE2 TYR 50 11.124 -4.495 -11.296 416 HH TYR 50 HH TYR 50 10.805 -7.499 -9.313 417 H GLU 51 H GLU 51 13.532 -0.320 -10.207 418 HA GLU 51 HA GLU 51 14.973 -2.610 -11.271 419 HB2 GLU 51 HB2 GLU 51 14.027 -0.011 -12.482 420 HB3 GLU 51 HB3 GLU 51 14.929 -1.246 -13.406 421 HG2 GLU 51 HG2 GLU 51 13.094 -2.894 -12.404 422 HG3 GLU 51 HG3 GLU 51 12.222 -1.410 -12.132 423 H ARG 52 H ARG 52 16.156 0.097 -9.549 424 HA ARG 52 HA ARG 52 18.759 0.067 -10.988 425 HB2 ARG 52 HB2 ARG 52 17.532 1.866 -8.890 426 HB3 ARG 52 HB3 ARG 52 19.266 1.623 -8.835 427 HG2 ARG 52 HG2 ARG 52 19.027 3.531 -10.133 428 HG3 ARG 52 HG3 ARG 52 19.384 2.244 -11.292 429 HD2 ARG 52 HD2 ARG 52 16.889 2.061 -11.719 430 HD3 ARG 52 HD3 ARG 52 16.672 3.453 -10.631 431 HE ARG 52 HE ARG 52 18.541 3.778 -12.906 432 HH11 ARG 52 HH11 ARG 52 15.188 4.209 -11.852 433 HH12 ARG 52 HH12 ARG 52 14.836 5.432 -13.036 434 HH21 ARG 52 HH21 ARG 52 18.112 5.221 -14.457 435 HH22 ARG 52 HH22 ARG 52 16.473 5.644 -14.838 436 H LEU 53 H LEU 53 17.243 -1.433 -8.143 437 HA LEU 53 HA LEU 53 19.447 -1.919 -6.537 438 HB2 LEU 53 HB2 LEU 53 17.174 -3.853 -7.129 439 HB3 LEU 53 HB3 LEU 53 18.116 -3.739 -5.645 440 HG LEU 53 HG LEU 53 16.176 -1.625 -6.686 441 HD11 LEU 53 HD11 LEU 53 14.999 -3.612 -6.062 442 HD12 LEU 53 HD12 LEU 53 15.863 -3.709 -4.525 443 HD13 LEU 53 HD13 LEU 53 14.731 -2.369 -4.838 444 HD21 LEU 53 HD21 LEU 53 16.419 -0.687 -4.336 445 HD22 LEU 53 HD22 LEU 53 17.930 -1.631 -4.231 446 HD23 LEU 53 HD23 LEU 53 17.729 -0.401 -5.473 447 H ASP 54 H ASP 54 21.110 -3.392 -6.583 448 HA ASP 54 HA ASP 54 22.052 -4.540 -8.979 449 HB2 ASP 54 HB2 ASP 54 23.424 -3.908 -7.084 450 HB3 ASP 54 HB3 ASP 54 22.656 -5.100 -6.048 451 H THR 55 H THR 55 19.776 -5.815 -6.648 452 HA THR 55 HA THR 55 19.238 -8.132 -8.311 453 HB THR 55 HB THR 55 19.944 -8.686 -5.409 454 HG1 THR 55 HG1 THR 55 21.659 -8.425 -7.558 455 HG21 THR 55 HG21 THR 55 19.772 -10.496 -7.845 456 HG22 THR 55 HG22 THR 55 20.131 -10.987 -6.172 457 HG23 THR 55 HG23 THR 55 18.535 -10.334 -6.574 458 HA PRO 56 HA PRO 56 15.595 -6.379 -6.244 459 HB2 PRO 56 HB2 PRO 56 13.852 -6.693 -8.303 460 HB3 PRO 56 HB3 PRO 56 15.058 -5.368 -8.325 461 HG2 PRO 56 HG2 PRO 56 15.117 -8.089 -9.680 462 HG3 PRO 56 HG3 PRO 56 15.504 -6.494 -10.397 463 HD2 PRO 56 HD2 PRO 56 17.371 -8.234 -9.394 464 HD3 PRO 56 HD3 PRO 56 17.610 -6.459 -9.384 465 HA PRO 57 HA PRO 57 13.798 -10.440 -5.350 466 HB2 PRO 57 HB2 PRO 57 11.334 -9.820 -4.375 467 HB3 PRO 57 HB3 PRO 57 12.796 -9.163 -3.588 468 HG2 PRO 57 HG2 PRO 57 11.073 -7.781 -5.673 469 HG3 PRO 57 HG3 PRO 57 11.546 -7.169 -4.051 470 HD2 PRO 57 HD2 PRO 57 13.029 -6.492 -6.222 471 HD3 PRO 57 HD3 PRO 57 13.775 -6.888 -4.675 472 H PHE 58 H PHE 58 10.905 -11.008 -5.870 473 HA PHE 58 HA PHE 58 11.007 -11.831 -8.567 474 HB2 PHE 58 HB2 PHE 58 8.669 -11.362 -6.677 475 HB3 PHE 58 HB3 PHE 58 8.476 -12.088 -8.257 476 HD1 PHE 58 HD1 PHE 58 9.871 -14.218 -8.799 477 HD2 PHE 58 HD2 PHE 58 9.096 -12.795 -4.804 478 HE1 PHE 58 HE1 PHE 58 10.359 -16.480 -7.903 479 HE2 PHE 58 HE2 PHE 58 9.544 -15.069 -3.921 480 HZ PHE 58 HZ PHE 58 10.201 -16.905 -5.445 481 H SER 59 H SER 59 9.310 -11.173 -10.241 482 HA SER 59 HA SER 59 9.766 -8.632 -11.333 483 HB2 SER 59 HB2 SER 59 7.296 -10.323 -11.756 484 HB3 SER 59 HB3 SER 59 8.147 -9.283 -12.915 485 HG SER 59 HG SER 59 8.713 -11.440 -13.307 486 H LYS 60 H LYS 60 8.514 -6.918 -11.680 487 HA LYS 60 HA LYS 60 7.474 -5.480 -9.649 488 HB2 LYS 60 HB2 LYS 60 6.511 -4.044 -11.429 489 HB3 LYS 60 HB3 LYS 60 8.176 -4.561 -11.662 490 HG2 LYS 60 HG2 LYS 60 7.276 -6.390 -13.265 491 HG3 LYS 60 HG3 LYS 60 5.720 -5.563 -13.131 492 HD2 LYS 60 HD2 LYS 60 6.779 -4.758 -15.074 493 HD3 LYS 60 HD3 LYS 60 6.911 -3.461 -13.857 494 HE2 LYS 60 HE2 LYS 60 9.262 -4.215 -13.440 495 HE3 LYS 60 HE3 LYS 60 9.096 -5.363 -14.768 496 HZ1 LYS 60 HZ1 LYS 60 8.800 -2.424 -15.072 497 HZ2 LYS 60 HZ2 LYS 60 10.181 -3.238 -15.286 498 HZ3 LYS 60 HZ3 LYS 60 8.890 -3.525 -16.286 499 H LYS 61 H LYS 61 5.707 -7.958 -11.354 500 HA LYS 61 HA LYS 61 3.032 -7.178 -10.633 501 HB2 LYS 61 HB2 LYS 61 4.297 -9.829 -11.422 502 HB3 LYS 61 HB3 LYS 61 2.569 -9.637 -11.073 503 HG2 LYS 61 HG2 LYS 61 2.369 -7.887 -12.793 504 HG3 LYS 61 HG3 LYS 61 4.101 -7.978 -13.140 505 HD2 LYS 61 HD2 LYS 61 3.885 -10.204 -14.061 506 HD3 LYS 61 HD3 LYS 61 2.211 -10.327 -13.502 507 HE2 LYS 61 HE2 LYS 61 2.291 -9.840 -15.906 508 HE3 LYS 61 HE3 LYS 61 1.506 -8.537 -15.004 509 HZ1 LYS 61 HZ1 LYS 61 3.508 -7.225 -15.219 510 HZ2 LYS 61 HZ2 LYS 61 4.318 -8.492 -15.930 511 HZ3 LYS 61 HZ3 LYS 61 3.094 -7.748 -16.699 512 H SER 62 H SER 62 5.392 -9.496 -8.981 513 HA SER 62 HA SER 62 3.714 -9.970 -6.758 514 HB2 SER 62 HB2 SER 62 5.416 -11.470 -6.680 515 HB3 SER 62 HB3 SER 62 6.508 -10.423 -7.585 516 HG SER 62 HG SER 62 6.165 -10.619 -4.797 517 H LEU 63 H LEU 63 6.181 -7.486 -7.423 518 HA LEU 63 HA LEU 63 6.226 -6.170 -4.980 519 HB2 LEU 63 HB2 LEU 63 7.512 -5.737 -7.297 520 HB3 LEU 63 HB3 LEU 63 6.253 -4.528 -7.518 521 HG LEU 63 HG LEU 63 6.945 -3.709 -5.118 522 HD11 LEU 63 HD11 LEU 63 9.537 -5.045 -5.957 523 HD12 LEU 63 HD12 LEU 63 9.185 -4.196 -4.438 524 HD13 LEU 63 HD13 LEU 63 8.440 -5.773 -4.799 525 HD21 LEU 63 HD21 LEU 63 8.794 -3.308 -7.528 526 HD22 LEU 63 HD22 LEU 63 7.379 -2.324 -7.107 527 HD23 LEU 63 HD23 LEU 63 8.795 -2.323 -6.056 528 H ARG 64 H ARG 64 4.016 -5.366 -7.750 529 HA ARG 64 HA ARG 64 2.549 -3.506 -6.161 530 HB2 ARG 64 HB2 ARG 64 2.674 -3.366 -8.621 531 HB3 ARG 64 HB3 ARG 64 1.800 -4.889 -8.777 532 HG2 ARG 64 HG2 ARG 64 0.392 -2.885 -9.208 533 HG3 ARG 64 HG3 ARG 64 -0.225 -3.906 -7.916 534 HD2 ARG 64 HD2 ARG 64 0.871 -2.299 -6.235 535 HD3 ARG 64 HD3 ARG 64 1.326 -1.312 -7.614 536 HE ARG 64 HE ARG 64 -0.737 -0.385 -7.564 537 HH11 ARG 64 HH11 ARG 64 -0.953 -3.497 -5.886 538 HH12 ARG 64 HH12 ARG 64 -2.652 -3.349 -5.547 539 HH21 ARG 64 HH21 ARG 64 -2.855 -0.099 -6.964 540 HH22 ARG 64 HH22 ARG 64 -3.794 -1.367 -6.196 541 H GLU 65 H GLU 65 1.965 -6.975 -6.896 542 HA GLU 65 HA GLU 65 -0.710 -7.136 -6.007 543 HB2 GLU 65 HB2 GLU 65 0.430 -8.825 -7.353 544 HB3 GLU 65 HB3 GLU 65 1.545 -9.185 -6.034 545 HG2 GLU 65 HG2 GLU 65 -1.265 -9.450 -5.174 546 HG3 GLU 65 HG3 GLU 65 -0.945 -10.404 -6.616 547 H ALA 66 H ALA 66 2.388 -7.496 -4.232 548 HA ALA 66 HA ALA 66 1.195 -8.137 -1.730 549 HB1 ALA 66 HB1 ALA 66 3.827 -6.796 -2.377 550 HB2 ALA 66 HB2 ALA 66 3.413 -7.575 -0.834 551 HB3 ALA 66 HB3 ALA 66 3.562 -8.554 -2.314 552 H LEU 67 H LEU 67 2.356 -4.943 -3.037 553 HA LEU 67 HA LEU 67 1.699 -3.452 -0.726 554 HB2 LEU 67 HB2 LEU 67 2.768 -2.807 -3.212 555 HB3 LEU 67 HB3 LEU 67 1.236 -1.970 -3.255 556 HG LEU 67 HG LEU 67 3.501 -1.651 -1.247 557 HD11 LEU 67 HD11 LEU 67 3.580 0.662 -2.075 558 HD12 LEU 67 HD12 LEU 67 3.726 -0.453 -3.429 559 HD13 LEU 67 HD13 LEU 67 2.182 0.362 -3.133 560 HD21 LEU 67 HD21 LEU 67 2.262 0.168 -0.157 561 HD22 LEU 67 HD22 LEU 67 0.810 -0.230 -1.089 562 HD23 LEU 67 HD23 LEU 67 1.474 -1.383 0.094 563 H SER 68 H SER 68 -0.292 -4.704 -3.299 564 HA SER 68 HA SER 68 -2.632 -3.155 -3.060 565 HB2 SER 68 HB2 SER 68 -1.809 -5.228 -4.653 566 HB3 SER 68 HB3 SER 68 -2.834 -6.092 -3.543 567 HG SER 68 HG SER 68 -4.110 -5.524 -5.170 568 H TYR 69 H TYR 69 -1.330 -5.768 -0.972 569 HA TYR 69 HA TYR 69 -3.883 -6.204 0.404 570 HB2 TYR 69 HB2 TYR 69 -1.106 -7.273 0.648 571 HB3 TYR 69 HB3 TYR 69 -2.002 -7.114 2.145 572 HD1 TYR 69 HD1 TYR 69 -4.032 -8.384 2.600 573 HD2 TYR 69 HD2 TYR 69 -1.846 -8.879 -1.089 574 HE1 TYR 69 HE1 TYR 69 -5.352 -10.410 2.109 575 HE2 TYR 69 HE2 TYR 69 -3.162 -10.902 -1.601 576 HH TYR 69 HH TYR 69 -5.706 -12.199 0.597 577 H TYR 70 H TYR 70 -0.862 -4.299 0.991 578 HA TYR 70 HA TYR 70 -1.778 -3.394 3.544 579 HB2 TYR 70 HB2 TYR 70 0.483 -2.683 1.746 580 HB3 TYR 70 HB3 TYR 70 -0.051 -1.452 2.891 581 HD1 TYR 70 HD1 TYR 70 -0.070 -5.216 3.364 582 HD2 TYR 70 HD2 TYR 70 1.648 -1.418 4.549 583 HE1 TYR 70 HE1 TYR 70 1.006 -6.301 5.293 584 HE2 TYR 70 HE2 TYR 70 2.742 -2.534 6.458 585 HH TYR 70 HH TYR 70 3.312 -4.756 7.376 586 H SER 71 H SER 71 -2.137 -1.986 0.297 587 HA SER 71 HA SER 71 -3.645 0.288 1.329 588 HB2 SER 71 HB2 SER 71 -4.308 0.630 -1.032 589 HB3 SER 71 HB3 SER 71 -2.570 0.631 -0.696 590 HG SER 71 HG SER 71 -4.147 -1.370 -1.938 591 H ALA 72 H ALA 72 -4.500 -2.870 1.452 592 HA ALA 72 HA ALA 72 -7.402 -2.357 1.249 593 HB1 ALA 72 HB1 ALA 72 -7.663 -4.728 0.673 594 HB2 ALA 72 HB2 ALA 72 -6.652 -3.906 -0.537 595 HB3 ALA 72 HB3 ALA 72 -5.904 -4.944 0.699 596 H SER 73 H SER 73 -5.083 -2.164 3.336 597 HA SER 73 HA SER 73 -5.585 -4.230 5.309 598 HB2 SER 73 HB2 SER 73 -4.742 -1.337 5.838 599 HB3 SER 73 HB3 SER 73 -4.637 -2.673 6.989 600 HG SER 73 HG SER 73 -3.240 -2.284 4.581 601 HA PRO 74 HA PRO 74 -9.603 -2.938 6.668 602 HB2 PRO 74 HB2 PRO 74 -9.550 -3.498 9.397 603 HB3 PRO 74 HB3 PRO 74 -9.806 -4.729 8.111 604 HG2 PRO 74 HG2 PRO 74 -7.300 -3.963 9.587 605 HG3 PRO 74 HG3 PRO 74 -7.882 -5.614 9.185 606 HD2 PRO 74 HD2 PRO 74 -5.942 -4.395 7.701 607 HD3 PRO 74 HD3 PRO 74 -7.186 -5.394 6.930 608 H ALA 75 H ALA 75 -6.877 -2.015 8.866 609 HA ALA 75 HA ALA 75 -8.137 0.238 9.952 610 HB1 ALA 75 HB1 ALA 75 -6.183 -0.986 10.860 611 HB2 ALA 75 HB2 ALA 75 -5.163 -0.277 9.570 612 HB3 ALA 75 HB3 ALA 75 -5.966 0.773 10.768 613 H TYR 76 H TYR 76 -6.334 -0.091 6.881 614 HA TYR 76 HA TYR 76 -5.938 2.762 6.484 615 HB2 TYR 76 HB2 TYR 76 -4.609 1.175 5.150 616 HB3 TYR 76 HB3 TYR 76 -6.044 0.350 4.609 617 HD1 TYR 76 HD1 TYR 76 -4.155 3.616 4.211 618 HD2 TYR 76 HD2 TYR 76 -7.277 1.021 2.701 619 HE1 TYR 76 HE1 TYR 76 -4.330 4.976 2.198 620 HE2 TYR 76 HE2 TYR 76 -7.384 2.354 0.646 621 HH TYR 76 HH TYR 76 -6.590 4.179 -0.471 622 H LEU 77 H LEU 77 -8.378 0.460 5.296 623 HA LEU 77 HA LEU 77 -9.908 2.455 3.946 624 HB2 LEU 77 HB2 LEU 77 -10.862 -0.224 5.028 625 HB3 LEU 77 HB3 LEU 77 -11.602 0.734 3.755 626 HG LEU 77 HG LEU 77 -8.789 -0.350 3.447 627 HD11 LEU 77 HD11 LEU 77 -10.267 -2.186 3.992 628 HD12 LEU 77 HD12 LEU 77 -11.352 -1.705 2.669 629 HD13 LEU 77 HD13 LEU 77 -9.703 -2.277 2.311 630 HD21 LEU 77 HD21 LEU 77 -9.239 -0.076 1.056 631 HD22 LEU 77 HD22 LEU 77 -10.871 0.544 1.423 632 HD23 LEU 77 HD23 LEU 77 -9.448 1.461 1.916 633 H SER 78 H SER 78 -10.267 0.904 7.138 634 HA SER 78 HA SER 78 -12.564 2.302 8.000 635 HB2 SER 78 HB2 SER 78 -11.374 0.278 9.041 636 HB3 SER 78 HB3 SER 78 -10.220 1.425 9.740 637 HG SER 78 HG SER 78 -13.024 1.248 10.213 638 H CYS 79 H CYS 79 -9.171 3.358 7.863 639 HA CYS 79 HA CYS 79 -9.606 5.767 9.394 640 HB2 CYS 79 HB2 CYS 79 -7.439 4.434 9.234 641 HB3 CYS 79 HB3 CYS 79 -7.186 5.227 7.662 642 HG CYS 79 HG CYS 79 -5.854 6.809 8.941 643 H GLN 80 H GLN 80 -10.971 5.151 6.543 644 HA GLN 80 HA GLN 80 -10.341 6.915 4.570 645 HB2 GLN 80 HB2 GLN 80 -12.836 7.162 4.232 646 HB3 GLN 80 HB3 GLN 80 -12.180 5.541 4.233 647 HG2 GLN 80 HG2 GLN 80 -13.032 5.268 6.615 648 HG3 GLN 80 HG3 GLN 80 -13.791 6.848 6.460 649 HE21 GLN 80 HE21 GLN 80 -16.028 6.633 5.984 650 HE22 GLN 80 HE22 GLN 80 -16.612 5.372 4.902 651 H LYS 81 H LYS 81 -9.413 8.907 5.083 652 HA LYS 81 HA LYS 81 -11.257 10.919 6.266 653 HB2 LYS 81 HB2 LYS 81 -8.347 10.478 6.882 654 HB3 LYS 81 HB3 LYS 81 -9.153 12.020 7.170 655 HG2 LYS 81 HG2 LYS 81 -10.139 9.373 8.288 656 HG3 LYS 81 HG3 LYS 81 -9.092 10.518 9.148 657 HD2 LYS 81 HD2 LYS 81 -11.119 12.166 8.558 658 HD3 LYS 81 HD3 LYS 81 -12.019 10.631 8.453 659 HE2 LYS 81 HE2 LYS 81 -11.207 9.995 10.689 660 HE3 LYS 81 HE3 LYS 81 -10.265 11.497 10.783 661 HZ1 LYS 81 HZ1 LYS 81 -13.205 11.252 10.791 662 HZ2 LYS 81 HZ2 LYS 81 -12.256 11.813 11.978 663 HZ3 LYS 81 HZ3 LYS 81 -12.410 12.701 10.602 664 HA PRO 82 HA PRO 82 -10.052 12.608 2.206 665 HB2 PRO 82 HB2 PRO 82 -12.116 14.394 1.960 666 HB3 PRO 82 HB3 PRO 82 -12.296 12.647 1.634 667 HG2 PRO 82 HG2 PRO 82 -13.003 14.152 4.156 668 HG3 PRO 82 HG3 PRO 82 -14.011 12.955 3.290 669 HD2 PRO 82 HD2 PRO 82 -12.482 12.317 5.497 670 HD3 PRO 82 HD3 PRO 82 -12.749 11.155 4.174 671 H ASP 83 H ASP 83 -9.339 14.801 1.695 672 HA ASP 83 HA ASP 83 -8.015 16.608 2.185 673 HB2 ASP 83 HB2 ASP 83 -10.044 17.756 2.704 674 HB3 ASP 83 HB3 ASP 83 -10.024 17.150 4.370 675 H THR 84 H THR 84 -6.443 15.030 2.586 676 HA THR 84 HA THR 84 -5.291 15.212 5.312 677 HB THR 84 HB THR 84 -6.514 13.116 5.275 678 HG1 THR 84 HG1 THR 84 -4.634 12.884 6.402 679 HG21 THR 84 HG21 THR 84 -5.954 11.282 3.756 680 HG22 THR 84 HG22 THR 84 -6.583 12.656 2.849 681 HG23 THR 84 HG23 THR 84 -4.827 12.325 2.861 682 H ALA 85 H ALA 85 -4.768 15.169 1.865 683 HA ALA 85 HA ALA 85 -2.961 15.661 0.578 684 HB1 ALA 85 HB1 ALA 85 -2.761 17.604 2.018 685 HB2 ALA 85 HB2 ALA 85 -1.664 16.699 3.092 686 HB3 ALA 85 HB3 ALA 85 -1.196 17.022 1.404 687 H ARG 86 H ARG 86 -2.432 13.775 -0.245 688 HA ARG 86 HA ARG 86 -0.963 11.799 1.369 689 HB2 ARG 86 HB2 ARG 86 -1.080 11.744 -1.656 690 HB3 ARG 86 HB3 ARG 86 -0.767 10.446 -0.555 691 HG2 ARG 86 HG2 ARG 86 -2.847 9.870 -1.188 692 HG3 ARG 86 HG3 ARG 86 -3.288 10.859 0.208 693 HD2 ARG 86 HD2 ARG 86 -4.227 12.489 -1.111 694 HD3 ARG 86 HD3 ARG 86 -2.957 12.345 -2.335 695 HE ARG 86 HE ARG 86 -4.764 10.093 -2.390 696 HH11 ARG 86 HH11 ARG 86 -4.200 13.410 -3.531 697 HH12 ARG 86 HH12 ARG 86 -5.031 13.183 -5.044 698 HH21 ARG 86 HH21 ARG 86 -6.043 9.840 -4.298 699 HH22 ARG 86 HH22 ARG 86 -6.097 11.117 -5.467 700 H VAL 87 H VAL 87 1.218 10.966 0.329 701 HA VAL 87 HA VAL 87 2.911 13.112 -0.687 702 HB VAL 87 HB VAL 87 4.684 12.261 1.015 703 HG11 VAL 87 HG11 VAL 87 2.406 14.036 1.987 704 HG12 VAL 87 HG12 VAL 87 4.077 13.956 2.650 705 HG13 VAL 87 HG13 VAL 87 3.800 14.536 1.018 706 HG21 VAL 87 HG21 VAL 87 2.191 11.571 2.643 707 HG22 VAL 87 HG22 VAL 87 3.327 10.390 1.947 708 HG23 VAL 87 HG23 VAL 87 3.875 11.537 3.182 709 H ASP 88 H ASP 88 4.836 12.333 -1.669 710 HA ASP 88 HA ASP 88 4.555 9.612 -2.801 711 HB2 ASP 88 HB2 ASP 88 5.858 10.415 -4.660 712 HB3 ASP 88 HB3 ASP 88 4.421 11.387 -4.397 713 H ILE 89 H ILE 89 6.894 8.899 -3.672 714 HA ILE 89 HA ILE 89 8.231 8.082 -1.308 715 HB ILE 89 HB ILE 89 9.977 7.153 -2.926 716 HG12 ILE 89 HG12 ILE 89 8.152 8.124 -5.154 717 HG13 ILE 89 HG13 ILE 89 9.644 8.931 -4.708 718 HG21 ILE 89 HG21 ILE 89 7.144 6.490 -3.767 719 HG22 ILE 89 HG22 ILE 89 8.552 5.419 -3.752 720 HG23 ILE 89 HG23 ILE 89 7.856 5.961 -2.215 721 HD11 ILE 89 HD11 ILE 89 9.435 6.041 -5.660 722 HD12 ILE 89 HD12 ILE 89 10.060 7.459 -6.546 723 HD13 ILE 89 HD13 ILE 89 10.922 6.875 -5.118 724 H TYR 90 H TYR 90 8.709 10.911 -3.311 725 HA TYR 90 HA TYR 90 11.437 11.391 -2.281 726 HB2 TYR 90 HB2 TYR 90 9.593 13.148 -3.910 727 HB3 TYR 90 HB3 TYR 90 11.298 13.417 -3.618 728 HD1 TYR 90 HD1 TYR 90 11.789 10.121 -4.222 729 HD2 TYR 90 HD2 TYR 90 9.939 13.452 -6.268 730 HE1 TYR 90 HE1 TYR 90 12.518 9.218 -6.389 731 HE2 TYR 90 HE2 TYR 90 10.613 12.517 -8.430 732 HH TYR 90 HH TYR 90 11.514 10.708 -9.458 733 H GLY 91 H GLY 91 8.252 11.766 -1.164 734 HA2 GLY 91 HA2 GLY 91 7.631 12.535 0.941 735 HA3 GLY 91 HA3 GLY 91 9.107 13.517 1.034 736 H ASN 92 H ASN 92 7.558 13.999 -2.020 737 HA ASN 92 HA ASN 92 6.932 16.738 -1.264 738 HB2 ASN 92 HB2 ASN 92 5.950 15.281 -3.744 739 HB3 ASN 92 HB3 ASN 92 6.070 17.009 -3.501 740 HD21 ASN 92 HD21 ASN 92 7.505 14.473 -5.017 741 HD22 ASN 92 HD22 ASN 92 9.107 15.202 -5.250 742 H GLU 93 H GLU 93 4.906 17.700 -1.097 743 HA GLU 93 HA GLU 93 2.722 16.013 -0.216 744 HB2 GLU 93 HB2 GLU 93 3.453 18.942 -0.421 745 HB3 GLU 93 HB3 GLU 93 1.768 18.501 -0.211 746 HG2 GLU 93 HG2 GLU 93 2.072 17.549 1.890 747 HG3 GLU 93 HG3 GLU 93 3.783 17.194 1.613 748 H VAL 94 H VAL 94 1.001 15.534 -1.370 749 HA VAL 94 HA VAL 94 0.661 16.632 -4.063 750 HB VAL 94 HB VAL 94 0.042 14.601 -5.022 751 HG11 VAL 94 HG11 VAL 94 2.187 13.807 -5.375 752 HG12 VAL 94 HG12 VAL 94 2.541 15.366 -4.671 753 HG13 VAL 94 HG13 VAL 94 2.665 13.934 -3.654 754 HG21 VAL 94 HG21 VAL 94 -0.894 13.456 -3.036 755 HG22 VAL 94 HG22 VAL 94 0.235 12.439 -3.965 756 HG23 VAL 94 HG23 VAL 94 0.773 13.176 -2.462 757 H ASP 95 H ASP 95 -1.801 15.823 -4.789 758 HA ASP 95 HA ASP 95 -3.356 17.661 -3.245 759 HB2 ASP 95 HB2 ASP 95 -4.505 15.510 -5.060 760 HB3 ASP 95 HB3 ASP 95 -5.082 17.145 -4.840 761 H VAL 96 H VAL 96 -5.797 16.762 -2.682 762 HA VAL 96 HA VAL 96 -5.325 14.470 -0.837 763 HB VAL 96 HB VAL 96 -6.880 15.435 0.594 764 HG11 VAL 96 HG11 VAL 96 -5.927 17.520 1.178 765 HG12 VAL 96 HG12 VAL 96 -4.636 16.726 0.255 766 HG13 VAL 96 HG13 VAL 96 -5.608 17.963 -0.503 767 HG21 VAL 96 HG21 VAL 96 -8.260 17.423 0.075 768 HG22 VAL 96 HG22 VAL 96 -7.672 17.399 -1.595 769 HG23 VAL 96 HG23 VAL 96 -8.688 16.074 -0.969 770 H VAL 97 H VAL 97 -7.104 13.180 -0.214 771 HA VAL 97 HA VAL 97 -8.383 11.954 -2.515 772 HB VAL 97 HB VAL 97 -8.793 11.393 0.466 773 HG11 VAL 97 HG11 VAL 97 -9.417 9.113 -0.366 774 HG12 VAL 97 HG12 VAL 97 -10.505 10.374 -0.970 775 HG13 VAL 97 HG13 VAL 97 -9.261 9.731 -2.042 776 HG21 VAL 97 HG21 VAL 97 -7.128 9.593 0.243 777 HG22 VAL 97 HG22 VAL 97 -6.804 10.079 -1.425 778 HG23 VAL 97 HG23 VAL 97 -6.376 11.152 -0.069 779 H THR 98 H THR 98 -10.525 12.273 -3.192 780 HA THR 98 HA THR 98 -11.941 14.566 -2.215 781 HB THR 98 HB THR 98 -13.701 13.765 -3.825 782 HG1 THR 98 HG1 THR 98 -13.083 11.958 -5.132 783 HG21 THR 98 HG21 THR 98 -11.707 15.106 -4.517 784 HG22 THR 98 HG22 THR 98 -10.932 13.607 -5.058 785 HG23 THR 98 HG23 THR 98 -12.451 14.161 -5.802 786 HA PRO 99 HA PRO 99 -14.318 12.822 1.022 787 HB2 PRO 99 HB2 PRO 99 -16.898 13.702 0.696 788 HB3 PRO 99 HB3 PRO 99 -15.551 14.748 1.234 789 HG2 PRO 99 HG2 PRO 99 -16.648 14.430 -1.576 790 HG3 PRO 99 HG3 PRO 99 -16.290 15.940 -0.699 791 HD2 PRO 99 HD2 PRO 99 -14.546 14.936 -2.459 792 HD3 PRO 99 HD3 PRO 99 -13.935 15.631 -0.946 793 H GLU 100 H GLU 100 -15.748 12.370 -2.210 794 HA GLU 100 HA GLU 100 -17.311 10.088 -1.434 795 HB2 GLU 100 HB2 GLU 100 -16.516 11.227 -4.128 796 HB3 GLU 100 HB3 GLU 100 -17.616 9.848 -3.896 797 HG2 GLU 100 HG2 GLU 100 -19.028 11.272 -2.367 798 HG3 GLU 100 HG3 GLU 100 -18.003 12.658 -2.725 799 H GLN 101 H GLN 101 -14.099 10.421 -3.155 800 HA GLN 101 HA GLN 101 -13.905 7.558 -3.372 801 HB2 GLN 101 HB2 GLN 101 -11.808 9.725 -3.583 802 HB3 GLN 101 HB3 GLN 101 -11.484 7.994 -3.828 803 HG2 GLN 101 HG2 GLN 101 -13.329 7.917 -5.541 804 HG3 GLN 101 HG3 GLN 101 -13.510 9.656 -5.395 805 HE21 GLN 101 HE21 GLN 101 -13.103 9.021 -7.837 806 HE22 GLN 101 HE22 GLN 101 -11.475 9.392 -8.377 807 H ALA 102 H ALA 102 -13.098 9.820 -0.748 808 HA ALA 102 HA ALA 102 -11.519 7.898 0.713 809 HB1 ALA 102 HB1 ALA 102 -11.904 9.402 2.641 810 HB2 ALA 102 HB2 ALA 102 -11.424 10.332 1.212 811 HB3 ALA 102 HB3 ALA 102 -13.125 10.303 1.719 812 H LYS 103 H LYS 103 -15.028 8.895 1.004 813 HA LYS 103 HA LYS 103 -15.520 6.938 3.009 814 HB2 LYS 103 HB2 LYS 103 -17.893 7.342 2.708 815 HB3 LYS 103 HB3 LYS 103 -16.998 8.867 2.672 816 HG2 LYS 103 HG2 LYS 103 -17.059 8.730 0.162 817 HG3 LYS 103 HG3 LYS 103 -18.102 7.320 0.270 818 HD2 LYS 103 HD2 LYS 103 -19.306 9.346 -0.276 819 HD3 LYS 103 HD3 LYS 103 -19.859 8.653 1.258 820 HE2 LYS 103 HE2 LYS 103 -18.638 10.330 2.523 821 HE3 LYS 103 HE3 LYS 103 -17.813 10.922 1.082 822 HZ1 LYS 103 HZ1 LYS 103 -19.838 12.150 2.034 823 HZ2 LYS 103 HZ2 LYS 103 -19.677 12.066 0.424 824 HZ3 LYS 103 HZ3 LYS 103 -20.741 11.067 1.206 825 H TYR 104 H TYR 104 -15.560 6.616 -0.491 826 HA TYR 104 HA TYR 104 -16.882 4.076 -0.815 827 HB2 TYR 104 HB2 TYR 104 -14.882 5.755 -2.305 828 HB3 TYR 104 HB3 TYR 104 -15.017 4.060 -2.723 829 HD1 TYR 104 HD1 TYR 104 -15.958 6.997 -4.064 830 HD2 TYR 104 HD2 TYR 104 -17.792 3.340 -2.670 831 HE1 TYR 104 HE1 TYR 104 -17.731 7.233 -5.763 832 HE2 TYR 104 HE2 TYR 104 -19.546 3.580 -4.354 833 HH TYR 104 HH TYR 104 -19.563 6.193 -6.812 834 H ALA 105 H ALA 105 -13.701 4.793 0.637 835 HA ALA 105 HA ALA 105 -12.540 2.253 0.283 836 HB1 ALA 105 HB1 ALA 105 -12.459 4.048 2.723 837 HB2 ALA 105 HB2 ALA 105 -11.268 2.824 2.291 838 HB3 ALA 105 HB3 ALA 105 -11.452 4.270 1.275 839 H TYR 106 H TYR 106 -15.172 3.250 2.505 840 HA TYR 106 HA TYR 106 -15.148 1.073 4.213 841 HB2 TYR 106 HB2 TYR 106 -17.108 1.927 5.012 842 HB3 TYR 106 HB3 TYR 106 -16.727 3.298 4.012 843 HD1 TYR 106 HD1 TYR 106 -17.680 3.038 1.409 844 HD2 TYR 106 HD2 TYR 106 -19.235 0.991 4.875 845 HE1 TYR 106 HE1 TYR 106 -19.761 2.550 0.188 846 HE2 TYR 106 HE2 TYR 106 -21.298 0.465 3.634 847 HH TYR 106 HH TYR 106 -22.456 0.679 1.661 848 H GLN 107 H GLN 107 -16.484 1.304 0.994 849 HA GLN 107 HA GLN 107 -18.088 -0.997 0.940 850 HB2 GLN 107 HB2 GLN 107 -18.446 -0.465 -1.210 851 HB3 GLN 107 HB3 GLN 107 -17.766 1.065 -0.648 852 HG2 GLN 107 HG2 GLN 107 -15.586 0.392 -1.641 853 HG3 GLN 107 HG3 GLN 107 -16.351 -1.005 -2.256 854 HE21 GLN 107 HE21 GLN 107 -15.161 1.641 -3.514 855 HE22 GLN 107 HE22 GLN 107 -16.351 1.875 -4.778 856 H ARG 108 H ARG 108 -14.813 -0.421 0.186 857 HA ARG 108 HA ARG 108 -14.042 -3.130 -0.555 858 HB2 ARG 108 HB2 ARG 108 -12.179 -0.984 0.526 859 HB3 ARG 108 HB3 ARG 108 -11.736 -2.357 -0.475 860 HG2 ARG 108 HG2 ARG 108 -13.481 -0.002 -1.328 861 HG3 ARG 108 HG3 ARG 108 -11.791 -0.198 -1.720 862 HD2 ARG 108 HD2 ARG 108 -12.271 -2.341 -2.926 863 HD3 ARG 108 HD3 ARG 108 -13.979 -2.190 -2.521 864 HE ARG 108 HE ARG 108 -14.310 -0.872 -4.291 865 HH11 ARG 108 HH11 ARG 108 -10.773 -0.787 -3.695 866 HH12 ARG 108 HH12 ARG 108 -10.451 -0.177 -5.282 867 HH21 ARG 108 HH21 ARG 108 -13.826 0.121 -6.272 868 HH22 ARG 108 HH22 ARG 108 -12.198 0.365 -6.747 869 H TYR 109 H TYR 109 -14.191 -1.464 2.608 870 HA TYR 109 HA TYR 109 -12.635 -3.471 3.976 871 HB2 TYR 109 HB2 TYR 109 -13.055 -1.218 4.853 872 HB3 TYR 109 HB3 TYR 109 -14.759 -1.518 5.011 873 HD1 TYR 109 HD1 TYR 109 -15.507 -3.583 6.533 874 HD2 TYR 109 HD2 TYR 109 -11.734 -1.490 6.823 875 HE1 TYR 109 HE1 TYR 109 -15.199 -4.496 8.754 876 HE2 TYR 109 HE2 TYR 109 -11.475 -2.325 9.134 877 HH TYR 109 HH TYR 109 -13.700 -4.748 10.545 878 H GLN 110 H GLN 110 -16.180 -2.862 3.746 879 HA GLN 110 HA GLN 110 -16.896 -5.276 5.005 880 HB2 GLN 110 HB2 GLN 110 -19.123 -4.908 4.248 881 HB3 GLN 110 HB3 GLN 110 -18.421 -3.399 4.840 882 HG2 GLN 110 HG2 GLN 110 -18.138 -2.595 2.551 883 HG3 GLN 110 HG3 GLN 110 -18.683 -4.147 1.888 884 HE21 GLN 110 HE21 GLN 110 -20.805 -4.089 1.188 885 HE22 GLN 110 HE22 GLN 110 -22.062 -3.176 2.067 886 H GLU 111 H GLU 111 -16.019 -4.710 1.687 887 HA GLU 111 HA GLU 111 -17.257 -6.939 0.466 888 HB2 GLU 111 HB2 GLU 111 -14.689 -5.395 0.003 889 HB3 GLU 111 HB3 GLU 111 -14.803 -6.946 -0.759 890 HG2 GLU 111 HG2 GLU 111 -16.555 -4.557 -1.254 891 HG3 GLU 111 HG3 GLU 111 -15.452 -5.339 -2.350 892 H ARG 112 H ARG 112 -14.232 -6.774 2.320 893 HA ARG 112 HA ARG 112 -13.985 -9.740 2.141 894 HB2 ARG 112 HB2 ARG 112 -11.812 -7.791 2.808 895 HB3 ARG 112 HB3 ARG 112 -11.727 -9.531 2.481 896 HG2 ARG 112 HG2 ARG 112 -12.985 -8.851 0.210 897 HG3 ARG 112 HG3 ARG 112 -12.337 -7.252 0.585 898 HD2 ARG 112 HD2 ARG 112 -10.766 -8.190 -0.843 899 HD3 ARG 112 HD3 ARG 112 -10.083 -8.367 0.785 900 HE ARG 112 HE ARG 112 -10.012 -10.600 0.464 901 HH11 ARG 112 HH11 ARG 112 -12.668 -9.498 -1.706 902 HH12 ARG 112 HH12 ARG 112 -12.710 -10.978 -2.569 903 HH21 ARG 112 HH21 ARG 112 -10.103 -12.518 -0.734 904 HH22 ARG 112 HH22 ARG 112 -11.322 -12.754 -1.957 905 H TYR 113 H TYR 113 -13.861 -7.109 4.565 906 HA TYR 113 HA TYR 113 -13.689 -9.051 6.759 907 HB2 TYR 113 HB2 TYR 113 -13.874 -6.021 6.794 908 HB3 TYR 113 HB3 TYR 113 -13.436 -7.055 8.151 909 HD1 TYR 113 HD1 TYR 113 -12.119 -5.023 5.576 910 HD2 TYR 113 HD2 TYR 113 -11.380 -8.707 7.668 911 HE1 TYR 113 HE1 TYR 113 -9.750 -5.001 4.772 912 HE2 TYR 113 HE2 TYR 113 -9.048 -8.694 6.919 913 HH TYR 113 HH TYR 113 -7.484 -7.679 5.507 914 H GLY 114 H GLY 114 -16.232 -8.017 4.913 915 HA2 GLY 114 HA2 GLY 114 -18.220 -8.164 7.135 916 HA3 GLY 114 HA3 GLY 114 -18.390 -7.110 5.718 917 H ASN 115 H ASN 115 -20.321 -8.214 5.051 918 HA ASN 115 HA ASN 115 -19.948 -10.919 3.876 919 HB2 ASN 115 HB2 ASN 115 -21.380 -10.989 5.917 920 HB3 ASN 115 HB3 ASN 115 -22.420 -9.752 5.198 921 HD21 ASN 115 HD21 ASN 115 -24.295 -11.190 5.280 922 HD22 ASN 115 HD22 ASN 115 -24.436 -12.507 4.151 923 H LYS 116 H LYS 116 -21.475 -11.211 2.003 924 HA LYS 116 HA LYS 116 -21.350 -8.878 0.245 925 HB2 LYS 116 HB2 LYS 116 -22.297 -11.735 -0.143 926 HB3 LYS 116 HB3 LYS 116 -22.453 -10.497 -1.406 927 HG2 LYS 116 HG2 LYS 116 -20.076 -10.059 -1.408 928 HG3 LYS 116 HG3 LYS 116 -19.795 -11.180 -0.084 929 HD2 LYS 116 HD2 LYS 116 -20.981 -11.945 -2.790 930 HD3 LYS 116 HD3 LYS 116 -19.272 -12.082 -2.408 931 HE2 LYS 116 HE2 LYS 116 -21.531 -13.566 -0.972 932 HE3 LYS 116 HE3 LYS 116 -20.523 -14.236 -2.245 933 HZ1 LYS 116 HZ1 LYS 116 -19.710 -14.931 -0.187 934 HZ2 LYS 116 HZ2 LYS 116 -18.587 -13.856 -0.767 935 HZ3 LYS 116 HZ3 LYS 116 -19.602 -13.408 0.433 936 H LYS 117 H LYS 117 -24.267 -10.742 -0.110 937 HA LYS 117 HA LYS 117 -25.966 -8.869 1.310 938 HB2 LYS 117 HB2 LYS 117 -25.197 -7.790 -0.946 939 HB3 LYS 117 HB3 LYS 117 -26.225 -8.993 -1.723 940 HG2 LYS 117 HG2 LYS 117 -28.205 -8.012 -0.699 941 HG3 LYS 117 HG3 LYS 117 -27.227 -7.038 0.401 942 HD2 LYS 117 HD2 LYS 117 -28.256 -5.785 -1.514 943 HD3 LYS 117 HD3 LYS 117 -26.496 -5.606 -1.388 944 HE2 LYS 117 HE2 LYS 117 -26.095 -7.124 -3.181 945 HE3 LYS 117 HE3 LYS 117 -27.768 -7.698 -3.190 946 HZ1 LYS 117 HZ1 LYS 117 -27.001 -4.935 -3.934 947 HZ2 LYS 117 HZ2 LYS 117 -27.213 -6.146 -5.001 948 HZ3 LYS 117 HZ3 LYS 117 -28.486 -5.667 -4.086 949 H SER 118 H SER 118 -28.382 -9.590 -0.092 950 HA SER 118 HA SER 118 -28.923 -12.149 0.991 951 HB2 SER 118 HB2 SER 118 -31.132 -11.600 -0.300 952 HB3 SER 118 HB3 SER 118 -30.620 -10.523 1.003 953 HG SER 118 HG SER 118 -30.744 -10.064 -1.744 954 H GLN 119 H GLN 119 -30.330 -13.610 -0.543 955 HA GLN 119 HA GLN 119 -28.983 -14.290 -3.072 956 HB2 GLN 119 HB2 GLN 119 -29.492 -15.972 -0.604 957 HB3 GLN 119 HB3 GLN 119 -29.850 -16.701 -2.167 958 HG2 GLN 119 HG2 GLN 119 -27.165 -15.381 -1.571 959 HG3 GLN 119 HG3 GLN 119 -27.479 -17.090 -1.282 960 HE21 GLN 119 HE21 GLN 119 -28.279 -18.405 -3.179 961 HE22 GLN 119 HE22 GLN 119 -27.834 -17.975 -4.801 962 H ASP 120 H ASP 120 -30.535 -13.569 -4.410 963 HA ASP 120 HA ASP 120 -33.338 -14.225 -3.936 964 HB2 ASP 120 HB2 ASP 120 -33.916 -11.780 -4.421 965 HB3 ASP 120 HB3 ASP 120 -33.224 -12.109 -2.854 966 H LEU 121 H LEU 121 -34.464 -12.977 -5.894 967 HA LEU 121 HA LEU 121 -35.046 -12.980 -8.027 968 HB2 LEU 121 HB2 LEU 121 -32.085 -12.784 -8.602 969 HB3 LEU 121 HB3 LEU 121 -33.340 -12.631 -9.824 970 HG LEU 121 HG LEU 121 -33.149 -10.798 -7.401 971 HD11 LEU 121 HD11 LEU 121 -31.158 -10.571 -8.833 972 HD12 LEU 121 HD12 LEU 121 -32.194 -10.351 -10.262 973 HD13 LEU 121 HD13 LEU 121 -32.196 -9.144 -8.948 974 HD21 LEU 121 HD21 LEU 121 -35.407 -10.850 -8.348 975 HD22 LEU 121 HD22 LEU 121 -34.618 -9.328 -8.752 976 HD23 LEU 121 HD23 LEU 121 -34.755 -10.602 -9.986 977 H LYS 122 H LYS 122 -32.559 -14.612 -9.595 978 HA LYS 122 HA LYS 122 -33.457 -17.330 -9.140 979 HB2 LYS 122 HB2 LYS 122 -33.730 -15.922 -11.847 980 HB3 LYS 122 HB3 LYS 122 -33.716 -17.671 -11.604 981 HG2 LYS 122 HG2 LYS 122 -35.781 -17.496 -10.194 982 HG3 LYS 122 HG3 LYS 122 -35.827 -15.754 -10.532 983 HD2 LYS 122 HD2 LYS 122 -37.347 -16.846 -12.038 984 HD3 LYS 122 HD3 LYS 122 -35.968 -16.232 -12.972 985 HE2 LYS 122 HE2 LYS 122 -34.948 -18.547 -12.872 986 HE3 LYS 122 HE3 LYS 122 -36.394 -19.115 -12.032 987 HZ1 LYS 122 HZ1 LYS 122 -36.464 -19.573 -14.388 988 HZ2 LYS 122 HZ2 LYS 122 -37.668 -18.514 -14.004 989 HZ3 LYS 122 HZ3 LYS 122 -36.300 -17.983 -14.761 Start of MODEL 5 1 H1 GLY 1 H GLY 1 29.122 2.568 9.219 2 HA2 GLY 1 HA2 GLY 1 26.958 1.046 10.559 3 HA3 GLY 1 HA3 GLY 1 26.774 1.826 8.966 4 H SER 2 H SER 2 26.268 -0.815 8.810 5 HA SER 2 HA SER 2 28.541 -1.852 7.307 6 HB2 SER 2 HB2 SER 2 28.427 -4.023 8.631 7 HB3 SER 2 HB3 SER 2 29.131 -2.660 9.502 8 HG SER 2 HG SER 2 26.494 -3.706 9.797 9 H ASN 3 H ASN 3 27.736 -4.188 6.535 10 HA ASN 3 HA ASN 3 26.357 -5.363 5.274 11 HB2 ASN 3 HB2 ASN 3 24.014 -4.367 6.900 12 HB3 ASN 3 HB3 ASN 3 24.257 -5.964 6.194 13 HD21 ASN 3 HD21 ASN 3 26.202 -7.249 7.159 14 HD22 ASN 3 HD22 ASN 3 26.483 -7.023 8.876 15 H GLN 4 H GLN 4 23.945 -5.232 4.216 16 HA GLN 4 HA GLN 4 23.567 -2.652 2.811 17 HB2 GLN 4 HB2 GLN 4 24.155 -5.341 1.528 18 HB3 GLN 4 HB3 GLN 4 23.226 -4.101 0.689 19 HG2 GLN 4 HG2 GLN 4 25.063 -2.528 0.746 20 HG3 GLN 4 HG3 GLN 4 25.998 -3.542 1.813 21 HE21 GLN 4 HE21 GLN 4 26.142 -2.554 -1.334 22 HE22 GLN 4 HE22 GLN 4 26.741 -4.011 -2.042 23 H GLN 5 H GLN 5 22.102 -5.895 2.164 24 HA GLN 5 HA GLN 5 19.520 -4.711 2.964 25 HB2 GLN 5 HB2 GLN 5 18.472 -6.614 1.989 26 HB3 GLN 5 HB3 GLN 5 19.633 -5.953 0.846 27 HG2 GLN 5 HG2 GLN 5 21.143 -7.806 1.230 28 HG3 GLN 5 HG3 GLN 5 20.186 -8.373 2.612 29 HE21 GLN 5 HE21 GLN 5 20.375 -8.306 -0.948 30 HE22 GLN 5 HE22 GLN 5 19.005 -9.370 -1.187 31 H LEU 6 H LEU 6 18.023 -6.080 4.255 32 HA LEU 6 HA LEU 6 19.322 -7.670 6.392 33 HB2 LEU 6 HB2 LEU 6 18.137 -6.504 8.130 34 HB3 LEU 6 HB3 LEU 6 19.306 -5.518 7.274 35 HG LEU 6 HG LEU 6 17.403 -4.508 5.930 36 HD11 LEU 6 HD11 LEU 6 15.805 -6.231 7.849 37 HD12 LEU 6 HD12 LEU 6 15.177 -4.636 7.349 38 HD13 LEU 6 HD13 LEU 6 15.507 -5.856 6.148 39 HD21 LEU 6 HD21 LEU 6 18.494 -3.373 7.808 40 HD22 LEU 6 HD22 LEU 6 16.777 -2.980 7.746 41 HD23 LEU 6 HD23 LEU 6 17.348 -4.153 8.949 42 H ASN 7 H ASN 7 16.518 -7.060 4.442 43 HA ASN 7 HA ASN 7 14.724 -8.145 3.908 44 HB2 ASN 7 HB2 ASN 7 16.673 -9.887 3.562 45 HB3 ASN 7 HB3 ASN 7 15.888 -10.768 4.876 46 HD21 ASN 7 HD21 ASN 7 15.964 -12.231 2.724 47 HD22 ASN 7 HD22 ASN 7 14.616 -12.026 1.616 48 H ALA 8 H ALA 8 12.835 -9.479 4.519 49 HA ALA 8 HA ALA 8 12.330 -9.600 7.472 50 HB1 ALA 8 HB1 ALA 8 11.213 -7.642 6.601 51 HB2 ALA 8 HB2 ALA 8 10.431 -8.598 5.323 52 HB3 ALA 8 HB3 ALA 8 10.028 -8.891 7.035 53 H THR 9 H THR 9 12.798 -11.697 7.519 54 HA THR 9 HA THR 9 11.838 -13.752 5.752 55 HB THR 9 HB THR 9 13.287 -13.895 8.430 56 HG1 THR 9 HG1 THR 9 15.131 -13.734 7.239 57 HG21 THR 9 HG21 THR 9 14.236 -15.981 7.484 58 HG22 THR 9 HG22 THR 9 12.483 -16.101 7.662 59 HG23 THR 9 HG23 THR 9 13.194 -15.814 6.056 60 H LYS 10 H LYS 10 9.517 -13.438 5.962 61 HA LYS 10 HA LYS 10 8.457 -15.123 8.075 62 HB2 LYS 10 HB2 LYS 10 8.684 -12.520 8.835 63 HB3 LYS 10 HB3 LYS 10 7.080 -12.454 8.116 64 HG2 LYS 10 HG2 LYS 10 6.315 -14.265 9.613 65 HG3 LYS 10 HG3 LYS 10 7.971 -14.516 10.190 66 HD2 LYS 10 HD2 LYS 10 6.816 -13.225 11.848 67 HD3 LYS 10 HD3 LYS 10 8.031 -12.197 11.067 68 HE2 LYS 10 HE2 LYS 10 6.239 -11.241 9.609 69 HE3 LYS 10 HE3 LYS 10 5.048 -12.266 10.434 70 HZ1 LYS 10 HZ1 LYS 10 6.634 -10.100 11.666 71 HZ2 LYS 10 HZ2 LYS 10 5.068 -10.064 11.248 72 HZ3 LYS 10 HZ3 LYS 10 5.535 -11.082 12.468 73 H LYS 11 H LYS 11 7.066 -12.607 5.921 74 HA LYS 11 HA LYS 11 5.272 -14.624 4.624 75 HB2 LYS 11 HB2 LYS 11 4.798 -11.781 5.610 76 HB3 LYS 11 HB3 LYS 11 3.860 -12.447 4.301 77 HG2 LYS 11 HG2 LYS 11 2.539 -12.696 6.192 78 HG3 LYS 11 HG3 LYS 11 3.141 -14.319 5.838 79 HD2 LYS 11 HD2 LYS 11 4.550 -14.343 7.740 80 HD3 LYS 11 HD3 LYS 11 4.598 -12.571 7.827 81 HE2 LYS 11 HE2 LYS 11 3.257 -13.326 9.644 82 HE3 LYS 11 HE3 LYS 11 2.214 -12.517 8.486 83 HZ1 LYS 11 HZ1 LYS 11 1.418 -14.650 7.748 84 HZ2 LYS 11 HZ2 LYS 11 2.486 -15.466 8.704 85 HZ3 LYS 11 HZ3 LYS 11 1.299 -14.568 9.384 86 H ASP 12 H ASP 12 5.422 -14.545 2.319 87 HA ASP 12 HA ASP 12 7.567 -13.037 1.242 88 HB2 ASP 12 HB2 ASP 12 7.343 -14.271 -0.581 89 HB3 ASP 12 HB3 ASP 12 6.369 -15.281 0.484 90 H LYS 13 H LYS 13 4.089 -12.373 1.344 91 HA LYS 13 HA LYS 13 4.308 -10.218 -0.613 92 HB2 LYS 13 HB2 LYS 13 2.103 -10.476 1.459 93 HB3 LYS 13 HB3 LYS 13 2.040 -9.645 -0.091 94 HG2 LYS 13 HG2 LYS 13 2.170 -12.622 0.426 95 HG3 LYS 13 HG3 LYS 13 0.788 -11.732 -0.232 96 HD2 LYS 13 HD2 LYS 13 3.471 -12.068 -1.583 97 HD3 LYS 13 HD3 LYS 13 2.101 -13.135 -1.837 98 HE2 LYS 13 HE2 LYS 13 0.866 -11.345 -2.937 99 HE3 LYS 13 HE3 LYS 13 2.163 -10.182 -2.562 100 HZ1 LYS 13 HZ1 LYS 13 3.677 -11.496 -3.873 101 HZ2 LYS 13 HZ2 LYS 13 2.542 -12.637 -4.161 102 HZ3 LYS 13 HZ3 LYS 13 2.365 -11.179 -4.848 103 H LEU 14 H LEU 14 4.036 -10.368 2.951 104 HA LEU 14 HA LEU 14 4.285 -7.570 3.298 105 HB2 LEU 14 HB2 LEU 14 5.276 -9.680 5.230 106 HB3 LEU 14 HB3 LEU 14 4.843 -8.017 5.604 107 HG LEU 14 HG LEU 14 2.935 -10.213 4.660 108 HD11 LEU 14 HD11 LEU 14 3.071 -8.665 7.277 109 HD12 LEU 14 HD12 LEU 14 1.958 -9.993 6.874 110 HD13 LEU 14 HD13 LEU 14 3.692 -10.308 7.032 111 HD21 LEU 14 HD21 LEU 14 1.166 -8.401 5.188 112 HD22 LEU 14 HD22 LEU 14 2.522 -7.253 5.067 113 HD23 LEU 14 HD23 LEU 14 2.058 -8.241 3.672 114 H GLN 15 H GLN 15 6.799 -9.981 2.733 115 HA GLN 15 HA GLN 15 9.017 -8.521 3.576 116 HB2 GLN 15 HB2 GLN 15 8.882 -10.920 2.855 117 HB3 GLN 15 HB3 GLN 15 8.849 -10.388 1.171 118 HG2 GLN 15 HG2 GLN 15 11.111 -9.428 1.463 119 HG3 GLN 15 HG3 GLN 15 11.067 -9.826 3.179 120 HE21 GLN 15 HE21 GLN 15 11.533 -11.891 3.822 121 HE22 GLN 15 HE22 GLN 15 11.898 -13.264 2.785 122 H VAL 16 H VAL 16 7.422 -8.377 0.288 123 HA VAL 16 HA VAL 16 9.402 -6.474 -0.612 124 HB VAL 16 HB VAL 16 8.062 -6.167 -2.594 125 HG11 VAL 16 HG11 VAL 16 8.041 -8.454 -3.447 126 HG12 VAL 16 HG12 VAL 16 9.483 -8.172 -2.459 127 HG13 VAL 16 HG13 VAL 16 8.101 -9.105 -1.799 128 HG21 VAL 16 HG21 VAL 16 5.962 -7.950 -1.325 129 HG22 VAL 16 HG22 VAL 16 5.785 -6.210 -1.702 130 HG23 VAL 16 HG23 VAL 16 5.976 -7.422 -2.985 131 H ILE 17 H ILE 17 6.260 -6.131 1.030 132 HA ILE 17 HA ILE 17 6.101 -3.301 0.516 133 HB ILE 17 HB ILE 17 4.846 -4.430 3.010 134 HG12 ILE 17 HG12 ILE 17 3.537 -4.787 0.289 135 HG13 ILE 17 HG13 ILE 17 4.340 -6.069 1.198 136 HG21 ILE 17 HG21 ILE 17 4.094 -2.339 0.909 137 HG22 ILE 17 HG22 ILE 17 3.108 -2.733 2.316 138 HG23 ILE 17 HG23 ILE 17 4.720 -2.052 2.546 139 HD11 ILE 17 HD11 ILE 17 2.066 -6.334 1.715 140 HD12 ILE 17 HD12 ILE 17 2.801 -5.604 3.154 141 HD13 ILE 17 HD13 ILE 17 1.848 -4.608 2.031 142 H ASP 18 H ASP 18 7.318 -5.275 3.147 143 HA ASP 18 HA ASP 18 8.065 -3.141 4.914 144 HB2 ASP 18 HB2 ASP 18 7.808 -5.615 5.463 145 HB3 ASP 18 HB3 ASP 18 9.415 -5.853 4.761 146 H TRP 19 H TRP 19 9.698 -4.738 2.186 147 HA TRP 19 HA TRP 19 12.276 -3.535 2.519 148 HB2 TRP 19 HB2 TRP 19 12.097 -5.452 1.104 149 HB3 TRP 19 HB3 TRP 19 10.780 -4.769 0.179 150 HD1 TRP 19 HD1 TRP 19 11.333 -3.111 -1.788 151 HE1 TRP 19 HE1 TRP 19 13.459 -2.441 -3.012 152 HE3 TRP 19 HE3 TRP 19 14.743 -5.294 1.321 153 HZ2 TRP 19 HZ2 TRP 19 16.333 -2.685 -2.611 154 HZ3 TRP 19 HZ3 TRP 19 17.210 -5.045 0.850 155 HH2 TRP 19 HH2 TRP 19 17.977 -3.709 -1.068 156 H LEU 20 H LEU 20 9.492 -2.650 0.344 157 HA LEU 20 HA LEU 20 10.719 -0.244 -0.476 158 HB2 LEU 20 HB2 LEU 20 8.701 0.426 -1.475 159 HB3 LEU 20 HB3 LEU 20 9.075 -1.263 -1.787 160 HG LEU 20 HG LEU 20 7.395 -1.581 0.266 161 HD11 LEU 20 HD11 LEU 20 5.451 -0.077 0.053 162 HD12 LEU 20 HD12 LEU 20 6.890 0.808 0.595 163 HD13 LEU 20 HD13 LEU 20 6.358 0.925 -1.097 164 HD21 LEU 20 HD21 LEU 20 5.639 -2.105 -1.295 165 HD22 LEU 20 HD22 LEU 20 6.471 -1.173 -2.566 166 HD23 LEU 20 HD23 LEU 20 7.201 -2.656 -1.880 167 H ILE 21 H ILE 21 8.759 -0.888 2.394 168 HA ILE 21 HA ILE 21 8.297 1.849 3.123 169 HB ILE 21 HB ILE 21 8.224 -0.812 4.564 170 HG12 ILE 21 HG12 ILE 21 6.051 1.269 4.026 171 HG13 ILE 21 HG13 ILE 21 6.395 -0.068 2.968 172 HG21 ILE 21 HG21 ILE 21 7.842 1.892 5.908 173 HG22 ILE 21 HG22 ILE 21 7.321 0.339 6.591 174 HG23 ILE 21 HG23 ILE 21 9.024 0.632 6.300 175 HD11 ILE 21 HD11 ILE 21 5.880 -1.646 4.886 176 HD12 ILE 21 HD12 ILE 21 5.371 -0.217 5.817 177 HD13 ILE 21 HD13 ILE 21 4.507 -0.646 4.353 178 H GLU 22 H GLU 22 10.961 -0.474 3.849 179 HA GLU 22 HA GLU 22 12.259 1.496 5.550 180 HB2 GLU 22 HB2 GLU 22 12.275 -1.211 5.562 181 HB3 GLU 22 HB3 GLU 22 13.697 -0.945 4.558 182 HG2 GLU 22 HG2 GLU 22 14.399 -1.152 6.850 183 HG3 GLU 22 HG3 GLU 22 14.588 0.552 6.416 184 H ASN 23 H ASN 23 12.380 0.574 2.219 185 HA ASN 23 HA ASN 23 14.881 1.664 1.395 186 HB2 ASN 23 HB2 ASN 23 12.332 0.818 0.128 187 HB3 ASN 23 HB3 ASN 23 13.184 2.037 -0.766 188 HD21 ASN 23 HD21 ASN 23 14.795 -0.614 1.124 189 HD22 ASN 23 HD22 ASN 23 15.366 -1.426 -0.308 190 H PHE 24 H PHE 24 11.592 3.151 1.533 191 HA PHE 24 HA PHE 24 12.912 5.797 1.115 192 HB2 PHE 24 HB2 PHE 24 10.458 4.707 -0.061 193 HB3 PHE 24 HB3 PHE 24 10.293 6.325 0.599 194 HD1 PHE 24 HD1 PHE 24 12.002 8.153 -0.024 195 HD2 PHE 24 HD2 PHE 24 11.554 4.455 -2.191 196 HE1 PHE 24 HE1 PHE 24 13.128 9.164 -1.968 197 HE2 PHE 24 HE2 PHE 24 12.631 5.505 -4.177 198 HZ PHE 24 HZ PHE 24 13.453 7.836 -4.055 199 HA PRO 25 HA PRO 25 11.526 5.887 5.474 200 HB2 PRO 25 HB2 PRO 25 13.653 7.133 6.568 201 HB3 PRO 25 HB3 PRO 25 13.678 5.411 6.099 202 HG2 PRO 25 HG2 PRO 25 14.674 7.775 4.472 203 HG3 PRO 25 HG3 PRO 25 15.556 6.261 4.892 204 HD2 PRO 25 HD2 PRO 25 14.274 6.534 2.526 205 HD3 PRO 25 HD3 PRO 25 14.285 4.980 3.419 206 H ASN 26 H ASN 26 11.022 7.901 3.023 207 HA ASN 26 HA ASN 26 11.165 10.534 4.408 208 HB2 ASN 26 HB2 ASN 26 10.314 9.706 1.607 209 HB3 ASN 26 HB3 ASN 26 10.191 11.348 2.216 210 HD21 ASN 26 HD21 ASN 26 13.068 10.027 3.517 211 HD22 ASN 26 HD22 ASN 26 14.132 10.622 2.261 212 H ALA 27 H ALA 27 8.851 7.987 3.739 213 HA ALA 27 HA ALA 27 6.822 8.898 5.487 214 HB1 ALA 27 HB1 ALA 27 6.555 9.564 2.506 215 HB2 ALA 27 HB2 ALA 27 5.130 9.304 3.521 216 HB3 ALA 27 HB3 ALA 27 6.254 10.635 3.887 217 H PHE 28 H PHE 28 6.070 6.873 6.024 218 HA PHE 28 HA PHE 28 4.685 5.211 4.429 219 HB2 PHE 28 HB2 PHE 28 7.580 4.475 4.414 220 HB3 PHE 28 HB3 PHE 28 6.467 3.198 4.759 221 HD1 PHE 28 HD1 PHE 28 4.132 3.873 2.976 222 HD2 PHE 28 HD2 PHE 28 8.385 4.074 2.193 223 HE1 PHE 28 HE1 PHE 28 3.698 3.483 0.600 224 HE2 PHE 28 HE2 PHE 28 7.926 3.608 -0.203 225 HZ PHE 28 HZ PHE 28 5.534 3.355 -0.986 226 H PHE 29 H PHE 29 4.163 2.994 5.708 227 HA PHE 29 HA PHE 29 4.853 3.265 8.546 228 HB2 PHE 29 HB2 PHE 29 2.057 3.485 7.510 229 HB3 PHE 29 HB3 PHE 29 2.412 3.048 9.158 230 HD1 PHE 29 HD1 PHE 29 2.234 5.838 6.760 231 HD2 PHE 29 HD2 PHE 29 3.559 4.685 10.700 232 HE1 PHE 29 HE1 PHE 29 2.357 8.210 7.416 233 HE2 PHE 29 HE2 PHE 29 3.541 7.055 11.401 234 HZ PHE 29 HZ PHE 29 2.954 8.836 9.763 235 H LYS 30 H LYS 30 5.312 1.368 9.189 236 HA LYS 30 HA LYS 30 4.927 -1.070 7.678 237 HB2 LYS 30 HB2 LYS 30 5.732 -0.741 10.603 238 HB3 LYS 30 HB3 LYS 30 5.533 -2.285 9.792 239 HG2 LYS 30 HG2 LYS 30 7.750 -2.080 9.620 240 HG3 LYS 30 HG3 LYS 30 7.260 -1.441 8.056 241 HD2 LYS 30 HD2 LYS 30 7.606 0.864 8.894 242 HD3 LYS 30 HD3 LYS 30 7.909 0.242 10.530 243 HE2 LYS 30 HE2 LYS 30 9.853 -1.092 9.626 244 HE3 LYS 30 HE3 LYS 30 9.586 -0.377 8.043 245 HZ1 LYS 30 HZ1 LYS 30 10.437 1.022 10.500 246 HZ2 LYS 30 HZ2 LYS 30 11.291 0.775 9.125 247 HZ3 LYS 30 HZ3 LYS 30 10.027 1.808 9.088 248 H LYS 31 H LYS 31 3.398 -0.071 10.725 249 HA LYS 31 HA LYS 31 1.477 -2.293 10.427 250 HB2 LYS 31 HB2 LYS 31 2.636 -0.887 12.654 251 HB3 LYS 31 HB3 LYS 31 0.909 -0.602 12.705 252 HG2 LYS 31 HG2 LYS 31 0.446 -3.001 12.514 253 HG3 LYS 31 HG3 LYS 31 2.181 -3.340 12.441 254 HD2 LYS 31 HD2 LYS 31 1.422 -1.739 14.814 255 HD3 LYS 31 HD3 LYS 31 0.572 -3.273 14.727 256 HE2 LYS 31 HE2 LYS 31 2.630 -3.477 16.017 257 HE3 LYS 31 HE3 LYS 31 2.640 -4.534 14.600 258 HZ1 LYS 31 HZ1 LYS 31 4.206 -3.116 13.550 259 HZ2 LYS 31 HZ2 LYS 31 3.993 -1.902 14.670 260 HZ3 LYS 31 HZ3 LYS 31 4.719 -3.299 15.089 261 H GLY 32 H GLY 32 -0.702 -2.170 10.241 262 HA2 GLY 32 HA2 GLY 32 -1.874 -0.061 8.844 263 HA3 GLY 32 HA3 GLY 32 -2.736 -1.379 9.647 264 H ASN 33 H ASN 33 -1.976 -0.828 12.352 265 HA ASN 33 HA ASN 33 -3.929 1.039 13.087 266 HB2 ASN 33 HB2 ASN 33 -3.432 0.661 15.249 267 HB3 ASN 33 HB3 ASN 33 -2.648 -0.747 14.565 268 HD21 ASN 33 HD21 ASN 33 -0.178 0.314 13.708 269 HD22 ASN 33 HD22 ASN 33 0.672 0.960 15.108 270 H GLN 34 H GLN 34 -0.736 1.835 11.948 271 HA GLN 34 HA GLN 34 -1.073 4.654 12.804 272 HB2 GLN 34 HB2 GLN 34 1.359 4.833 12.833 273 HB3 GLN 34 HB3 GLN 34 0.725 3.677 14.003 274 HG2 GLN 34 HG2 GLN 34 1.336 1.808 12.431 275 HG3 GLN 34 HG3 GLN 34 2.070 2.994 11.354 276 HE21 GLN 34 HE21 GLN 34 4.430 2.841 11.643 277 HE22 GLN 34 HE22 GLN 34 5.097 2.687 13.231 278 H VAL 35 H VAL 35 -1.485 2.680 10.180 279 HA VAL 35 HA VAL 35 0.046 4.156 8.259 280 HB VAL 35 HB VAL 35 -0.801 1.732 8.139 281 HG11 VAL 35 HG11 VAL 35 -2.817 1.234 7.019 282 HG12 VAL 35 HG12 VAL 35 -3.297 2.330 8.311 283 HG13 VAL 35 HG13 VAL 35 -3.168 2.950 6.681 284 HG21 VAL 35 HG21 VAL 35 -0.883 3.533 5.703 285 HG22 VAL 35 HG22 VAL 35 0.496 2.609 6.346 286 HG23 VAL 35 HG23 VAL 35 -0.892 1.768 5.662 287 H LYS 36 H LYS 36 -0.591 5.470 6.607 288 HA LYS 36 HA LYS 36 -3.126 6.961 6.732 289 HB2 LYS 36 HB2 LYS 36 -0.256 8.026 6.694 290 HB3 LYS 36 HB3 LYS 36 -1.630 8.978 6.153 291 HG2 LYS 36 HG2 LYS 36 -2.697 8.528 8.451 292 HG3 LYS 36 HG3 LYS 36 -1.103 7.959 8.969 293 HD2 LYS 36 HD2 LYS 36 -1.717 10.707 7.765 294 HD3 LYS 36 HD3 LYS 36 -1.546 10.372 9.494 295 HE2 LYS 36 HE2 LYS 36 0.774 9.700 9.203 296 HE3 LYS 36 HE3 LYS 36 0.654 9.858 7.443 297 HZ1 LYS 36 HZ1 LYS 36 0.087 12.207 9.094 298 HZ2 LYS 36 HZ2 LYS 36 1.659 11.792 8.734 299 HZ3 LYS 36 HZ3 LYS 36 0.571 12.104 7.553 300 HA PRO 37 HA PRO 37 -2.688 6.076 2.429 301 HB2 PRO 37 HB2 PRO 37 -3.926 8.099 1.092 302 HB3 PRO 37 HB3 PRO 37 -4.809 6.952 2.144 303 HG2 PRO 37 HG2 PRO 37 -3.803 9.733 2.838 304 HG3 PRO 37 HG3 PRO 37 -5.430 9.049 3.135 305 HD2 PRO 37 HD2 PRO 37 -3.467 9.108 5.048 306 HD3 PRO 37 HD3 PRO 37 -4.663 7.783 4.952 307 H LEU 38 H LEU 38 -1.642 6.591 0.517 308 HA LEU 38 HA LEU 38 0.576 8.586 0.640 309 HB2 LEU 38 HB2 LEU 38 0.281 5.871 -0.747 310 HB3 LEU 38 HB3 LEU 38 1.551 7.031 -1.050 311 HG LEU 38 HG LEU 38 2.553 5.468 0.233 312 HD11 LEU 38 HD11 LEU 38 3.367 6.581 2.140 313 HD12 LEU 38 HD12 LEU 38 2.889 7.847 1.011 314 HD13 LEU 38 HD13 LEU 38 1.822 7.481 2.375 315 HD21 LEU 38 HD21 LEU 38 1.832 4.512 2.317 316 HD22 LEU 38 HD22 LEU 38 0.347 5.487 2.290 317 HD23 LEU 38 HD23 LEU 38 0.629 4.235 1.048 318 H LYS 39 H LYS 39 1.192 9.245 -1.636 319 HA LYS 39 HA LYS 39 -0.805 10.573 -2.996 320 HB2 LYS 39 HB2 LYS 39 1.495 11.177 -3.217 321 HB3 LYS 39 HB3 LYS 39 1.954 9.564 -3.713 322 HG2 LYS 39 HG2 LYS 39 2.211 11.092 -5.482 323 HG3 LYS 39 HG3 LYS 39 1.023 9.851 -5.907 324 HD2 LYS 39 HD2 LYS 39 -0.778 11.594 -5.635 325 HD3 LYS 39 HD3 LYS 39 0.490 12.764 -5.212 326 HE2 LYS 39 HE2 LYS 39 1.665 12.095 -7.388 327 HE3 LYS 39 HE3 LYS 39 0.171 11.261 -7.833 328 HZ1 LYS 39 HZ1 LYS 39 -0.959 13.434 -7.622 329 HZ2 LYS 39 HZ2 LYS 39 0.502 14.150 -7.277 330 HZ3 LYS 39 HZ3 LYS 39 0.236 13.475 -8.736 331 H ILE 40 H ILE 40 -1.974 10.112 -5.024 332 HA ILE 40 HA ILE 40 -2.804 7.399 -5.175 333 HB ILE 40 HB ILE 40 -4.291 9.277 -5.679 334 HG12 ILE 40 HG12 ILE 40 -5.459 8.331 -7.585 335 HG13 ILE 40 HG13 ILE 40 -4.044 7.390 -8.058 336 HG21 ILE 40 HG21 ILE 40 -4.284 10.452 -7.777 337 HG22 ILE 40 HG22 ILE 40 -2.717 10.706 -7.004 338 HG23 ILE 40 HG23 ILE 40 -2.866 9.556 -8.347 339 HD11 ILE 40 HD11 ILE 40 -5.478 7.059 -5.395 340 HD12 ILE 40 HD12 ILE 40 -5.853 6.107 -6.848 341 HD13 ILE 40 HD13 ILE 40 -4.255 5.975 -6.097 342 H GLY 41 H GLY 41 -1.992 5.751 -6.219 343 HA2 GLY 41 HA2 GLY 41 -0.877 4.465 -7.783 344 HA3 GLY 41 HA3 GLY 41 -0.659 5.896 -8.782 345 H ILE 42 H ILE 42 0.539 6.108 -5.509 346 HA ILE 42 HA ILE 42 3.103 6.764 -6.101 347 HB ILE 42 HB ILE 42 1.950 7.088 -3.952 348 HG12 ILE 42 HG12 ILE 42 4.682 5.832 -3.598 349 HG13 ILE 42 HG13 ILE 42 4.377 7.425 -4.284 350 HG21 ILE 42 HG21 ILE 42 2.091 5.223 -2.227 351 HG22 ILE 42 HG22 ILE 42 0.943 4.934 -3.535 352 HG23 ILE 42 HG23 ILE 42 2.521 4.119 -3.508 353 HD11 ILE 42 HD11 ILE 42 5.006 7.673 -1.997 354 HD12 ILE 42 HD12 ILE 42 3.295 8.105 -2.135 355 HD13 ILE 42 HD13 ILE 42 3.792 6.529 -1.448 356 H PHE 43 H PHE 43 1.900 3.509 -6.279 357 HA PHE 43 HA PHE 43 4.322 2.047 -5.783 358 HB2 PHE 43 HB2 PHE 43 2.512 0.621 -5.968 359 HB3 PHE 43 HB3 PHE 43 1.709 1.599 -7.182 360 HD1 PHE 43 HD1 PHE 43 1.910 1.177 -9.488 361 HD2 PHE 43 HD2 PHE 43 4.449 -0.896 -6.722 362 HE1 PHE 43 HE1 PHE 43 2.644 -0.356 -11.313 363 HE2 PHE 43 HE2 PHE 43 5.258 -2.372 -8.554 364 HZ PHE 43 HZ PHE 43 4.327 -2.112 -10.849 365 H ASP 44 H ASP 44 3.075 3.927 -8.561 366 HA ASP 44 HA ASP 44 4.997 2.966 -10.427 367 HB2 ASP 44 HB2 ASP 44 2.689 4.427 -10.616 368 HB3 ASP 44 HB3 ASP 44 3.878 5.709 -10.839 369 H ASP 45 H ASP 45 5.193 5.394 -7.960 370 HA ASP 45 HA ASP 45 7.532 6.800 -9.073 371 HB2 ASP 45 HB2 ASP 45 5.806 6.947 -6.603 372 HB3 ASP 45 HB3 ASP 45 7.476 7.377 -6.390 373 H LEU 46 H LEU 46 6.773 4.445 -6.553 374 HA LEU 46 HA LEU 46 9.466 4.072 -5.598 375 HB2 LEU 46 HB2 LEU 46 7.485 3.811 -4.248 376 HB3 LEU 46 HB3 LEU 46 6.893 2.489 -5.253 377 HG LEU 46 HG LEU 46 7.751 1.822 -3.063 378 HD11 LEU 46 HD11 LEU 46 9.650 0.437 -4.912 379 HD12 LEU 46 HD12 LEU 46 8.530 -0.209 -3.728 380 HD13 LEU 46 HD13 LEU 46 7.912 0.369 -5.275 381 HD21 LEU 46 HD21 LEU 46 10.502 2.644 -4.064 382 HD22 LEU 46 HD22 LEU 46 9.552 3.443 -2.792 383 HD23 LEU 46 HD23 LEU 46 10.160 1.797 -2.549 384 H ILE 47 H ILE 47 7.483 2.241 -8.008 385 HA ILE 47 HA ILE 47 9.100 -0.051 -8.089 386 HB ILE 47 HB ILE 47 6.845 0.422 -9.176 387 HG12 ILE 47 HG12 ILE 47 8.316 -1.663 -9.473 388 HG13 ILE 47 HG13 ILE 47 6.884 -1.398 -10.450 389 HG21 ILE 47 HG21 ILE 47 8.552 1.514 -11.468 390 HG22 ILE 47 HG22 ILE 47 6.792 1.205 -11.507 391 HG23 ILE 47 HG23 ILE 47 7.465 2.423 -10.429 392 HD11 ILE 47 HD11 ILE 47 8.153 -0.782 -12.381 393 HD12 ILE 47 HD12 ILE 47 9.665 -0.756 -11.459 394 HD13 ILE 47 HD13 ILE 47 8.810 -2.288 -11.716 395 H ASP 48 H ASP 48 9.619 3.198 -9.391 396 HA ASP 48 HA ASP 48 11.584 2.741 -11.293 397 HB2 ASP 48 HB2 ASP 48 10.407 4.904 -10.618 398 HB3 ASP 48 HB3 ASP 48 11.527 5.022 -9.264 399 H PHE 49 H PHE 49 11.770 3.056 -7.788 400 HA PHE 49 HA PHE 49 14.637 2.907 -7.573 401 HB2 PHE 49 HB2 PHE 49 13.002 3.920 -5.927 402 HB3 PHE 49 HB3 PHE 49 12.578 2.290 -5.434 403 HD1 PHE 49 HD1 PHE 49 13.084 3.266 -3.190 404 HD2 PHE 49 HD2 PHE 49 16.202 2.639 -6.108 405 HE1 PHE 49 HE1 PHE 49 14.815 3.547 -1.431 406 HE2 PHE 49 HE2 PHE 49 17.890 2.763 -4.331 407 HZ PHE 49 HZ PHE 49 17.186 3.277 -1.972 408 H TYR 50 H TYR 50 12.069 0.436 -7.680 409 HA TYR 50 HA TYR 50 13.693 -1.736 -6.611 410 HB2 TYR 50 HB2 TYR 50 11.647 -2.589 -6.520 411 HB3 TYR 50 HB3 TYR 50 10.995 -1.441 -7.667 412 HD1 TYR 50 HD1 TYR 50 12.592 -4.837 -7.366 413 HD2 TYR 50 HD2 TYR 50 10.825 -1.929 -10.012 414 HE1 TYR 50 HE1 TYR 50 12.406 -6.525 -9.196 415 HE2 TYR 50 HE2 TYR 50 10.713 -3.596 -11.812 416 HH TYR 50 HH TYR 50 12.476 -5.862 -12.119 417 H GLU 51 H GLU 51 13.358 -0.204 -9.776 418 HA GLU 51 HA GLU 51 14.665 -2.245 -11.314 419 HB2 GLU 51 HB2 GLU 51 14.175 0.716 -11.777 420 HB3 GLU 51 HB3 GLU 51 14.895 -0.330 -12.986 421 HG2 GLU 51 HG2 GLU 51 12.304 -1.197 -11.726 422 HG3 GLU 51 HG3 GLU 51 12.263 0.137 -12.876 423 H ARG 52 H ARG 52 15.811 -0.082 -8.964 424 HA ARG 52 HA ARG 52 18.470 0.429 -10.056 425 HB2 ARG 52 HB2 ARG 52 16.860 1.747 -8.253 426 HB3 ARG 52 HB3 ARG 52 17.898 0.849 -7.145 427 HG2 ARG 52 HG2 ARG 52 18.975 2.921 -7.477 428 HG3 ARG 52 HG3 ARG 52 19.861 1.794 -8.530 429 HD2 ARG 52 HD2 ARG 52 18.531 2.579 -10.483 430 HD3 ARG 52 HD3 ARG 52 17.539 3.565 -9.392 431 HE ARG 52 HE ARG 52 20.401 4.141 -9.383 432 HH11 ARG 52 HH11 ARG 52 17.236 4.940 -10.841 433 HH12 ARG 52 HH12 ARG 52 17.747 6.425 -11.545 434 HH21 ARG 52 HH21 ARG 52 21.034 6.217 -10.152 435 HH22 ARG 52 HH22 ARG 52 19.884 7.268 -10.931 436 H LEU 53 H LEU 53 17.035 -2.110 -7.863 437 HA LEU 53 HA LEU 53 19.169 -2.918 -6.502 438 HB2 LEU 53 HB2 LEU 53 16.709 -4.209 -7.765 439 HB3 LEU 53 HB3 LEU 53 17.796 -5.096 -6.694 440 HG LEU 53 HG LEU 53 17.494 -3.459 -5.005 441 HD11 LEU 53 HD11 LEU 53 15.525 -1.916 -4.898 442 HD12 LEU 53 HD12 LEU 53 17.064 -1.422 -5.603 443 HD13 LEU 53 HD13 LEU 53 15.744 -1.891 -6.660 444 HD21 LEU 53 HD21 LEU 53 14.750 -4.414 -5.910 445 HD22 LEU 53 HD22 LEU 53 15.960 -5.499 -5.177 446 HD23 LEU 53 HD23 LEU 53 15.264 -4.189 -4.232 447 H ASP 54 H ASP 54 20.708 -4.333 -6.779 448 HA ASP 54 HA ASP 54 22.127 -4.559 -9.155 449 HB2 ASP 54 HB2 ASP 54 22.795 -5.004 -6.687 450 HB3 ASP 54 HB3 ASP 54 22.289 -6.668 -6.974 451 H THR 55 H THR 55 19.869 -6.884 -7.726 452 HA THR 55 HA THR 55 19.014 -7.973 -10.247 453 HB THR 55 HB THR 55 20.603 -9.881 -8.477 454 HG1 THR 55 HG1 THR 55 21.426 -8.226 -10.419 455 HG21 THR 55 HG21 THR 55 18.734 -10.950 -9.753 456 HG22 THR 55 HG22 THR 55 19.411 -10.285 -11.253 457 HG23 THR 55 HG23 THR 55 20.334 -11.478 -10.300 458 HA PRO 56 HA PRO 56 16.093 -7.977 -6.676 459 HB2 PRO 56 HB2 PRO 56 13.925 -7.276 -8.090 460 HB3 PRO 56 HB3 PRO 56 15.063 -6.099 -7.389 461 HG2 PRO 56 HG2 PRO 56 14.900 -7.056 -10.251 462 HG3 PRO 56 HG3 PRO 56 15.169 -5.389 -9.646 463 HD2 PRO 56 HD2 PRO 56 17.215 -6.987 -10.455 464 HD3 PRO 56 HD3 PRO 56 17.416 -5.856 -9.103 465 HA PRO 57 HA PRO 57 14.946 -12.089 -8.241 466 HB2 PRO 57 HB2 PRO 57 14.028 -13.223 -5.968 467 HB3 PRO 57 HB3 PRO 57 15.753 -12.830 -6.186 468 HG2 PRO 57 HG2 PRO 57 13.646 -11.217 -4.715 469 HG3 PRO 57 HG3 PRO 57 15.287 -11.673 -4.152 470 HD2 PRO 57 HD2 PRO 57 14.734 -9.242 -5.309 471 HD3 PRO 57 HD3 PRO 57 16.305 -10.071 -5.524 472 H PHE 58 H PHE 58 12.649 -9.916 -6.656 473 HA PHE 58 HA PHE 58 10.275 -11.434 -7.605 474 HB2 PHE 58 HB2 PHE 58 10.856 -9.314 -5.512 475 HB3 PHE 58 HB3 PHE 58 9.261 -9.425 -6.176 476 HD1 PHE 58 HD1 PHE 58 8.081 -11.787 -6.156 477 HD2 PHE 58 HD2 PHE 58 11.412 -10.680 -3.662 478 HE1 PHE 58 HE1 PHE 58 7.456 -13.557 -4.540 479 HE2 PHE 58 HE2 PHE 58 10.787 -12.441 -2.043 480 HZ PHE 58 HZ PHE 58 8.799 -13.894 -2.471 481 H SER 59 H SER 59 8.865 -10.552 -9.121 482 HA SER 59 HA SER 59 9.800 -8.210 -10.667 483 HB2 SER 59 HB2 SER 59 7.766 -10.434 -11.016 484 HB3 SER 59 HB3 SER 59 7.596 -8.948 -11.948 485 HG SER 59 HG SER 59 9.957 -10.553 -11.935 486 H LYS 60 H LYS 60 8.252 -6.565 -11.305 487 HA LYS 60 HA LYS 60 7.056 -5.141 -9.311 488 HB2 LYS 60 HB2 LYS 60 6.121 -3.746 -11.004 489 HB3 LYS 60 HB3 LYS 60 7.715 -4.309 -11.485 490 HG2 LYS 60 HG2 LYS 60 6.299 -6.185 -12.780 491 HG3 LYS 60 HG3 LYS 60 5.018 -4.978 -12.658 492 HD2 LYS 60 HD2 LYS 60 7.779 -4.610 -13.908 493 HD3 LYS 60 HD3 LYS 60 6.273 -4.822 -14.795 494 HE2 LYS 60 HE2 LYS 60 5.453 -2.663 -14.092 495 HE3 LYS 60 HE3 LYS 60 6.745 -2.492 -12.894 496 HZ1 LYS 60 HZ1 LYS 60 7.108 -1.234 -14.973 497 HZ2 LYS 60 HZ2 LYS 60 8.340 -2.286 -14.597 498 HZ3 LYS 60 HZ3 LYS 60 7.291 -2.647 -15.787 499 H LYS 61 H LYS 61 5.436 -7.712 -11.047 500 HA LYS 61 HA LYS 61 2.788 -7.152 -10.316 501 HB2 LYS 61 HB2 LYS 61 2.324 -9.513 -10.649 502 HB3 LYS 61 HB3 LYS 61 3.419 -8.930 -11.897 503 HG2 LYS 61 HG2 LYS 61 5.336 -9.961 -10.570 504 HG3 LYS 61 HG3 LYS 61 4.128 -10.688 -9.498 505 HD2 LYS 61 HD2 LYS 61 4.302 -11.193 -12.474 506 HD3 LYS 61 HD3 LYS 61 4.971 -12.230 -11.207 507 HE2 LYS 61 HE2 LYS 61 2.701 -12.569 -10.261 508 HE3 LYS 61 HE3 LYS 61 2.021 -11.536 -11.528 509 HZ1 LYS 61 HZ1 LYS 61 2.894 -13.108 -13.157 510 HZ2 LYS 61 HZ2 LYS 61 3.404 -14.106 -11.960 511 HZ3 LYS 61 HZ3 LYS 61 1.783 -13.785 -12.150 512 H SER 62 H SER 62 5.179 -9.097 -8.451 513 HA SER 62 HA SER 62 3.504 -9.580 -6.256 514 HB2 SER 62 HB2 SER 62 5.554 -10.283 -5.146 515 HB3 SER 62 HB3 SER 62 5.493 -10.889 -6.803 516 HG SER 62 HG SER 62 6.928 -9.088 -7.364 517 H LEU 63 H LEU 63 5.985 -7.045 -6.687 518 HA LEU 63 HA LEU 63 5.758 -5.780 -4.212 519 HB2 LEU 63 HB2 LEU 63 7.492 -5.457 -5.947 520 HB3 LEU 63 HB3 LEU 63 6.381 -4.470 -6.889 521 HG LEU 63 HG LEU 63 6.902 -3.778 -3.983 522 HD11 LEU 63 HD11 LEU 63 9.163 -4.123 -5.062 523 HD12 LEU 63 HD12 LEU 63 8.752 -2.816 -6.204 524 HD13 LEU 63 HD13 LEU 63 8.861 -2.490 -4.464 525 HD21 LEU 63 HD21 LEU 63 6.598 -1.469 -4.808 526 HD22 LEU 63 HD22 LEU 63 6.479 -2.057 -6.470 527 HD23 LEU 63 HD23 LEU 63 5.219 -2.463 -5.258 528 H ARG 64 H ARG 64 3.965 -5.020 -7.225 529 HA ARG 64 HA ARG 64 2.361 -3.041 -6.036 530 HB2 ARG 64 HB2 ARG 64 2.692 -3.352 -8.481 531 HB3 ARG 64 HB3 ARG 64 1.802 -4.843 -8.444 532 HG2 ARG 64 HG2 ARG 64 0.559 -2.825 -9.328 533 HG3 ARG 64 HG3 ARG 64 -0.278 -3.706 -8.040 534 HD2 ARG 64 HD2 ARG 64 0.104 -2.068 -6.449 535 HD3 ARG 64 HD3 ARG 64 1.511 -1.441 -7.266 536 HE ARG 64 HE ARG 64 0.060 -0.444 -8.971 537 HH11 ARG 64 HH11 ARG 64 -1.477 -1.326 -5.897 538 HH12 ARG 64 HH12 ARG 64 -2.555 0.037 -5.910 539 HH21 ARG 64 HH21 ARG 64 -1.309 1.424 -8.892 540 HH22 ARG 64 HH22 ARG 64 -2.319 1.706 -7.492 541 H GLU 65 H GLU 65 1.590 -6.535 -6.549 542 HA GLU 65 HA GLU 65 -1.053 -6.433 -5.531 543 HB2 GLU 65 HB2 GLU 65 1.064 -8.620 -5.615 544 HB3 GLU 65 HB3 GLU 65 -0.552 -8.902 -4.957 545 HG2 GLU 65 HG2 GLU 65 -1.602 -8.312 -7.060 546 HG3 GLU 65 HG3 GLU 65 -0.067 -7.834 -7.767 547 H ALA 66 H ALA 66 2.049 -7.064 -3.828 548 HA ALA 66 HA ALA 66 0.857 -7.504 -1.282 549 HB1 ALA 66 HB1 ALA 66 3.145 -7.172 -0.459 550 HB2 ALA 66 HB2 ALA 66 3.130 -8.256 -1.857 551 HB3 ALA 66 HB3 ALA 66 3.635 -6.557 -2.054 552 H LEU 67 H LEU 67 2.079 -4.479 -2.853 553 HA LEU 67 HA LEU 67 1.659 -2.783 -0.618 554 HB2 LEU 67 HB2 LEU 67 2.484 -2.447 -3.289 555 HB3 LEU 67 HB3 LEU 67 1.042 -1.457 -3.185 556 HG LEU 67 HG LEU 67 3.424 -1.308 -1.280 557 HD11 LEU 67 HD11 LEU 67 4.020 -0.643 -3.591 558 HD12 LEU 67 HD12 LEU 67 2.686 0.538 -3.592 559 HD13 LEU 67 HD13 LEU 67 4.058 0.732 -2.486 560 HD21 LEU 67 HD21 LEU 67 1.394 -0.441 -0.204 561 HD22 LEU 67 HD22 LEU 67 2.496 0.886 -0.608 562 HD23 LEU 67 HD23 LEU 67 1.058 0.590 -1.615 563 H SER 68 H SER 68 -0.560 -3.807 -3.245 564 HA SER 68 HA SER 68 -2.797 -2.283 -2.373 565 HB2 SER 68 HB2 SER 68 -2.551 -4.733 -4.144 566 HB3 SER 68 HB3 SER 68 -4.105 -3.969 -3.753 567 HG SER 68 HG SER 68 -3.504 -2.941 -5.504 568 H TYR 69 H TYR 69 -1.472 -5.336 -1.213 569 HA TYR 69 HA TYR 69 -3.863 -6.162 0.191 570 HB2 TYR 69 HB2 TYR 69 -1.250 -7.252 -0.283 571 HB3 TYR 69 HB3 TYR 69 -1.435 -7.120 1.461 572 HD1 TYR 69 HD1 TYR 69 -2.303 -9.088 2.478 573 HD2 TYR 69 HD2 TYR 69 -3.584 -8.029 -1.510 574 HE1 TYR 69 HE1 TYR 69 -3.874 -10.996 2.476 575 HE2 TYR 69 HE2 TYR 69 -5.190 -9.923 -1.480 576 HH TYR 69 HH TYR 69 -5.648 -12.048 1.346 577 H TYR 70 H TYR 70 -0.893 -4.274 1.102 578 HA TYR 70 HA TYR 70 -1.875 -3.783 3.783 579 HB2 TYR 70 HB2 TYR 70 0.331 -2.665 2.096 580 HB3 TYR 70 HB3 TYR 70 -0.319 -1.608 3.330 581 HD1 TYR 70 HD1 TYR 70 -0.423 -5.142 4.404 582 HD2 TYR 70 HD2 TYR 70 2.071 -1.614 4.113 583 HE1 TYR 70 HE1 TYR 70 1.032 -6.013 6.153 584 HE2 TYR 70 HE2 TYR 70 3.607 -2.573 5.767 585 HH TYR 70 HH TYR 70 4.057 -4.347 7.134 586 H SER 71 H SER 71 -2.470 -2.074 0.667 587 HA SER 71 HA SER 71 -3.927 -0.017 2.092 588 HB2 SER 71 HB2 SER 71 -4.324 1.003 0.105 589 HB3 SER 71 HB3 SER 71 -2.717 0.286 -0.053 590 HG SER 71 HG SER 71 -3.596 -0.326 -1.898 591 H ALA 72 H ALA 72 -4.752 -3.186 1.838 592 HA ALA 72 HA ALA 72 -7.679 -2.669 1.662 593 HB1 ALA 72 HB1 ALA 72 -6.110 -5.258 1.339 594 HB2 ALA 72 HB2 ALA 72 -7.872 -5.089 1.262 595 HB3 ALA 72 HB3 ALA 72 -6.859 -4.313 0.032 596 H SER 73 H SER 73 -5.227 -2.671 3.783 597 HA SER 73 HA SER 73 -5.877 -4.389 5.901 598 HB2 SER 73 HB2 SER 73 -3.787 -3.165 5.696 599 HB3 SER 73 HB3 SER 73 -4.631 -1.611 5.801 600 HG SER 73 HG SER 73 -3.576 -2.161 7.662 601 HA PRO 74 HA PRO 74 -9.720 -2.689 7.416 602 HB2 PRO 74 HB2 PRO 74 -9.489 -3.169 10.133 603 HB3 PRO 74 HB3 PRO 74 -10.012 -4.376 8.896 604 HG2 PRO 74 HG2 PRO 74 -7.313 -3.936 10.155 605 HG3 PRO 74 HG3 PRO 74 -8.145 -5.490 9.795 606 HD2 PRO 74 HD2 PRO 74 -6.176 -4.519 8.187 607 HD3 PRO 74 HD3 PRO 74 -7.599 -5.350 7.497 608 H ALA 75 H ALA 75 -6.937 -1.864 9.507 609 HA ALA 75 HA ALA 75 -7.990 0.497 10.478 610 HB1 ALA 75 HB1 ALA 75 -5.106 -0.197 9.802 611 HB2 ALA 75 HB2 ALA 75 -5.642 1.079 10.930 612 HB3 ALA 75 HB3 ALA 75 -5.982 -0.629 11.292 613 H TYR 76 H TYR 76 -6.027 0.085 7.491 614 HA TYR 76 HA TYR 76 -5.964 2.789 6.697 615 HB2 TYR 76 HB2 TYR 76 -4.528 1.064 5.686 616 HB3 TYR 76 HB3 TYR 76 -5.919 0.218 5.069 617 HD1 TYR 76 HD1 TYR 76 -3.633 3.061 4.458 618 HD2 TYR 76 HD2 TYR 76 -7.232 1.082 3.204 619 HE1 TYR 76 HE1 TYR 76 -3.509 4.205 2.252 620 HE2 TYR 76 HE2 TYR 76 -7.117 2.189 1.033 621 HH TYR 76 HH TYR 76 -5.990 3.744 -0.304 622 H LEU 77 H LEU 77 -8.430 0.293 5.835 623 HA LEU 77 HA LEU 77 -9.815 2.230 4.118 624 HB2 LEU 77 HB2 LEU 77 -10.759 -0.466 5.185 625 HB3 LEU 77 HB3 LEU 77 -11.567 0.501 3.968 626 HG LEU 77 HG LEU 77 -8.699 -0.415 3.568 627 HD11 LEU 77 HD11 LEU 77 -11.180 -2.006 3.456 628 HD12 LEU 77 HD12 LEU 77 -9.960 -2.262 2.154 629 HD13 LEU 77 HD13 LEU 77 -9.536 -2.384 3.857 630 HD21 LEU 77 HD21 LEU 77 -9.371 1.356 2.102 631 HD22 LEU 77 HD22 LEU 77 -9.249 -0.165 1.203 632 HD23 LEU 77 HD23 LEU 77 -10.850 0.488 1.654 633 H SER 78 H SER 78 -10.412 0.734 7.253 634 HA SER 78 HA SER 78 -12.795 2.093 7.885 635 HB2 SER 78 HB2 SER 78 -11.585 0.156 9.188 636 HB3 SER 78 HB3 SER 78 -10.716 1.459 10.009 637 HG SER 78 HG SER 78 -12.958 2.370 10.294 638 H CYS 79 H CYS 79 -9.396 3.274 8.211 639 HA CYS 79 HA CYS 79 -10.213 5.613 9.702 640 HB2 CYS 79 HB2 CYS 79 -7.973 6.175 9.844 641 HB3 CYS 79 HB3 CYS 79 -8.040 4.428 10.010 642 HG CYS 79 HG CYS 79 -5.975 4.671 8.753 643 H GLN 80 H GLN 80 -11.060 5.013 6.708 644 HA GLN 80 HA GLN 80 -10.348 6.787 4.829 645 HB2 GLN 80 HB2 GLN 80 -12.850 7.018 4.345 646 HB3 GLN 80 HB3 GLN 80 -12.194 5.402 4.322 647 HG2 GLN 80 HG2 GLN 80 -13.492 4.697 6.063 648 HG3 GLN 80 HG3 GLN 80 -13.240 6.166 6.991 649 HE21 GLN 80 HE21 GLN 80 -14.364 8.173 6.067 650 HE22 GLN 80 HE22 GLN 80 -16.072 7.922 5.679 651 H LYS 81 H LYS 81 -9.477 8.789 5.486 652 HA LYS 81 HA LYS 81 -11.470 10.751 6.462 653 HB2 LYS 81 HB2 LYS 81 -8.588 10.481 7.286 654 HB3 LYS 81 HB3 LYS 81 -9.446 12.015 7.392 655 HG2 LYS 81 HG2 LYS 81 -10.231 9.463 8.810 656 HG3 LYS 81 HG3 LYS 81 -9.483 10.893 9.530 657 HD2 LYS 81 HD2 LYS 81 -11.602 12.152 8.839 658 HD3 LYS 81 HD3 LYS 81 -12.273 10.544 8.418 659 HE2 LYS 81 HE2 LYS 81 -11.872 9.756 10.701 660 HE3 LYS 81 HE3 LYS 81 -11.266 11.349 11.170 661 HZ1 LYS 81 HZ1 LYS 81 -13.391 12.276 10.864 662 HZ2 LYS 81 HZ2 LYS 81 -13.955 11.012 10.011 663 HZ3 LYS 81 HZ3 LYS 81 -13.696 10.853 11.633 664 HA PRO 82 HA PRO 82 -10.199 12.456 2.470 665 HB2 PRO 82 HB2 PRO 82 -12.211 14.297 2.228 666 HB3 PRO 82 HB3 PRO 82 -12.453 12.557 1.921 667 HG2 PRO 82 HG2 PRO 82 -13.083 14.125 4.423 668 HG3 PRO 82 HG3 PRO 82 -14.122 12.922 3.595 669 HD2 PRO 82 HD2 PRO 82 -12.538 12.399 5.816 670 HD3 PRO 82 HD3 PRO 82 -12.913 11.148 4.599 671 H ASP 83 H ASP 83 -9.569 14.786 1.942 672 HA ASP 83 HA ASP 83 -8.439 16.731 2.414 673 HB2 ASP 83 HB2 ASP 83 -10.105 16.957 4.944 674 HB3 ASP 83 HB3 ASP 83 -9.302 18.245 4.062 675 H THR 84 H THR 84 -7.257 14.230 3.365 676 HA THR 84 HA THR 84 -5.932 14.998 5.875 677 HB THR 84 HB THR 84 -6.968 12.699 5.139 678 HG1 THR 84 HG1 THR 84 -5.603 11.737 6.675 679 HG21 THR 84 HG21 THR 84 -4.071 12.163 4.414 680 HG22 THR 84 HG22 THR 84 -5.474 11.075 4.315 681 HG23 THR 84 HG23 THR 84 -5.320 12.436 3.184 682 H ALA 85 H ALA 85 -5.145 15.126 2.497 683 HA ALA 85 HA ALA 85 -3.271 15.739 1.380 684 HB1 ALA 85 HB1 ALA 85 -3.535 17.764 2.685 685 HB2 ALA 85 HB2 ALA 85 -2.476 17.084 3.955 686 HB3 ALA 85 HB3 ALA 85 -1.826 17.403 2.331 687 H ARG 86 H ARG 86 -2.711 13.733 1.017 688 HA ARG 86 HA ARG 86 -0.729 12.301 2.622 689 HB2 ARG 86 HB2 ARG 86 -0.781 10.669 0.682 690 HB3 ARG 86 HB3 ARG 86 -2.267 10.917 1.578 691 HG2 ARG 86 HG2 ARG 86 -2.300 12.745 -0.624 692 HG3 ARG 86 HG3 ARG 86 -1.734 11.227 -1.257 693 HD2 ARG 86 HD2 ARG 86 -4.078 10.891 0.510 694 HD3 ARG 86 HD3 ARG 86 -4.376 12.049 -0.766 695 HE ARG 86 HE ARG 86 -3.464 9.220 -1.208 696 HH11 ARG 86 HH11 ARG 86 -4.515 12.102 -2.818 697 HH12 ARG 86 HH12 ARG 86 -5.469 11.339 -3.981 698 HH21 ARG 86 HH21 ARG 86 -4.976 8.105 -2.646 699 HH22 ARG 86 HH22 ARG 86 -5.848 9.053 -3.829 700 H VAL 87 H VAL 87 1.195 11.357 1.060 701 HA VAL 87 HA VAL 87 2.538 13.620 -0.251 702 HB VAL 87 HB VAL 87 4.613 13.079 1.009 703 HG11 VAL 87 HG11 VAL 87 2.328 13.883 2.860 704 HG12 VAL 87 HG12 VAL 87 4.058 14.200 3.099 705 HG13 VAL 87 HG13 VAL 87 3.200 14.966 1.764 706 HG21 VAL 87 HG21 VAL 87 4.118 10.793 1.728 707 HG22 VAL 87 HG22 VAL 87 4.487 11.837 3.110 708 HG23 VAL 87 HG23 VAL 87 2.802 11.376 2.768 709 H ASP 88 H ASP 88 4.534 12.856 -1.355 710 HA ASP 88 HA ASP 88 4.074 10.282 -2.743 711 HB2 ASP 88 HB2 ASP 88 5.463 11.188 -4.528 712 HB3 ASP 88 HB3 ASP 88 4.059 12.191 -4.215 713 H ILE 89 H ILE 89 6.500 9.463 -3.552 714 HA ILE 89 HA ILE 89 7.693 8.487 -1.154 715 HB ILE 89 HB ILE 89 9.413 7.463 -2.527 716 HG12 ILE 89 HG12 ILE 89 8.241 8.991 -4.887 717 HG13 ILE 89 HG13 ILE 89 9.766 9.361 -4.077 718 HG21 ILE 89 HG21 ILE 89 6.747 7.199 -3.967 719 HG22 ILE 89 HG22 ILE 89 8.021 5.980 -3.795 720 HG23 ILE 89 HG23 ILE 89 7.096 6.475 -2.374 721 HD11 ILE 89 HD11 ILE 89 10.013 8.166 -6.202 722 HD12 ILE 89 HD12 ILE 89 10.845 7.448 -4.819 723 HD13 ILE 89 HD13 ILE 89 9.357 6.700 -5.420 724 H TYR 90 H TYR 90 8.336 11.370 -2.991 725 HA TYR 90 HA TYR 90 10.982 11.812 -1.839 726 HB2 TYR 90 HB2 TYR 90 9.132 13.484 -3.556 727 HB3 TYR 90 HB3 TYR 90 10.686 14.047 -2.982 728 HD1 TYR 90 HD1 TYR 90 9.087 11.299 -5.077 729 HD2 TYR 90 HD2 TYR 90 12.626 13.650 -4.252 730 HE1 TYR 90 HE1 TYR 90 10.174 10.355 -7.058 731 HE2 TYR 90 HE2 TYR 90 13.693 12.730 -6.278 732 HH TYR 90 HH TYR 90 13.411 11.359 -8.199 733 H GLY 91 H GLY 91 7.820 11.939 -0.627 734 HA2 GLY 91 HA2 GLY 91 7.066 12.653 1.386 735 HA3 GLY 91 HA3 GLY 91 8.606 13.473 1.688 736 H ASN 92 H ASN 92 7.250 14.410 -1.373 737 HA ASN 92 HA ASN 92 6.798 17.133 -0.392 738 HB2 ASN 92 HB2 ASN 92 5.760 16.044 -3.020 739 HB3 ASN 92 HB3 ASN 92 6.149 17.692 -2.604 740 HD21 ASN 92 HD21 ASN 92 7.224 15.035 -4.234 741 HD22 ASN 92 HD22 ASN 92 8.925 15.490 -4.416 742 H GLU 93 H GLU 93 4.798 18.215 -0.429 743 HA GLU 93 HA GLU 93 2.570 16.618 0.563 744 HB2 GLU 93 HB2 GLU 93 3.366 19.474 0.393 745 HB3 GLU 93 HB3 GLU 93 1.654 19.199 0.095 746 HG2 GLU 93 HG2 GLU 93 1.403 17.993 2.198 747 HG3 GLU 93 HG3 GLU 93 3.154 18.024 2.461 748 H VAL 94 H VAL 94 0.840 15.941 -0.550 749 HA VAL 94 HA VAL 94 0.561 16.783 -3.349 750 HB VAL 94 HB VAL 94 0.022 14.668 -4.100 751 HG11 VAL 94 HG11 VAL 94 2.452 15.322 -3.949 752 HG12 VAL 94 HG12 VAL 94 2.600 14.367 -2.486 753 HG13 VAL 94 HG13 VAL 94 2.192 13.571 -4.017 754 HG21 VAL 94 HG21 VAL 94 0.780 13.214 -1.612 755 HG22 VAL 94 HG22 VAL 94 -0.859 13.872 -1.755 756 HG23 VAL 94 HG23 VAL 94 -0.239 12.720 -2.954 757 H ASP 95 H ASP 95 -1.816 15.834 -4.041 758 HA ASP 95 HA ASP 95 -3.559 17.623 -2.505 759 HB2 ASP 95 HB2 ASP 95 -5.253 16.900 -4.233 760 HB3 ASP 95 HB3 ASP 95 -3.796 17.634 -4.867 761 H VAL 96 H VAL 96 -5.963 16.600 -2.162 762 HA VAL 96 HA VAL 96 -5.433 14.318 -0.310 763 HB VAL 96 HB VAL 96 -7.065 15.191 1.094 764 HG11 VAL 96 HG11 VAL 96 -6.059 17.847 0.067 765 HG12 VAL 96 HG12 VAL 96 -6.280 17.278 1.736 766 HG13 VAL 96 HG13 VAL 96 -4.935 16.696 0.747 767 HG21 VAL 96 HG21 VAL 96 -8.955 15.692 -0.288 768 HG22 VAL 96 HG22 VAL 96 -8.482 17.267 0.373 769 HG23 VAL 96 HG23 VAL 96 -8.039 16.833 -1.270 770 H VAL 97 H VAL 97 -7.330 13.082 0.303 771 HA VAL 97 HA VAL 97 -8.492 11.831 -2.119 772 HB VAL 97 HB VAL 97 -9.094 11.061 0.771 773 HG11 VAL 97 HG11 VAL 97 -9.557 8.854 -0.211 774 HG12 VAL 97 HG12 VAL 97 -10.550 10.101 -0.978 775 HG13 VAL 97 HG13 VAL 97 -9.130 9.459 -1.826 776 HG21 VAL 97 HG21 VAL 97 -6.849 9.932 -0.928 777 HG22 VAL 97 HG22 VAL 97 -6.597 10.971 0.492 778 HG23 VAL 97 HG23 VAL 97 -7.329 9.375 0.676 779 H THR 98 H THR 98 -10.570 12.403 -2.858 780 HA THR 98 HA THR 98 -11.896 14.577 -1.523 781 HB THR 98 HB THR 98 -13.462 14.444 -3.353 782 HG1 THR 98 HG1 THR 98 -13.683 12.884 -4.631 783 HG21 THR 98 HG21 THR 98 -12.021 14.979 -5.128 784 HG22 THR 98 HG22 THR 98 -11.132 15.428 -3.675 785 HG23 THR 98 HG23 THR 98 -10.706 13.936 -4.524 786 HA PRO 99 HA PRO 99 -14.511 12.399 1.258 787 HB2 PRO 99 HB2 PRO 99 -17.074 13.355 0.882 788 HB3 PRO 99 HB3 PRO 99 -15.764 14.242 1.718 789 HG2 PRO 99 HG2 PRO 99 -16.622 14.468 -1.190 790 HG3 PRO 99 HG3 PRO 99 -16.350 15.795 -0.020 791 HD2 PRO 99 HD2 PRO 99 -14.411 15.149 -1.729 792 HD3 PRO 99 HD3 PRO 99 -13.992 15.405 -0.015 793 H GLU 100 H GLU 100 -15.730 12.396 -2.062 794 HA GLU 100 HA GLU 100 -17.497 10.150 -1.803 795 HB2 GLU 100 HB2 GLU 100 -16.229 11.785 -4.001 796 HB3 GLU 100 HB3 GLU 100 -16.938 10.243 -4.445 797 HG2 GLU 100 HG2 GLU 100 -18.657 11.940 -2.676 798 HG3 GLU 100 HG3 GLU 100 -18.352 12.579 -4.308 799 H GLN 101 H GLN 101 -14.055 10.474 -2.928 800 HA GLN 101 HA GLN 101 -13.892 7.601 -3.394 801 HB2 GLN 101 HB2 GLN 101 -11.726 9.721 -3.165 802 HB3 GLN 101 HB3 GLN 101 -11.493 7.997 -3.619 803 HG2 GLN 101 HG2 GLN 101 -13.020 8.310 -5.528 804 HG3 GLN 101 HG3 GLN 101 -13.142 10.037 -5.161 805 HE21 GLN 101 HE21 GLN 101 -12.370 9.548 -7.664 806 HE22 GLN 101 HE22 GLN 101 -10.652 9.839 -7.844 807 H ALA 102 H ALA 102 -13.131 9.818 -0.697 808 HA ALA 102 HA ALA 102 -11.611 8.041 0.844 809 HB1 ALA 102 HB1 ALA 102 -13.455 10.285 1.762 810 HB2 ALA 102 HB2 ALA 102 -12.255 9.466 2.775 811 HB3 ALA 102 HB3 ALA 102 -11.723 10.407 1.375 812 H LYS 103 H LYS 103 -15.168 8.680 1.005 813 HA LYS 103 HA LYS 103 -15.552 6.648 2.987 814 HB2 LYS 103 HB2 LYS 103 -17.907 6.911 2.687 815 HB3 LYS 103 HB3 LYS 103 -17.161 8.503 2.680 816 HG2 LYS 103 HG2 LYS 103 -18.095 8.973 0.673 817 HG3 LYS 103 HG3 LYS 103 -17.316 7.596 -0.053 818 HD2 LYS 103 HD2 LYS 103 -19.682 7.567 -0.419 819 HD3 LYS 103 HD3 LYS 103 -19.194 6.151 0.540 820 HE2 LYS 103 HE2 LYS 103 -19.986 7.275 2.612 821 HE3 LYS 103 HE3 LYS 103 -20.432 8.704 1.675 822 HZ1 LYS 103 HZ1 LYS 103 -22.331 7.279 2.120 823 HZ2 LYS 103 HZ2 LYS 103 -22.050 7.353 0.498 824 HZ3 LYS 103 HZ3 LYS 103 -21.623 6.014 1.299 825 H TYR 104 H TYR 104 -15.459 6.440 -0.514 826 HA TYR 104 HA TYR 104 -16.820 4.019 -0.891 827 HB2 TYR 104 HB2 TYR 104 -14.853 5.648 -2.397 828 HB3 TYR 104 HB3 TYR 104 -14.911 3.934 -2.811 829 HD1 TYR 104 HD1 TYR 104 -17.906 5.912 -1.689 830 HD2 TYR 104 HD2 TYR 104 -15.762 4.246 -5.039 831 HE1 TYR 104 HE1 TYR 104 -19.911 6.189 -3.091 832 HE2 TYR 104 HE2 TYR 104 -17.778 4.519 -6.459 833 HH TYR 104 HH TYR 104 -19.996 5.412 -6.566 834 H ALA 105 H ALA 105 -13.707 4.541 0.573 835 HA ALA 105 HA ALA 105 -12.461 2.056 0.305 836 HB1 ALA 105 HB1 ALA 105 -12.668 3.832 2.778 837 HB2 ALA 105 HB2 ALA 105 -11.391 2.661 2.447 838 HB3 ALA 105 HB3 ALA 105 -11.555 4.103 1.423 839 H TYR 106 H TYR 106 -15.314 2.969 2.287 840 HA TYR 106 HA TYR 106 -15.257 0.837 4.091 841 HB2 TYR 106 HB2 TYR 106 -17.333 1.496 4.731 842 HB3 TYR 106 HB3 TYR 106 -16.816 2.960 3.934 843 HD1 TYR 106 HD1 TYR 106 -17.432 2.633 1.090 844 HD2 TYR 106 HD2 TYR 106 -19.536 1.011 4.477 845 HE1 TYR 106 HE1 TYR 106 -19.520 2.640 -0.218 846 HE2 TYR 106 HE2 TYR 106 -21.591 0.848 3.137 847 HH TYR 106 HH TYR 106 -21.786 2.095 -0.249 848 H GLN 107 H GLN 107 -16.260 0.788 0.713 849 HA GLN 107 HA GLN 107 -17.731 -1.651 0.759 850 HB2 GLN 107 HB2 GLN 107 -16.043 -0.425 -1.461 851 HB3 GLN 107 HB3 GLN 107 -17.158 -1.794 -1.640 852 HG2 GLN 107 HG2 GLN 107 -18.935 -0.167 -0.590 853 HG3 GLN 107 HG3 GLN 107 -17.797 1.106 -1.070 854 HE21 GLN 107 HE21 GLN 107 -17.284 1.286 -3.452 855 HE22 GLN 107 HE22 GLN 107 -18.481 0.705 -4.576 856 H ARG 108 H ARG 108 -14.300 -0.920 0.295 857 HA ARG 108 HA ARG 108 -13.441 -3.622 -0.133 858 HB2 ARG 108 HB2 ARG 108 -11.795 -1.294 0.878 859 HB3 ARG 108 HB3 ARG 108 -11.208 -2.716 0.018 860 HG2 ARG 108 HG2 ARG 108 -12.948 -0.454 -1.111 861 HG3 ARG 108 HG3 ARG 108 -11.254 -0.792 -1.471 862 HD2 ARG 108 HD2 ARG 108 -12.034 -3.119 -2.275 863 HD3 ARG 108 HD3 ARG 108 -13.675 -2.440 -2.286 864 HE ARG 108 HE ARG 108 -12.276 -0.594 -3.717 865 HH11 ARG 108 HH11 ARG 108 -12.952 -4.036 -4.108 866 HH12 ARG 108 HH12 ARG 108 -12.426 -4.123 -5.745 867 HH21 ARG 108 HH21 ARG 108 -11.206 -0.760 -5.761 868 HH22 ARG 108 HH22 ARG 108 -11.224 -2.224 -6.664 869 H TYR 109 H TYR 109 -14.113 -1.754 2.812 870 HA TYR 109 HA TYR 109 -12.698 -3.602 4.532 871 HB2 TYR 109 HB2 TYR 109 -13.239 -1.262 5.161 872 HB3 TYR 109 HB3 TYR 109 -14.950 -1.645 5.174 873 HD1 TYR 109 HD1 TYR 109 -15.806 -3.496 6.791 874 HD2 TYR 109 HD2 TYR 109 -11.884 -1.702 7.104 875 HE1 TYR 109 HE1 TYR 109 -15.588 -4.394 9.051 876 HE2 TYR 109 HE2 TYR 109 -11.676 -2.603 9.394 877 HH TYR 109 HH TYR 109 -13.987 -4.914 10.757 878 H GLN 110 H GLN 110 -16.168 -3.057 3.723 879 HA GLN 110 HA GLN 110 -17.017 -5.333 5.108 880 HB2 GLN 110 HB2 GLN 110 -19.163 -5.173 4.041 881 HB3 GLN 110 HB3 GLN 110 -18.609 -3.608 4.629 882 HG2 GLN 110 HG2 GLN 110 -18.153 -2.856 2.402 883 HG3 GLN 110 HG3 GLN 110 -18.415 -4.465 1.715 884 HE21 GLN 110 HE21 GLN 110 -20.213 -2.054 3.797 885 HE22 GLN 110 HE22 GLN 110 -21.766 -2.476 3.140 886 H GLU 111 H GLU 111 -15.632 -5.104 1.923 887 HA GLU 111 HA GLU 111 -16.547 -7.478 0.683 888 HB2 GLU 111 HB2 GLU 111 -14.047 -5.801 0.608 889 HB3 GLU 111 HB3 GLU 111 -13.895 -7.411 -0.050 890 HG2 GLU 111 HG2 GLU 111 -16.060 -5.500 -0.966 891 HG3 GLU 111 HG3 GLU 111 -14.443 -5.542 -1.673 892 H ARG 112 H ARG 112 -13.928 -7.024 3.067 893 HA ARG 112 HA ARG 112 -13.642 -10.002 3.231 894 HB2 ARG 112 HB2 ARG 112 -11.705 -7.771 3.909 895 HB3 ARG 112 HB3 ARG 112 -11.412 -9.451 4.332 896 HG2 ARG 112 HG2 ARG 112 -11.926 -8.649 1.434 897 HG3 ARG 112 HG3 ARG 112 -10.346 -8.476 2.173 898 HD2 ARG 112 HD2 ARG 112 -10.384 -10.583 0.992 899 HD3 ARG 112 HD3 ARG 112 -10.265 -10.857 2.730 900 HE ARG 112 HE ARG 112 -12.114 -12.018 2.745 901 HH11 ARG 112 HH11 ARG 112 -12.107 -10.217 -0.286 902 HH12 ARG 112 HH12 ARG 112 -13.645 -10.798 -0.863 903 HH21 ARG 112 HH21 ARG 112 -14.230 -12.818 2.023 904 HH22 ARG 112 HH22 ARG 112 -14.887 -12.236 0.543 905 H TYR 113 H TYR 113 -13.949 -7.138 5.302 906 HA TYR 113 HA TYR 113 -14.252 -8.894 7.655 907 HB2 TYR 113 HB2 TYR 113 -13.828 -5.914 7.495 908 HB3 TYR 113 HB3 TYR 113 -13.610 -6.955 8.903 909 HD1 TYR 113 HD1 TYR 113 -12.008 -5.417 6.086 910 HD2 TYR 113 HD2 TYR 113 -11.802 -8.858 8.679 911 HE1 TYR 113 HE1 TYR 113 -9.606 -5.796 5.423 912 HE2 TYR 113 HE2 TYR 113 -9.410 -9.170 8.079 913 HH TYR 113 HH TYR 113 -7.902 -7.415 5.481 914 H GLY 114 H GLY 114 -16.426 -8.135 5.513 915 HA2 GLY 114 HA2 GLY 114 -18.574 -7.584 7.457 916 HA3 GLY 114 HA3 GLY 114 -18.451 -6.577 6.014 917 H ASN 115 H ASN 115 -20.630 -7.476 5.566 918 HA ASN 115 HA ASN 115 -20.530 -9.715 3.745 919 HB2 ASN 115 HB2 ASN 115 -20.788 -11.098 5.664 920 HB3 ASN 115 HB3 ASN 115 -21.942 -9.985 6.427 921 HD21 ASN 115 HD21 ASN 115 -23.842 -11.304 6.553 922 HD22 ASN 115 HD22 ASN 115 -24.583 -11.952 5.096 923 H LYS 116 H LYS 116 -21.678 -8.817 2.060 924 HA LYS 116 HA LYS 116 -24.385 -7.989 2.487 925 HB2 LYS 116 HB2 LYS 116 -22.511 -5.959 2.564 926 HB3 LYS 116 HB3 LYS 116 -22.808 -6.044 0.824 927 HG2 LYS 116 HG2 LYS 116 -24.894 -5.806 2.995 928 HG3 LYS 116 HG3 LYS 116 -24.247 -4.457 2.040 929 HD2 LYS 116 HD2 LYS 116 -25.140 -5.789 -0.035 930 HD3 LYS 116 HD3 LYS 116 -26.057 -6.723 1.161 931 HE2 LYS 116 HE2 LYS 116 -27.513 -5.107 0.274 932 HE3 LYS 116 HE3 LYS 116 -27.164 -4.657 1.948 933 HZ1 LYS 116 HZ1 LYS 116 -25.731 -2.939 1.167 934 HZ2 LYS 116 HZ2 LYS 116 -25.771 -3.504 -0.393 935 HZ3 LYS 116 HZ3 LYS 116 -27.112 -2.853 0.233 936 H LYS 117 H LYS 117 -25.524 -8.519 0.742 937 HA LYS 117 HA LYS 117 -26.226 -8.907 -1.344 938 HB2 LYS 117 HB2 LYS 117 -24.207 -7.727 -2.245 939 HB3 LYS 117 HB3 LYS 117 -23.401 -9.295 -2.349 940 HG2 LYS 117 HG2 LYS 117 -25.184 -10.075 -3.923 941 HG3 LYS 117 HG3 LYS 117 -25.971 -8.488 -3.760 942 HD2 LYS 117 HD2 LYS 117 -23.740 -7.477 -4.534 943 HD3 LYS 117 HD3 LYS 117 -23.264 -9.121 -4.988 944 HE2 LYS 117 HE2 LYS 117 -25.138 -9.283 -6.557 945 HE3 LYS 117 HE3 LYS 117 -25.837 -7.771 -5.943 946 HZ1 LYS 117 HZ1 LYS 117 -24.703 -7.361 -7.972 947 HZ2 LYS 117 HZ2 LYS 117 -23.878 -6.633 -6.770 948 HZ3 LYS 117 HZ3 LYS 117 -23.318 -8.067 -7.424 949 H SER 118 H SER 118 -26.631 -10.836 -2.521 950 HA SER 118 HA SER 118 -25.531 -13.387 -1.802 951 HB2 SER 118 HB2 SER 118 -26.804 -12.815 0.295 952 HB3 SER 118 HB3 SER 118 -28.249 -12.553 -0.682 953 HG SER 118 HG SER 118 -26.925 -14.942 0.027 954 H GLN 119 H GLN 119 -25.410 -12.806 -4.173 955 HA GLN 119 HA GLN 119 -27.940 -13.435 -5.637 956 HB2 GLN 119 HB2 GLN 119 -26.046 -11.124 -6.035 957 HB3 GLN 119 HB3 GLN 119 -26.741 -11.904 -7.448 958 HG2 GLN 119 HG2 GLN 119 -29.025 -11.536 -6.596 959 HG3 GLN 119 HG3 GLN 119 -28.352 -10.714 -5.181 960 HE21 GLN 119 HE21 GLN 119 -28.106 -10.617 -8.820 961 HE22 GLN 119 HE22 GLN 119 -27.970 -8.880 -8.919 962 H ASP 120 H ASP 120 -27.229 -15.618 -5.617 963 HA ASP 120 HA ASP 120 -24.677 -16.159 -7.029 964 HB2 ASP 120 HB2 ASP 120 -25.426 -17.503 -5.070 965 HB3 ASP 120 HB3 ASP 120 -26.729 -18.160 -6.059 966 H LEU 121 H LEU 121 -28.069 -16.016 -7.609 967 HA LEU 121 HA LEU 121 -28.335 -17.754 -9.801 968 HB2 LEU 121 HB2 LEU 121 -29.881 -15.207 -9.179 969 HB3 LEU 121 HB3 LEU 121 -30.361 -16.399 -10.383 970 HG LEU 121 HG LEU 121 -30.127 -16.916 -7.388 971 HD11 LEU 121 HD11 LEU 121 -32.578 -16.636 -9.174 972 HD12 LEU 121 HD12 LEU 121 -32.586 -17.032 -7.443 973 HD13 LEU 121 HD13 LEU 121 -32.013 -15.446 -7.984 974 HD21 LEU 121 HD21 LEU 121 -29.687 -19.002 -8.597 975 HD22 LEU 121 HD22 LEU 121 -31.305 -19.064 -7.901 976 HD23 LEU 121 HD23 LEU 121 -31.106 -18.737 -9.635 977 H LYS 122 H LYS 122 -27.699 -17.701 -11.755 978 HA LYS 122 HA LYS 122 -26.470 -17.221 -13.548 979 HB2 LYS 122 HB2 LYS 122 -28.924 -16.724 -13.941 980 HB3 LYS 122 HB3 LYS 122 -28.518 -15.009 -13.931 981 HG2 LYS 122 HG2 LYS 122 -27.274 -15.199 -15.939 982 HG3 LYS 122 HG3 LYS 122 -26.995 -16.940 -15.705 983 HD2 LYS 122 HD2 LYS 122 -29.346 -17.421 -16.190 984 HD3 LYS 122 HD3 LYS 122 -29.669 -15.688 -16.432 985 HE2 LYS 122 HE2 LYS 122 -28.070 -15.639 -18.319 986 HE3 LYS 122 HE3 LYS 122 -27.622 -17.314 -18.001 987 HZ1 LYS 122 HZ1 LYS 122 -29.748 -18.047 -18.601 988 HZ2 LYS 122 HZ2 LYS 122 -30.325 -16.490 -18.806 989 HZ3 LYS 122 HZ3 LYS 122 -29.204 -17.113 -19.823 Start of MODEL 6 1 H1 GLY 1 H GLY 1 26.079 -18.348 -7.395 2 HA2 GLY 1 HA2 GLY 1 24.511 -18.923 -5.565 3 HA3 GLY 1 HA3 GLY 1 26.209 -18.908 -5.032 4 H SER 2 H SER 2 23.451 -18.166 -3.664 5 HA SER 2 HA SER 2 23.443 -15.412 -3.163 6 HB2 SER 2 HB2 SER 2 22.647 -17.597 -1.205 7 HB3 SER 2 HB3 SER 2 21.989 -15.955 -1.347 8 HG SER 2 HG SER 2 20.545 -17.235 -2.390 9 H ASN 3 H ASN 3 24.883 -14.171 -2.084 10 HA ASN 3 HA ASN 3 26.695 -15.437 -0.080 11 HB2 ASN 3 HB2 ASN 3 27.421 -13.283 -2.090 12 HB3 ASN 3 HB3 ASN 3 28.449 -13.830 -0.768 13 HD21 ASN 3 HD21 ASN 3 28.283 -14.043 -3.987 14 HD22 ASN 3 HD22 ASN 3 28.795 -15.698 -4.233 15 H GLN 4 H GLN 4 25.731 -12.157 -1.242 16 HA GLN 4 HA GLN 4 25.650 -11.149 1.506 17 HB2 GLN 4 HB2 GLN 4 24.888 -9.864 -1.163 18 HB3 GLN 4 HB3 GLN 4 24.954 -9.039 0.388 19 HG2 GLN 4 HG2 GLN 4 27.054 -8.472 -0.125 20 HG3 GLN 4 HG3 GLN 4 27.519 -10.143 0.186 21 HE21 GLN 4 HE21 GLN 4 27.255 -7.629 -2.225 22 HE22 GLN 4 HE22 GLN 4 27.667 -8.587 -3.597 23 H GLN 5 H GLN 5 23.791 -10.542 2.576 24 HA GLN 5 HA GLN 5 21.763 -10.561 3.355 25 HB2 GLN 5 HB2 GLN 5 21.557 -9.199 1.060 26 HB3 GLN 5 HB3 GLN 5 20.428 -10.495 0.669 27 HG2 GLN 5 HG2 GLN 5 19.210 -8.641 1.539 28 HG3 GLN 5 HG3 GLN 5 19.166 -9.870 2.799 29 HE21 GLN 5 HE21 GLN 5 18.616 -7.192 3.354 30 HE22 GLN 5 HE22 GLN 5 19.866 -6.586 4.432 31 H LEU 6 H LEU 6 19.342 -11.652 3.112 32 HA LEU 6 HA LEU 6 19.516 -14.437 2.446 33 HB2 LEU 6 HB2 LEU 6 18.766 -15.058 4.746 34 HB3 LEU 6 HB3 LEU 6 20.419 -14.574 4.640 35 HG LEU 6 HG LEU 6 18.889 -13.855 6.619 36 HD11 LEU 6 HD11 LEU 6 20.302 -11.939 7.051 37 HD12 LEU 6 HD12 LEU 6 21.220 -13.276 6.352 38 HD13 LEU 6 HD13 LEU 6 20.790 -11.879 5.347 39 HD21 LEU 6 HD21 LEU 6 18.313 -11.423 4.884 40 HD22 LEU 6 HD22 LEU 6 17.109 -12.618 5.430 41 HD23 LEU 6 HD23 LEU 6 17.962 -11.633 6.602 42 H ASN 7 H ASN 7 17.441 -15.310 3.406 43 HA ASN 7 HA ASN 7 15.170 -14.030 2.068 44 HB2 ASN 7 HB2 ASN 7 15.985 -16.578 2.130 45 HB3 ASN 7 HB3 ASN 7 15.013 -16.637 3.596 46 HD21 ASN 7 HD21 ASN 7 14.948 -17.060 0.259 47 HD22 ASN 7 HD22 ASN 7 13.193 -17.003 0.079 48 H ALA 8 H ALA 8 13.131 -13.556 3.110 49 HA ALA 8 HA ALA 8 13.278 -12.324 5.645 50 HB1 ALA 8 HB1 ALA 8 11.637 -11.791 3.825 51 HB2 ALA 8 HB2 ALA 8 10.824 -13.337 4.146 52 HB3 ALA 8 HB3 ALA 8 10.841 -12.081 5.392 53 H THR 9 H THR 9 12.978 -13.054 7.743 54 HA THR 9 HA THR 9 12.476 -15.871 8.189 55 HB THR 9 HB THR 9 12.830 -13.645 10.224 56 HG1 THR 9 HG1 THR 9 15.087 -14.506 10.042 57 HG21 THR 9 HG21 THR 9 12.263 -15.820 11.243 58 HG22 THR 9 HG22 THR 9 13.506 -16.623 10.264 59 HG23 THR 9 HG23 THR 9 13.963 -15.464 11.534 60 H LYS 10 H LYS 10 10.451 -13.267 7.676 61 HA LYS 10 HA LYS 10 8.192 -14.582 9.028 62 HB2 LYS 10 HB2 LYS 10 9.158 -12.420 10.210 63 HB3 LYS 10 HB3 LYS 10 8.277 -11.564 8.941 64 HG2 LYS 10 HG2 LYS 10 6.156 -12.676 9.727 65 HG3 LYS 10 HG3 LYS 10 7.100 -13.607 10.891 66 HD2 LYS 10 HD2 LYS 10 6.144 -11.869 12.158 67 HD3 LYS 10 HD3 LYS 10 7.833 -11.401 11.922 68 HE2 LYS 10 HE2 LYS 10 7.027 -10.024 9.916 69 HE3 LYS 10 HE3 LYS 10 5.371 -10.341 10.460 70 HZ1 LYS 10 HZ1 LYS 10 6.259 -8.224 11.246 71 HZ2 LYS 10 HZ2 LYS 10 5.879 -9.197 12.510 72 HZ3 LYS 10 HZ3 LYS 10 7.449 -8.974 12.065 73 H LYS 11 H LYS 11 6.271 -12.698 7.924 74 HA LYS 11 HA LYS 11 5.867 -13.875 5.360 75 HB2 LYS 11 HB2 LYS 11 4.747 -11.361 6.638 76 HB3 LYS 11 HB3 LYS 11 4.341 -11.851 5.003 77 HG2 LYS 11 HG2 LYS 11 2.526 -12.454 6.225 78 HG3 LYS 11 HG3 LYS 11 3.332 -13.958 5.873 79 HD2 LYS 11 HD2 LYS 11 3.587 -12.515 8.560 80 HD3 LYS 11 HD3 LYS 11 2.267 -13.619 8.168 81 HE2 LYS 11 HE2 LYS 11 4.081 -15.355 7.568 82 HE3 LYS 11 HE3 LYS 11 5.210 -14.306 8.424 83 HZ1 LYS 11 HZ1 LYS 11 4.472 -15.824 9.967 84 HZ2 LYS 11 HZ2 LYS 11 3.575 -14.505 10.346 85 HZ3 LYS 11 HZ3 LYS 11 2.901 -15.743 9.490 86 H ASP 12 H ASP 12 7.408 -13.645 3.795 87 HA ASP 12 HA ASP 12 9.191 -11.515 3.454 88 HB2 ASP 12 HB2 ASP 12 9.701 -12.585 1.330 89 HB3 ASP 12 HB3 ASP 12 9.258 -13.891 2.427 90 H LYS 13 H LYS 13 5.879 -11.922 2.226 91 HA LYS 13 HA LYS 13 5.905 -9.813 0.335 92 HB2 LYS 13 HB2 LYS 13 3.620 -10.978 1.986 93 HB3 LYS 13 HB3 LYS 13 3.432 -10.014 0.518 94 HG2 LYS 13 HG2 LYS 13 4.880 -12.677 0.520 95 HG3 LYS 13 HG3 LYS 13 3.155 -12.558 0.327 96 HD2 LYS 13 HD2 LYS 13 5.024 -11.011 -1.500 97 HD3 LYS 13 HD3 LYS 13 4.609 -12.713 -1.787 98 HE2 LYS 13 HE2 LYS 13 2.218 -12.180 -1.800 99 HE3 LYS 13 HE3 LYS 13 2.555 -10.474 -1.495 100 HZ1 LYS 13 HZ1 LYS 13 2.109 -11.051 -3.833 101 HZ2 LYS 13 HZ2 LYS 13 3.587 -10.327 -3.628 102 HZ3 LYS 13 HZ3 LYS 13 3.523 -11.922 -3.889 103 H LEU 14 H LEU 14 5.357 -9.901 3.958 104 HA LEU 14 HA LEU 14 4.541 -7.082 3.917 105 HB2 LEU 14 HB2 LEU 14 5.345 -8.868 6.238 106 HB3 LEU 14 HB3 LEU 14 4.529 -7.306 6.332 107 HG LEU 14 HG LEU 14 3.355 -9.835 5.073 108 HD11 LEU 14 HD11 LEU 14 3.611 -9.798 7.583 109 HD12 LEU 14 HD12 LEU 14 2.536 -8.401 7.595 110 HD13 LEU 14 HD13 LEU 14 1.946 -9.967 6.989 111 HD21 LEU 14 HD21 LEU 14 2.414 -7.917 3.940 112 HD22 LEU 14 HD22 LEU 14 1.211 -8.532 5.077 113 HD23 LEU 14 HD23 LEU 14 2.169 -7.083 5.477 114 H GLN 15 H GLN 15 7.465 -8.990 4.126 115 HA GLN 15 HA GLN 15 9.212 -7.215 5.386 116 HB2 GLN 15 HB2 GLN 15 9.349 -9.755 4.523 117 HB3 GLN 15 HB3 GLN 15 10.163 -9.009 3.152 118 HG2 GLN 15 HG2 GLN 15 11.830 -9.713 4.736 119 HG3 GLN 15 HG3 GLN 15 11.752 -7.950 4.799 120 HE21 GLN 15 HE21 GLN 15 11.682 -7.199 6.805 121 HE22 GLN 15 HE22 GLN 15 10.867 -7.873 8.210 122 H VAL 16 H VAL 16 8.582 -7.563 1.830 123 HA VAL 16 HA VAL 16 10.451 -5.538 1.113 124 HB VAL 16 HB VAL 16 9.329 -5.452 -1.057 125 HG11 VAL 16 HG11 VAL 16 9.566 -8.312 -0.027 126 HG12 VAL 16 HG12 VAL 16 9.700 -7.772 -1.709 127 HG13 VAL 16 HG13 VAL 16 10.925 -7.283 -0.526 128 HG21 VAL 16 HG21 VAL 16 7.251 -7.312 0.176 129 HG22 VAL 16 HG22 VAL 16 6.975 -5.655 -0.427 130 HG23 VAL 16 HG23 VAL 16 7.418 -6.957 -1.544 131 H ILE 17 H ILE 17 7.124 -5.272 2.267 132 HA ILE 17 HA ILE 17 6.832 -2.524 1.516 133 HB ILE 17 HB ILE 17 5.336 -3.602 3.873 134 HG12 ILE 17 HG12 ILE 17 4.573 -4.240 0.997 135 HG13 ILE 17 HG13 ILE 17 5.200 -5.400 2.181 136 HG21 ILE 17 HG21 ILE 17 3.639 -2.070 2.995 137 HG22 ILE 17 HG22 ILE 17 5.195 -1.256 3.145 138 HG23 ILE 17 HG23 ILE 17 4.620 -1.778 1.544 139 HD11 ILE 17 HD11 ILE 17 2.555 -3.952 2.304 140 HD12 ILE 17 HD12 ILE 17 2.861 -5.684 2.229 141 HD13 ILE 17 HD13 ILE 17 3.267 -4.805 3.703 142 H ASP 18 H ASP 18 7.904 -4.191 4.397 143 HA ASP 18 HA ASP 18 8.255 -1.971 6.131 144 HB2 ASP 18 HB2 ASP 18 8.405 -4.511 6.616 145 HB3 ASP 18 HB3 ASP 18 10.101 -4.384 6.137 146 H TRP 19 H TRP 19 10.420 -3.375 3.675 147 HA TRP 19 HA TRP 19 12.677 -1.671 4.153 148 HB2 TRP 19 HB2 TRP 19 12.925 -3.764 2.963 149 HB3 TRP 19 HB3 TRP 19 11.781 -3.276 1.728 150 HD1 TRP 19 HD1 TRP 19 12.631 -1.658 -0.221 151 HE1 TRP 19 HE1 TRP 19 14.930 -1.033 -1.086 152 HE3 TRP 19 HE3 TRP 19 15.473 -3.251 3.754 153 HZ2 TRP 19 HZ2 TRP 19 17.666 -1.478 -0.359 154 HZ3 TRP 19 HZ3 TRP 19 17.955 -3.120 3.618 155 HH2 TRP 19 HH2 TRP 19 19.057 -2.263 1.566 156 H LEU 20 H LEU 20 10.091 -1.476 1.551 157 HA LEU 20 HA LEU 20 11.074 0.998 0.623 158 HB2 LEU 20 HB2 LEU 20 8.976 1.320 -0.549 159 HB3 LEU 20 HB3 LEU 20 9.699 -0.267 -0.790 160 HG LEU 20 HG LEU 20 8.031 -0.863 1.202 161 HD11 LEU 20 HD11 LEU 20 7.030 1.415 1.312 162 HD12 LEU 20 HD12 LEU 20 6.492 1.222 -0.366 163 HD13 LEU 20 HD13 LEU 20 5.848 0.168 0.917 164 HD21 LEU 20 HD21 LEU 20 6.533 -1.823 -0.453 165 HD22 LEU 20 HD22 LEU 20 7.264 -0.812 -1.717 166 HD23 LEU 20 HD23 LEU 20 8.217 -2.054 -0.870 167 H ILE 21 H ILE 21 8.911 0.359 3.338 168 HA ILE 21 HA ILE 21 7.994 3.065 3.663 169 HB ILE 21 HB ILE 21 8.212 0.629 5.452 170 HG12 ILE 21 HG12 ILE 21 5.766 2.265 4.674 171 HG13 ILE 21 HG13 ILE 21 6.397 0.990 3.642 172 HG21 ILE 21 HG21 ILE 21 7.511 3.440 6.360 173 HG22 ILE 21 HG22 ILE 21 6.942 2.000 7.220 174 HG23 ILE 21 HG23 ILE 21 8.673 2.333 7.042 175 HD11 ILE 21 HD11 ILE 21 6.096 -0.651 5.504 176 HD12 ILE 21 HD12 ILE 21 5.387 0.652 6.477 177 HD13 ILE 21 HD13 ILE 21 4.578 0.128 4.999 178 H GLU 22 H GLU 22 10.755 1.207 5.062 179 HA GLU 22 HA GLU 22 11.760 3.455 6.494 180 HB2 GLU 22 HB2 GLU 22 12.193 0.994 6.919 181 HB3 GLU 22 HB3 GLU 22 13.315 1.016 5.548 182 HG2 GLU 22 HG2 GLU 22 14.695 2.718 6.704 183 HG3 GLU 22 HG3 GLU 22 13.497 2.826 8.005 184 H ASN 23 H ASN 23 12.155 2.414 3.160 185 HA ASN 23 HA ASN 23 14.552 3.844 2.520 186 HB2 ASN 23 HB2 ASN 23 12.283 2.715 0.902 187 HB3 ASN 23 HB3 ASN 23 13.334 3.883 0.153 188 HD21 ASN 23 HD21 ASN 23 13.963 1.045 2.390 189 HD22 ASN 23 HD22 ASN 23 15.276 0.481 1.373 190 H PHE 24 H PHE 24 11.088 4.850 2.216 191 HA PHE 24 HA PHE 24 12.104 7.645 1.899 192 HB2 PHE 24 HB2 PHE 24 9.749 6.320 0.612 193 HB3 PHE 24 HB3 PHE 24 9.851 8.064 0.797 194 HD1 PHE 24 HD1 PHE 24 12.560 8.899 0.205 195 HD2 PHE 24 HD2 PHE 24 10.212 5.777 -1.644 196 HE1 PHE 24 HE1 PHE 24 13.756 9.233 -1.914 197 HE2 PHE 24 HE2 PHE 24 11.518 6.092 -3.747 198 HZ PHE 24 HZ PHE 24 13.270 7.819 -3.873 199 HA PRO 25 HA PRO 25 9.957 7.689 5.923 200 HB2 PRO 25 HB2 PRO 25 11.691 9.394 7.228 201 HB3 PRO 25 HB3 PRO 25 12.017 7.671 7.004 202 HG2 PRO 25 HG2 PRO 25 12.991 9.959 5.278 203 HG3 PRO 25 HG3 PRO 25 13.963 8.653 6.033 204 HD2 PRO 25 HD2 PRO 25 13.145 8.468 3.480 205 HD3 PRO 25 HD3 PRO 25 13.103 7.027 4.538 206 H ASN 26 H ASN 26 9.779 9.651 3.315 207 HA ASN 26 HA ASN 26 9.340 12.208 4.654 208 HB2 ASN 26 HB2 ASN 26 8.756 11.353 1.850 209 HB3 ASN 26 HB3 ASN 26 8.350 12.934 2.495 210 HD21 ASN 26 HD21 ASN 26 10.974 10.905 1.628 211 HD22 ASN 26 HD22 ASN 26 12.270 12.107 1.706 212 H ALA 27 H ALA 27 7.468 9.364 3.939 213 HA ALA 27 HA ALA 27 5.110 10.064 5.377 214 HB1 ALA 27 HB1 ALA 27 4.479 11.572 3.636 215 HB2 ALA 27 HB2 ALA 27 5.197 10.571 2.366 216 HB3 ALA 27 HB3 ALA 27 3.678 10.058 3.156 217 H PHE 28 H PHE 28 4.829 7.988 6.070 218 HA PHE 28 HA PHE 28 3.842 5.938 4.490 219 HB2 PHE 28 HB2 PHE 28 6.803 5.890 4.783 220 HB3 PHE 28 HB3 PHE 28 6.002 4.435 5.326 221 HD1 PHE 28 HD1 PHE 28 3.796 3.885 3.575 222 HD2 PHE 28 HD2 PHE 28 7.706 5.492 2.633 223 HE1 PHE 28 HE1 PHE 28 3.603 3.041 1.239 224 HE2 PHE 28 HE2 PHE 28 7.493 4.560 0.330 225 HZ PHE 28 HZ PHE 28 5.462 3.309 -0.315 226 H PHE 29 H PHE 29 3.629 3.823 5.910 227 HA PHE 29 HA PHE 29 3.937 4.126 8.774 228 HB2 PHE 29 HB2 PHE 29 1.188 4.067 7.471 229 HB3 PHE 29 HB3 PHE 29 1.513 3.620 9.137 230 HD1 PHE 29 HD1 PHE 29 1.074 6.428 6.829 231 HD2 PHE 29 HD2 PHE 29 2.466 5.287 10.750 232 HE1 PHE 29 HE1 PHE 29 0.915 8.788 7.587 233 HE2 PHE 29 HE2 PHE 29 2.126 7.616 11.547 234 HZ PHE 29 HZ PHE 29 1.287 9.334 10.002 235 H LYS 30 H LYS 30 3.943 2.043 9.723 236 HA LYS 30 HA LYS 30 3.986 -0.272 7.840 237 HB2 LYS 30 HB2 LYS 30 4.793 0.049 10.761 238 HB3 LYS 30 HB3 LYS 30 4.609 -1.524 10.005 239 HG2 LYS 30 HG2 LYS 30 6.783 -1.376 9.651 240 HG3 LYS 30 HG3 LYS 30 6.331 -0.461 8.216 241 HD2 LYS 30 HD2 LYS 30 6.584 1.647 9.579 242 HD3 LYS 30 HD3 LYS 30 7.099 0.667 10.951 243 HE2 LYS 30 HE2 LYS 30 8.542 0.700 8.264 244 HE3 LYS 30 HE3 LYS 30 8.968 1.743 9.630 245 HZ1 LYS 30 HZ1 LYS 30 9.196 -1.193 9.473 246 HZ2 LYS 30 HZ2 LYS 30 10.384 -0.074 9.665 247 HZ3 LYS 30 HZ3 LYS 30 9.370 -0.358 10.898 248 H LYS 31 H LYS 31 2.401 0.594 10.902 249 HA LYS 31 HA LYS 31 0.649 -1.658 11.039 250 HB2 LYS 31 HB2 LYS 31 1.053 0.922 12.437 251 HB3 LYS 31 HB3 LYS 31 -0.656 0.596 12.268 252 HG2 LYS 31 HG2 LYS 31 -0.328 -1.660 13.290 253 HG3 LYS 31 HG3 LYS 31 1.375 -1.259 13.534 254 HD2 LYS 31 HD2 LYS 31 0.610 0.775 14.853 255 HD3 LYS 31 HD3 LYS 31 -1.043 0.126 14.754 256 HE2 LYS 31 HE2 LYS 31 -0.354 -1.919 15.916 257 HE3 LYS 31 HE3 LYS 31 1.329 -1.386 15.919 258 HZ1 LYS 31 HZ1 LYS 31 -0.872 -0.030 17.358 259 HZ2 LYS 31 HZ2 LYS 31 0.334 -0.966 18.019 260 HZ3 LYS 31 HZ3 LYS 31 0.679 0.480 17.317 261 H GLY 32 H GLY 32 -1.911 -1.101 11.136 262 HA2 GLY 32 HA2 GLY 32 -2.654 0.008 8.439 263 HA3 GLY 32 HA3 GLY 32 -3.544 -1.201 9.374 264 H ASN 33 H ASN 33 -3.188 0.227 11.949 265 HA ASN 33 HA ASN 33 -5.483 1.848 11.818 266 HB2 ASN 33 HB2 ASN 33 -5.549 1.778 14.020 267 HB3 ASN 33 HB3 ASN 33 -4.381 0.497 13.846 268 HD21 ASN 33 HD21 ASN 33 -1.945 2.100 13.472 269 HD22 ASN 33 HD22 ASN 33 -1.732 3.030 14.948 270 H GLN 34 H GLN 34 -2.213 2.971 11.331 271 HA GLN 34 HA GLN 34 -3.183 5.772 11.570 272 HB2 GLN 34 HB2 GLN 34 -0.850 6.411 12.080 273 HB3 GLN 34 HB3 GLN 34 -1.642 5.446 13.334 274 HG2 GLN 34 HG2 GLN 34 -0.376 3.451 12.581 275 HG3 GLN 34 HG3 GLN 34 0.394 4.444 11.336 276 HE21 GLN 34 HE21 GLN 34 0.245 6.403 14.131 277 HE22 GLN 34 HE22 GLN 34 1.859 6.035 14.692 278 H VAL 35 H VAL 35 -2.874 3.487 9.364 279 HA VAL 35 HA VAL 35 -1.049 4.662 7.468 280 HB VAL 35 HB VAL 35 -1.970 2.245 7.724 281 HG11 VAL 35 HG11 VAL 35 -4.043 3.067 5.679 282 HG12 VAL 35 HG12 VAL 35 -3.849 1.516 6.553 283 HG13 VAL 35 HG13 VAL 35 -4.428 2.964 7.387 284 HG21 VAL 35 HG21 VAL 35 -0.358 2.871 6.019 285 HG22 VAL 35 HG22 VAL 35 -1.524 1.691 5.411 286 HG23 VAL 35 HG23 VAL 35 -1.679 3.396 4.941 287 H LYS 36 H LYS 36 -1.616 5.789 5.442 288 HA LYS 36 HA LYS 36 -4.303 7.006 5.344 289 HB2 LYS 36 HB2 LYS 36 -3.515 9.221 5.227 290 HB3 LYS 36 HB3 LYS 36 -2.868 8.515 6.687 291 HG2 LYS 36 HG2 LYS 36 -0.645 8.487 5.787 292 HG3 LYS 36 HG3 LYS 36 -1.227 8.858 4.143 293 HD2 LYS 36 HD2 LYS 36 -2.089 11.020 4.849 294 HD3 LYS 36 HD3 LYS 36 -1.695 10.689 6.543 295 HE2 LYS 36 HE2 LYS 36 0.673 10.765 6.091 296 HE3 LYS 36 HE3 LYS 36 0.394 10.858 4.334 297 HZ1 LYS 36 HZ1 LYS 36 0.866 13.019 5.413 298 HZ2 LYS 36 HZ2 LYS 36 -0.510 13.006 4.577 299 HZ3 LYS 36 HZ3 LYS 36 -0.576 12.945 6.204 300 HA PRO 37 HA PRO 37 -3.722 6.244 1.063 301 HB2 PRO 37 HB2 PRO 37 -5.020 8.246 -0.270 302 HB3 PRO 37 HB3 PRO 37 -5.862 6.984 0.672 303 HG2 PRO 37 HG2 PRO 37 -5.131 9.785 1.581 304 HG3 PRO 37 HG3 PRO 37 -6.708 8.952 1.728 305 HD2 PRO 37 HD2 PRO 37 -4.934 9.053 3.759 306 HD3 PRO 37 HD3 PRO 37 -5.917 7.588 3.490 307 H LEU 38 H LEU 38 -2.274 6.583 -0.526 308 HA LEU 38 HA LEU 38 -0.310 8.829 -0.263 309 HB2 LEU 38 HB2 LEU 38 -0.114 6.003 -1.377 310 HB3 LEU 38 HB3 LEU 38 1.167 7.192 -1.545 311 HG LEU 38 HG LEU 38 0.089 6.392 1.200 312 HD11 LEU 38 HD11 LEU 38 1.991 4.816 1.344 313 HD12 LEU 38 HD12 LEU 38 0.766 4.330 0.132 314 HD13 LEU 38 HD13 LEU 38 2.310 5.056 -0.380 315 HD21 LEU 38 HD21 LEU 38 1.510 8.447 1.081 316 HD22 LEU 38 HD22 LEU 38 2.281 7.143 2.000 317 HD23 LEU 38 HD23 LEU 38 2.801 7.481 0.343 318 H LYS 39 H LYS 39 0.756 9.381 -2.453 319 HA LYS 39 HA LYS 39 -1.135 10.382 -4.295 320 HB2 LYS 39 HB2 LYS 39 1.157 11.227 -4.101 321 HB3 LYS 39 HB3 LYS 39 1.820 9.669 -4.530 322 HG2 LYS 39 HG2 LYS 39 0.183 10.503 -6.759 323 HG3 LYS 39 HG3 LYS 39 1.085 11.895 -6.234 324 HD2 LYS 39 HD2 LYS 39 3.203 10.511 -6.327 325 HD3 LYS 39 HD3 LYS 39 2.246 9.191 -7.014 326 HE2 LYS 39 HE2 LYS 39 1.527 10.824 -8.853 327 HE3 LYS 39 HE3 LYS 39 2.690 11.974 -8.162 328 HZ1 LYS 39 HZ1 LYS 39 3.923 10.940 -9.779 329 HZ2 LYS 39 HZ2 LYS 39 4.326 10.015 -8.490 330 HZ3 LYS 39 HZ3 LYS 39 3.232 9.469 -9.576 331 H ILE 40 H ILE 40 -1.833 9.588 -6.407 332 HA ILE 40 HA ILE 40 -2.166 6.736 -6.473 333 HB ILE 40 HB ILE 40 -3.862 8.264 -7.355 334 HG12 ILE 40 HG12 ILE 40 -4.348 7.203 -9.473 335 HG13 ILE 40 HG13 ILE 40 -2.695 6.622 -9.639 336 HG21 ILE 40 HG21 ILE 40 -1.889 9.017 -9.557 337 HG22 ILE 40 HG22 ILE 40 -3.578 9.523 -9.438 338 HG23 ILE 40 HG23 ILE 40 -2.401 10.080 -8.240 339 HD11 ILE 40 HD11 ILE 40 -4.391 4.912 -8.860 340 HD12 ILE 40 HD12 ILE 40 -3.006 5.081 -7.770 341 HD13 ILE 40 HD13 ILE 40 -4.554 5.843 -7.353 342 H GLY 41 H GLY 41 -1.068 5.243 -7.839 343 HA2 GLY 41 HA2 GLY 41 0.669 4.377 -9.012 344 HA3 GLY 41 HA3 GLY 41 0.835 5.945 -9.810 345 H ILE 42 H ILE 42 1.292 6.252 -6.425 346 HA ILE 42 HA ILE 42 3.833 7.146 -6.437 347 HB ILE 42 HB ILE 42 2.165 7.420 -4.711 348 HG12 ILE 42 HG12 ILE 42 4.922 6.566 -3.887 349 HG13 ILE 42 HG13 ILE 42 4.390 8.155 -4.408 350 HG21 ILE 42 HG21 ILE 42 1.340 5.119 -4.478 351 HG22 ILE 42 HG22 ILE 42 2.926 4.605 -3.892 352 HG23 ILE 42 HG23 ILE 42 1.932 5.682 -2.921 353 HD11 ILE 42 HD11 ILE 42 2.952 8.312 -2.370 354 HD12 ILE 42 HD12 ILE 42 3.634 6.743 -1.815 355 HD13 ILE 42 HD13 ILE 42 4.682 8.148 -2.040 356 H PHE 43 H PHE 43 2.972 3.631 -6.451 357 HA PHE 43 HA PHE 43 5.472 2.649 -5.521 358 HB2 PHE 43 HB2 PHE 43 3.995 0.900 -5.717 359 HB3 PHE 43 HB3 PHE 43 3.151 1.608 -7.080 360 HD1 PHE 43 HD1 PHE 43 3.609 0.993 -9.317 361 HD2 PHE 43 HD2 PHE 43 6.300 -0.294 -6.202 362 HE1 PHE 43 HE1 PHE 43 4.770 -0.496 -10.915 363 HE2 PHE 43 HE2 PHE 43 7.521 -1.682 -7.828 364 HZ PHE 43 HZ PHE 43 6.752 -1.801 -10.196 365 H ASP 44 H ASP 44 4.396 3.883 -8.697 366 HA ASP 44 HA ASP 44 6.597 3.007 -10.256 367 HB2 ASP 44 HB2 ASP 44 4.241 3.874 -10.904 368 HB3 ASP 44 HB3 ASP 44 4.928 5.495 -10.745 369 H ASP 45 H ASP 45 6.169 5.707 -8.070 370 HA ASP 45 HA ASP 45 8.429 7.302 -9.048 371 HB2 ASP 45 HB2 ASP 45 6.753 7.357 -6.471 372 HB3 ASP 45 HB3 ASP 45 8.066 8.469 -6.847 373 H LEU 46 H LEU 46 7.637 5.153 -6.462 374 HA LEU 46 HA LEU 46 10.035 5.219 -4.915 375 HB2 LEU 46 HB2 LEU 46 8.034 4.757 -3.807 376 HB3 LEU 46 HB3 LEU 46 7.491 3.627 -5.043 377 HG LEU 46 HG LEU 46 9.270 1.985 -4.273 378 HD11 LEU 46 HD11 LEU 46 10.641 3.729 -3.000 379 HD12 LEU 46 HD12 LEU 46 9.348 3.719 -1.773 380 HD13 LEU 46 HD13 LEU 46 10.275 2.250 -2.124 381 HD21 LEU 46 HD21 LEU 46 6.891 1.818 -3.790 382 HD22 LEU 46 HD22 LEU 46 7.916 1.156 -2.518 383 HD23 LEU 46 HD23 LEU 46 7.136 2.739 -2.279 384 H ILE 47 H ILE 47 8.827 2.983 -7.390 385 HA ILE 47 HA ILE 47 10.584 0.840 -6.923 386 HB ILE 47 HB ILE 47 8.585 0.998 -8.479 387 HG12 ILE 47 HG12 ILE 47 10.191 -0.958 -8.260 388 HG13 ILE 47 HG13 ILE 47 9.062 -0.896 -9.601 389 HG21 ILE 47 HG21 ILE 47 10.611 1.963 -10.556 390 HG22 ILE 47 HG22 ILE 47 8.894 1.545 -10.821 391 HG23 ILE 47 HG23 ILE 47 9.337 2.927 -9.814 392 HD11 ILE 47 HD11 ILE 47 10.725 -0.385 -11.187 393 HD12 ILE 47 HD12 ILE 47 11.931 -0.023 -9.952 394 HD13 ILE 47 HD13 ILE 47 11.373 -1.687 -10.163 395 H ASP 48 H ASP 48 11.116 3.970 -8.548 396 HA ASP 48 HA ASP 48 13.482 3.400 -9.937 397 HB2 ASP 48 HB2 ASP 48 12.502 5.935 -8.571 398 HB3 ASP 48 HB3 ASP 48 13.978 5.877 -9.503 399 H PHE 49 H PHE 49 12.990 4.076 -6.499 400 HA PHE 49 HA PHE 49 15.774 4.454 -5.882 401 HB2 PHE 49 HB2 PHE 49 13.673 5.146 -4.555 402 HB3 PHE 49 HB3 PHE 49 13.633 3.497 -3.960 403 HD1 PHE 49 HD1 PHE 49 13.549 5.110 -1.889 404 HD2 PHE 49 HD2 PHE 49 17.135 4.398 -4.193 405 HE1 PHE 49 HE1 PHE 49 14.947 5.809 0.010 406 HE2 PHE 49 HE2 PHE 49 18.499 5.044 -2.268 407 HZ PHE 49 HZ PHE 49 17.394 5.755 -0.130 408 H TYR 50 H TYR 50 13.696 1.581 -6.180 409 HA TYR 50 HA TYR 50 15.435 -0.247 -4.816 410 HB2 TYR 50 HB2 TYR 50 13.581 -1.401 -5.012 411 HB3 TYR 50 HB3 TYR 50 12.965 -0.418 -6.314 412 HD1 TYR 50 HD1 TYR 50 14.710 -3.549 -5.498 413 HD2 TYR 50 HD2 TYR 50 13.405 -0.965 -8.657 414 HE1 TYR 50 HE1 TYR 50 14.912 -5.426 -7.131 415 HE2 TYR 50 HE2 TYR 50 13.656 -2.792 -10.301 416 HH TYR 50 HH TYR 50 14.692 -4.930 -10.567 417 H GLU 51 H GLU 51 15.353 1.145 -8.085 418 HA GLU 51 HA GLU 51 17.185 -0.680 -9.285 419 HB2 GLU 51 HB2 GLU 51 16.344 2.103 -10.096 420 HB3 GLU 51 HB3 GLU 51 17.348 1.033 -11.076 421 HG2 GLU 51 HG2 GLU 51 14.756 -0.019 -10.016 422 HG3 GLU 51 HG3 GLU 51 14.670 1.124 -11.334 423 H ARG 52 H ARG 52 17.596 1.770 -6.974 424 HA ARG 52 HA ARG 52 20.386 2.470 -7.635 425 HB2 ARG 52 HB2 ARG 52 18.437 3.996 -6.609 426 HB3 ARG 52 HB3 ARG 52 18.966 3.279 -5.098 427 HG2 ARG 52 HG2 ARG 52 20.088 5.351 -5.296 428 HG3 ARG 52 HG3 ARG 52 21.307 4.108 -5.579 429 HD2 ARG 52 HD2 ARG 52 21.097 4.491 -8.040 430 HD3 ARG 52 HD3 ARG 52 19.855 5.718 -7.727 431 HE ARG 52 HE ARG 52 22.372 6.147 -6.328 432 HH11 ARG 52 HH11 ARG 52 20.817 6.798 -9.498 433 HH12 ARG 52 HH12 ARG 52 21.504 8.374 -9.605 434 HH21 ARG 52 HH21 ARG 52 23.464 8.126 -6.710 435 HH22 ARG 52 HH22 ARG 52 23.002 9.117 -8.054 436 H LEU 53 H LEU 53 18.703 0.047 -5.628 437 HA LEU 53 HA LEU 53 20.613 -0.199 -3.591 438 HB2 LEU 53 HB2 LEU 53 18.875 -2.331 -4.869 439 HB3 LEU 53 HB3 LEU 53 19.597 -2.384 -3.267 440 HG LEU 53 HG LEU 53 17.405 -0.523 -4.221 441 HD11 LEU 53 HD11 LEU 53 17.432 -2.783 -2.191 442 HD12 LEU 53 HD12 LEU 53 16.048 -1.721 -2.563 443 HD13 LEU 53 HD13 LEU 53 16.684 -2.798 -3.798 444 HD21 LEU 53 HD21 LEU 53 18.631 0.883 -2.819 445 HD22 LEU 53 HD22 LEU 53 17.332 0.274 -1.817 446 HD23 LEU 53 HD23 LEU 53 18.984 -0.399 -1.656 447 H ASP 54 H ASP 54 22.608 -1.086 -3.644 448 HA ASP 54 HA ASP 54 23.941 -1.635 -6.112 449 HB2 ASP 54 HB2 ASP 54 25.053 -0.818 -4.081 450 HB3 ASP 54 HB3 ASP 54 24.694 -2.338 -3.245 451 H THR 55 H THR 55 22.354 -3.699 -3.748 452 HA THR 55 HA THR 55 22.454 -5.996 -5.603 453 HB THR 55 HB THR 55 22.869 -7.377 -3.380 454 HG1 THR 55 HG1 THR 55 24.800 -5.574 -2.757 455 HG21 THR 55 HG21 THR 55 24.246 -7.399 -5.456 456 HG22 THR 55 HG22 THR 55 25.174 -6.026 -4.835 457 HG23 THR 55 HG23 THR 55 25.196 -7.585 -3.975 458 HA PRO 56 HA PRO 56 18.290 -5.020 -3.862 459 HB2 PRO 56 HB2 PRO 56 17.130 -5.678 -6.434 460 HB3 PRO 56 HB3 PRO 56 17.241 -4.093 -5.644 461 HG2 PRO 56 HG2 PRO 56 18.660 -4.876 -7.963 462 HG3 PRO 56 HG3 PRO 56 18.989 -3.454 -6.938 463 HD2 PRO 56 HD2 PRO 56 20.377 -6.095 -7.002 464 HD3 PRO 56 HD3 PRO 56 20.997 -4.480 -6.578 465 HA PRO 57 HA PRO 57 18.087 -9.604 -3.695 466 HB2 PRO 57 HB2 PRO 57 16.935 -9.991 -1.276 467 HB3 PRO 57 HB3 PRO 57 18.606 -9.374 -1.436 468 HG2 PRO 57 HG2 PRO 57 16.071 -7.761 -0.992 469 HG3 PRO 57 HG3 PRO 57 17.617 -7.668 -0.093 470 HD2 PRO 57 HD2 PRO 57 16.973 -5.984 -2.176 471 HD3 PRO 57 HD3 PRO 57 18.642 -6.482 -1.803 472 H PHE 58 H PHE 58 15.242 -7.487 -3.322 473 HA PHE 58 HA PHE 58 13.405 -9.755 -3.978 474 HB2 PHE 58 HB2 PHE 58 11.599 -8.273 -3.230 475 HB3 PHE 58 HB3 PHE 58 12.771 -8.583 -1.964 476 HD1 PHE 58 HD1 PHE 58 13.892 -6.759 -0.853 477 HD2 PHE 58 HD2 PHE 58 11.735 -6.024 -4.527 478 HE1 PHE 58 HE1 PHE 58 14.348 -4.348 -0.646 479 HE2 PHE 58 HE2 PHE 58 12.287 -3.636 -4.357 480 HZ PHE 58 HZ PHE 58 13.561 -2.767 -2.410 481 H SER 59 H SER 59 11.729 -9.370 -5.561 482 HA SER 59 HA SER 59 12.678 -7.842 -7.897 483 HB2 SER 59 HB2 SER 59 12.016 -10.127 -8.295 484 HB3 SER 59 HB3 SER 59 10.473 -9.897 -7.457 485 HG SER 59 HG SER 59 10.846 -9.690 -9.967 486 H LYS 60 H LYS 60 11.420 -6.329 -8.958 487 HA LYS 60 HA LYS 60 9.890 -4.477 -7.421 488 HB2 LYS 60 HB2 LYS 60 9.458 -3.386 -9.574 489 HB3 LYS 60 HB3 LYS 60 11.154 -3.836 -9.379 490 HG2 LYS 60 HG2 LYS 60 10.699 -5.891 -10.815 491 HG3 LYS 60 HG3 LYS 60 9.090 -5.236 -11.142 492 HD2 LYS 60 HD2 LYS 60 11.712 -3.802 -11.736 493 HD3 LYS 60 HD3 LYS 60 10.830 -4.789 -12.902 494 HE2 LYS 60 HE2 LYS 60 8.863 -3.311 -12.746 495 HE3 LYS 60 HE3 LYS 60 9.690 -2.322 -11.537 496 HZ1 LYS 60 HZ1 LYS 60 10.377 -2.606 -14.376 497 HZ2 LYS 60 HZ2 LYS 60 9.950 -1.252 -13.550 498 HZ3 LYS 60 HZ3 LYS 60 11.438 -1.966 -13.313 499 H LYS 61 H LYS 61 8.882 -7.204 -9.446 500 HA LYS 61 HA LYS 61 6.108 -6.581 -9.556 501 HB2 LYS 61 HB2 LYS 61 7.851 -8.936 -10.032 502 HB3 LYS 61 HB3 LYS 61 6.271 -9.406 -9.446 503 HG2 LYS 61 HG2 LYS 61 6.601 -7.440 -11.728 504 HG3 LYS 61 HG3 LYS 61 6.551 -9.180 -12.010 505 HD2 LYS 61 HD2 LYS 61 4.356 -7.857 -10.409 506 HD3 LYS 61 HD3 LYS 61 4.329 -7.793 -12.173 507 HE2 LYS 61 HE2 LYS 61 4.437 -10.244 -12.282 508 HE3 LYS 61 HE3 LYS 61 4.524 -10.346 -10.519 509 HZ1 LYS 61 HZ1 LYS 61 2.349 -9.411 -10.374 510 HZ2 LYS 61 HZ2 LYS 61 2.261 -9.158 -11.999 511 HZ3 LYS 61 HZ3 LYS 61 2.297 -10.705 -11.403 512 H SER 62 H SER 62 7.983 -8.574 -7.238 513 HA SER 62 HA SER 62 5.896 -9.248 -5.509 514 HB2 SER 62 HB2 SER 62 8.773 -8.788 -4.651 515 HB3 SER 62 HB3 SER 62 7.616 -10.000 -4.079 516 HG SER 62 HG SER 62 7.706 -10.878 -6.273 517 H LEU 63 H LEU 63 8.242 -6.509 -5.400 518 HA LEU 63 HA LEU 63 7.451 -5.308 -3.018 519 HB2 LEU 63 HB2 LEU 63 9.448 -4.722 -4.272 520 HB3 LEU 63 HB3 LEU 63 8.503 -4.040 -5.581 521 HG LEU 63 HG LEU 63 7.810 -2.867 -2.974 522 HD11 LEU 63 HD11 LEU 63 10.221 -3.246 -2.510 523 HD12 LEU 63 HD12 LEU 63 10.615 -2.321 -3.989 524 HD13 LEU 63 HD13 LEU 63 9.817 -1.530 -2.644 525 HD21 LEU 63 HD21 LEU 63 8.050 -0.762 -4.160 526 HD22 LEU 63 HD22 LEU 63 8.898 -1.527 -5.515 527 HD23 LEU 63 HD23 LEU 63 7.190 -1.929 -5.193 528 H ARG 64 H ARG 64 6.165 -4.508 -6.318 529 HA ARG 64 HA ARG 64 4.157 -2.799 -5.315 530 HB2 ARG 64 HB2 ARG 64 4.897 -2.772 -7.611 531 HB3 ARG 64 HB3 ARG 64 4.358 -4.391 -7.893 532 HG2 ARG 64 HG2 ARG 64 2.963 -2.564 -8.879 533 HG3 ARG 64 HG3 ARG 64 2.040 -3.709 -7.900 534 HD2 ARG 64 HD2 ARG 64 1.689 -2.143 -6.165 535 HD3 ARG 64 HD3 ARG 64 3.084 -1.183 -6.625 536 HE ARG 64 HE ARG 64 1.885 -0.407 -8.585 537 HH11 ARG 64 HH11 ARG 64 -0.298 -2.061 -6.258 538 HH12 ARG 64 HH12 ARG 64 -1.681 -1.237 -6.880 539 HH21 ARG 64 HH21 ARG 64 0.122 0.943 -8.984 540 HH22 ARG 64 HH22 ARG 64 -1.440 0.616 -8.312 541 H GLU 65 H GLU 65 3.886 -6.359 -6.072 542 HA GLU 65 HA GLU 65 1.065 -6.402 -5.577 543 HB2 GLU 65 HB2 GLU 65 3.148 -8.404 -6.057 544 HB3 GLU 65 HB3 GLU 65 2.131 -8.900 -4.718 545 HG2 GLU 65 HG2 GLU 65 0.997 -9.790 -6.513 546 HG3 GLU 65 HG3 GLU 65 0.099 -8.303 -6.227 547 H ALA 66 H ALA 66 3.859 -6.742 -3.396 548 HA ALA 66 HA ALA 66 2.326 -7.408 -1.076 549 HB1 ALA 66 HB1 ALA 66 5.096 -6.361 -1.650 550 HB2 ALA 66 HB2 ALA 66 4.478 -6.347 -0.015 551 HB3 ALA 66 HB3 ALA 66 4.615 -7.904 -0.873 552 H LEU 67 H LEU 67 3.381 -4.315 -2.540 553 HA LEU 67 HA LEU 67 2.544 -2.578 -0.469 554 HB2 LEU 67 HB2 LEU 67 3.376 -2.382 -3.187 555 HB3 LEU 67 HB3 LEU 67 2.067 -1.237 -2.924 556 HG LEU 67 HG LEU 67 4.575 -1.467 -1.211 557 HD11 LEU 67 HD11 LEU 67 3.885 0.497 -3.477 558 HD12 LEU 67 HD12 LEU 67 5.335 0.557 -2.439 559 HD13 LEU 67 HD13 LEU 67 5.110 -0.793 -3.547 560 HD21 LEU 67 HD21 LEU 67 2.800 -0.429 0.044 561 HD22 LEU 67 HD22 LEU 67 3.927 0.832 -0.450 562 HD23 LEU 67 HD23 LEU 67 2.389 0.647 -1.309 563 H SER 68 H SER 68 0.808 -3.948 -3.284 564 HA SER 68 HA SER 68 -1.645 -2.626 -2.922 565 HB2 SER 68 HB2 SER 68 -1.044 -5.387 -4.088 566 HB3 SER 68 HB3 SER 68 -2.585 -4.546 -4.256 567 HG SER 68 HG SER 68 -0.811 -4.315 -5.949 568 H TYR 69 H TYR 69 -0.264 -5.370 -1.161 569 HA TYR 69 HA TYR 69 -2.698 -6.312 0.056 570 HB2 TYR 69 HB2 TYR 69 0.050 -6.996 0.099 571 HB3 TYR 69 HB3 TYR 69 -0.344 -6.589 1.765 572 HD1 TYR 69 HD1 TYR 69 -2.268 -7.859 2.883 573 HD2 TYR 69 HD2 TYR 69 -0.649 -8.924 -0.977 574 HE1 TYR 69 HE1 TYR 69 -3.284 -10.123 3.073 575 HE2 TYR 69 HE2 TYR 69 -1.653 -11.165 -0.781 576 HH TYR 69 HH TYR 69 -3.188 -12.423 0.339 577 H TYR 70 H TYR 70 -0.182 -3.940 1.098 578 HA TYR 70 HA TYR 70 -1.617 -3.236 3.503 579 HB2 TYR 70 HB2 TYR 70 0.821 -2.224 2.071 580 HB3 TYR 70 HB3 TYR 70 -0.006 -1.120 3.170 581 HD1 TYR 70 HD1 TYR 70 -0.215 -4.714 4.084 582 HD2 TYR 70 HD2 TYR 70 2.096 -1.068 4.522 583 HE1 TYR 70 HE1 TYR 70 0.766 -5.583 6.100 584 HE2 TYR 70 HE2 TYR 70 3.257 -2.070 6.447 585 HH TYR 70 HH TYR 70 2.161 -5.167 7.891 586 H SER 71 H SER 71 -1.884 -2.116 0.191 587 HA SER 71 HA SER 71 -3.473 0.230 0.897 588 HB2 SER 71 HB2 SER 71 -3.252 -1.337 -1.703 589 HB3 SER 71 HB3 SER 71 -3.939 0.291 -1.506 590 HG SER 71 HG SER 71 -1.996 1.119 -1.277 591 H ALA 72 H ALA 72 -4.067 -3.189 0.801 592 HA ALA 72 HA ALA 72 -7.005 -2.837 0.648 593 HB1 ALA 72 HB1 ALA 72 -5.228 -5.216 -0.018 594 HB2 ALA 72 HB2 ALA 72 -7.003 -5.251 0.039 595 HB3 ALA 72 HB3 ALA 72 -6.203 -4.207 -1.131 596 H SER 73 H SER 73 -4.955 -2.569 3.033 597 HA SER 73 HA SER 73 -5.591 -4.862 4.675 598 HB2 SER 73 HB2 SER 73 -4.582 -3.644 6.495 599 HB3 SER 73 HB3 SER 73 -3.589 -3.422 5.055 600 HG SER 73 HG SER 73 -3.740 -1.451 5.823 601 HA PRO 74 HA PRO 74 -9.735 -3.733 5.611 602 HB2 PRO 74 HB2 PRO 74 -9.886 -4.146 8.383 603 HB3 PRO 74 HB3 PRO 74 -10.107 -5.410 7.112 604 HG2 PRO 74 HG2 PRO 74 -7.711 -4.674 8.776 605 HG3 PRO 74 HG3 PRO 74 -8.252 -6.319 8.299 606 HD2 PRO 74 HD2 PRO 74 -6.181 -5.057 7.067 607 HD3 PRO 74 HD3 PRO 74 -7.320 -6.080 6.132 608 H ALA 75 H ALA 75 -7.245 -2.524 7.876 609 HA ALA 75 HA ALA 75 -8.724 -0.349 8.887 610 HB1 ALA 75 HB1 ALA 75 -6.585 0.389 9.743 611 HB2 ALA 75 HB2 ALA 75 -6.746 -1.376 9.921 612 HB3 ALA 75 HB3 ALA 75 -5.725 -0.699 8.620 613 H TYR 76 H TYR 76 -6.470 -0.508 6.019 614 HA TYR 76 HA TYR 76 -6.579 2.299 5.478 615 HB2 TYR 76 HB2 TYR 76 -4.916 0.766 4.379 616 HB3 TYR 76 HB3 TYR 76 -6.222 -0.072 3.576 617 HD1 TYR 76 HD1 TYR 76 -3.928 2.804 3.413 618 HD2 TYR 76 HD2 TYR 76 -7.611 1.163 1.783 619 HE1 TYR 76 HE1 TYR 76 -3.638 4.159 1.445 620 HE2 TYR 76 HE2 TYR 76 -7.294 2.544 -0.229 621 HH TYR 76 HH TYR 76 -5.947 4.169 -1.318 622 H LEU 77 H LEU 77 -8.669 -0.401 4.340 623 HA LEU 77 HA LEU 77 -10.216 1.416 2.703 624 HB2 LEU 77 HB2 LEU 77 -11.100 -1.275 3.785 625 HB3 LEU 77 HB3 LEU 77 -11.752 -0.370 2.426 626 HG LEU 77 HG LEU 77 -8.858 -1.244 2.350 627 HD11 LEU 77 HD11 LEU 77 -9.546 -3.315 1.296 628 HD12 LEU 77 HD12 LEU 77 -10.213 -3.181 2.938 629 HD13 LEU 77 HD13 LEU 77 -11.259 -2.881 1.530 630 HD21 LEU 77 HD21 LEU 77 -10.960 -0.526 0.278 631 HD22 LEU 77 HD22 LEU 77 -9.522 0.400 0.712 632 HD23 LEU 77 HD23 LEU 77 -9.353 -1.190 -0.088 633 H SER 78 H SER 78 -10.685 0.033 5.922 634 HA SER 78 HA SER 78 -13.218 1.120 6.540 635 HB2 SER 78 HB2 SER 78 -11.918 -0.608 7.819 636 HB3 SER 78 HB3 SER 78 -10.852 0.664 8.413 637 HG SER 78 HG SER 78 -13.161 -0.146 9.445 638 H CYS 79 H CYS 79 -9.969 2.623 6.731 639 HA CYS 79 HA CYS 79 -10.934 5.022 7.995 640 HB2 CYS 79 HB2 CYS 79 -8.783 5.732 8.133 641 HB3 CYS 79 HB3 CYS 79 -8.663 3.968 8.253 642 HG CYS 79 HG CYS 79 -8.162 3.755 5.588 643 H GLN 80 H GLN 80 -11.808 4.168 5.052 644 HA GLN 80 HA GLN 80 -11.357 5.917 3.081 645 HB2 GLN 80 HB2 GLN 80 -13.834 5.827 2.615 646 HB3 GLN 80 HB3 GLN 80 -13.027 4.298 2.828 647 HG2 GLN 80 HG2 GLN 80 -14.319 3.669 4.559 648 HG3 GLN 80 HG3 GLN 80 -14.149 5.214 5.381 649 HE21 GLN 80 HE21 GLN 80 -15.340 7.067 4.128 650 HE22 GLN 80 HE22 GLN 80 -17.038 6.719 3.764 651 H LYS 81 H LYS 81 -10.603 8.027 3.686 652 HA LYS 81 HA LYS 81 -12.729 9.945 4.502 653 HB2 LYS 81 HB2 LYS 81 -9.823 9.835 5.279 654 HB3 LYS 81 HB3 LYS 81 -10.835 11.254 5.529 655 HG2 LYS 81 HG2 LYS 81 -11.739 8.561 6.577 656 HG3 LYS 81 HG3 LYS 81 -10.502 9.469 7.432 657 HD2 LYS 81 HD2 LYS 81 -12.099 10.425 8.540 658 HD3 LYS 81 HD3 LYS 81 -12.597 11.277 7.063 659 HE2 LYS 81 HE2 LYS 81 -14.037 9.230 6.538 660 HE3 LYS 81 HE3 LYS 81 -13.552 8.554 8.094 661 HZ1 LYS 81 HZ1 LYS 81 -15.680 9.629 8.250 662 HZ2 LYS 81 HZ2 LYS 81 -14.600 10.440 9.178 663 HZ3 LYS 81 HZ3 LYS 81 -15.086 11.059 7.716 664 HA PRO 82 HA PRO 82 -11.330 11.444 0.423 665 HB2 PRO 82 HB2 PRO 82 -13.484 13.041 -0.134 666 HB3 PRO 82 HB3 PRO 82 -13.542 11.268 -0.282 667 HG2 PRO 82 HG2 PRO 82 -14.543 12.991 1.994 668 HG3 PRO 82 HG3 PRO 82 -15.358 11.593 1.220 669 HD2 PRO 82 HD2 PRO 82 -13.894 11.445 3.568 670 HD3 PRO 82 HD3 PRO 82 -14.099 10.061 2.457 671 H ASP 83 H ASP 83 -11.168 13.833 -0.325 672 HA ASP 83 HA ASP 83 -9.965 15.775 0.056 673 HB2 ASP 83 HB2 ASP 83 -12.208 16.488 0.030 674 HB3 ASP 83 HB3 ASP 83 -12.377 16.202 1.761 675 H THR 84 H THR 84 -8.355 14.246 1.101 676 HA THR 84 HA THR 84 -7.678 15.327 3.786 677 HB THR 84 HB THR 84 -8.539 13.062 3.950 678 HG1 THR 84 HG1 THR 84 -6.626 13.844 5.208 679 HG21 THR 84 HG21 THR 84 -6.194 12.208 2.195 680 HG22 THR 84 HG22 THR 84 -7.316 11.134 3.057 681 HG23 THR 84 HG23 THR 84 -7.922 12.145 1.742 682 H ALA 85 H ALA 85 -6.611 15.025 0.568 683 HA ALA 85 HA ALA 85 -4.753 15.630 -0.554 684 HB1 ALA 85 HB1 ALA 85 -3.290 17.307 0.341 685 HB2 ALA 85 HB2 ALA 85 -4.990 17.701 0.708 686 HB3 ALA 85 HB3 ALA 85 -3.922 17.071 1.977 687 H ARG 86 H ARG 86 -3.740 13.918 -1.156 688 HA ARG 86 HA ARG 86 -2.093 12.389 0.794 689 HB2 ARG 86 HB2 ARG 86 -2.237 11.888 -2.211 690 HB3 ARG 86 HB3 ARG 86 -1.584 10.846 -0.955 691 HG2 ARG 86 HG2 ARG 86 -3.593 9.815 -1.124 692 HG3 ARG 86 HG3 ARG 86 -4.096 11.085 -0.002 693 HD2 ARG 86 HD2 ARG 86 -5.711 11.316 -1.634 694 HD3 ARG 86 HD3 ARG 86 -4.516 12.444 -2.236 695 HE ARG 86 HE ARG 86 -4.394 9.646 -3.213 696 HH11 ARG 86 HH11 ARG 86 -5.070 13.029 -4.057 697 HH12 ARG 86 HH12 ARG 86 -5.696 12.682 -5.617 698 HH21 ARG 86 HH21 ARG 86 -5.038 9.146 -5.240 699 HH22 ARG 86 HH22 ARG 86 -5.574 10.376 -6.376 700 H VAL 87 H VAL 87 0.224 11.758 -0.238 701 HA VAL 87 HA VAL 87 1.575 14.144 -1.269 702 HB VAL 87 HB VAL 87 3.413 13.561 0.456 703 HG11 VAL 87 HG11 VAL 87 2.243 14.825 2.305 704 HG12 VAL 87 HG12 VAL 87 2.284 15.612 0.727 705 HG13 VAL 87 HG13 VAL 87 0.796 14.846 1.274 706 HG21 VAL 87 HG21 VAL 87 2.496 11.379 1.227 707 HG22 VAL 87 HG22 VAL 87 2.730 12.540 2.550 708 HG23 VAL 87 HG23 VAL 87 1.105 12.230 1.950 709 H ASP 88 H ASP 88 3.689 13.656 -2.113 710 HA ASP 88 HA ASP 88 3.816 11.028 -3.486 711 HB2 ASP 88 HB2 ASP 88 5.899 13.233 -3.618 712 HB3 ASP 88 HB3 ASP 88 5.637 11.914 -4.750 713 H ILE 89 H ILE 89 6.322 10.261 -3.572 714 HA ILE 89 HA ILE 89 7.130 9.337 -1.025 715 HB ILE 89 HB ILE 89 9.265 8.704 -2.251 716 HG12 ILE 89 HG12 ILE 89 7.867 9.665 -4.789 717 HG13 ILE 89 HG13 ILE 89 9.073 10.646 -3.968 718 HG21 ILE 89 HG21 ILE 89 6.718 7.895 -3.680 719 HG22 ILE 89 HG22 ILE 89 8.210 6.956 -3.532 720 HG23 ILE 89 HG23 ILE 89 7.238 7.265 -2.092 721 HD11 ILE 89 HD11 ILE 89 9.610 7.823 -4.977 722 HD12 ILE 89 HD12 ILE 89 10.042 9.331 -5.815 723 HD13 ILE 89 HD13 ILE 89 10.774 8.960 -4.251 724 H TYR 90 H TYR 90 7.829 12.390 -2.570 725 HA TYR 90 HA TYR 90 10.179 12.917 -0.850 726 HB2 TYR 90 HB2 TYR 90 8.744 14.533 -2.976 727 HB3 TYR 90 HB3 TYR 90 10.120 15.114 -2.061 728 HD1 TYR 90 HD1 TYR 90 10.957 11.700 -2.660 729 HD2 TYR 90 HD2 TYR 90 10.571 15.536 -4.642 730 HE1 TYR 90 HE1 TYR 90 12.374 10.902 -4.485 731 HE2 TYR 90 HE2 TYR 90 12.060 14.744 -6.435 732 HH TYR 90 HH TYR 90 12.992 11.330 -6.712 733 H GLY 91 H GLY 91 6.833 12.967 -0.415 734 HA2 GLY 91 HA2 GLY 91 5.674 13.674 1.431 735 HA3 GLY 91 HA3 GLY 91 7.002 14.711 1.925 736 H ASN 92 H ASN 92 6.495 15.461 -1.281 737 HA ASN 92 HA ASN 92 5.276 18.012 -0.704 738 HB2 ASN 92 HB2 ASN 92 5.615 16.534 -3.356 739 HB3 ASN 92 HB3 ASN 92 5.086 18.203 -3.199 740 HD21 ASN 92 HD21 ASN 92 7.831 16.394 -3.893 741 HD22 ASN 92 HD22 ASN 92 9.033 17.444 -3.121 742 H GLU 93 H GLU 93 3.189 18.739 -1.111 743 HA GLU 93 HA GLU 93 1.145 16.783 -0.759 744 HB2 GLU 93 HB2 GLU 93 1.407 19.769 -0.878 745 HB3 GLU 93 HB3 GLU 93 -0.128 19.117 -1.423 746 HG2 GLU 93 HG2 GLU 93 -0.163 17.698 0.710 747 HG3 GLU 93 HG3 GLU 93 1.170 18.712 1.287 748 H VAL 94 H VAL 94 -0.499 16.235 -2.012 749 HA VAL 94 HA VAL 94 -0.500 16.814 -4.854 750 HB VAL 94 HB VAL 94 -0.696 14.696 -5.608 751 HG11 VAL 94 HG11 VAL 94 1.517 14.575 -3.526 752 HG12 VAL 94 HG12 VAL 94 1.415 13.631 -5.006 753 HG13 VAL 94 HG13 VAL 94 1.617 15.386 -5.088 754 HG21 VAL 94 HG21 VAL 94 -0.435 13.235 -3.036 755 HG22 VAL 94 HG22 VAL 94 -2.049 13.748 -3.602 756 HG23 VAL 94 HG23 VAL 94 -1.034 12.699 -4.605 757 H ASP 95 H ASP 95 -2.809 15.562 -5.647 758 HA ASP 95 HA ASP 95 -4.744 17.381 -4.448 759 HB2 ASP 95 HB2 ASP 95 -6.181 16.552 -6.231 760 HB3 ASP 95 HB3 ASP 95 -4.589 16.877 -6.890 761 H VAL 96 H VAL 96 -7.129 16.079 -4.267 762 HA VAL 96 HA VAL 96 -6.618 14.082 -2.113 763 HB VAL 96 HB VAL 96 -8.433 14.918 -0.994 764 HG11 VAL 96 HG11 VAL 96 -7.963 17.191 -0.510 765 HG12 VAL 96 HG12 VAL 96 -6.434 16.562 -1.132 766 HG13 VAL 96 HG13 VAL 96 -7.447 17.536 -2.165 767 HG21 VAL 96 HG21 VAL 96 -10.148 15.193 -2.763 768 HG22 VAL 96 HG22 VAL 96 -10.003 16.699 -1.866 769 HG23 VAL 96 HG23 VAL 96 -9.241 16.567 -3.437 770 H VAL 97 H VAL 97 -8.223 12.516 -1.603 771 HA VAL 97 HA VAL 97 -9.207 11.129 -3.970 772 HB VAL 97 HB VAL 97 -9.880 10.479 -1.062 773 HG11 VAL 97 HG11 VAL 97 -9.613 8.703 -3.528 774 HG12 VAL 97 HG12 VAL 97 -10.156 8.211 -1.909 775 HG13 VAL 97 HG13 VAL 97 -11.142 9.308 -2.871 776 HG21 VAL 97 HG21 VAL 97 -7.531 10.562 -0.964 777 HG22 VAL 97 HG22 VAL 97 -7.931 8.871 -1.150 778 HG23 VAL 97 HG23 VAL 97 -7.344 9.765 -2.563 779 H THR 98 H THR 98 -11.299 11.406 -4.796 780 HA THR 98 HA THR 98 -12.986 13.467 -3.758 781 HB THR 98 HB THR 98 -14.469 12.355 -5.655 782 HG1 THR 98 HG1 THR 98 -12.981 11.231 -7.121 783 HG21 THR 98 HG21 THR 98 -11.735 13.559 -6.294 784 HG22 THR 98 HG22 THR 98 -13.144 13.508 -7.381 785 HG23 THR 98 HG23 THR 98 -13.205 14.474 -5.902 786 HA PRO 99 HA PRO 99 -15.573 11.278 -0.998 787 HB2 PRO 99 HB2 PRO 99 -18.180 11.858 -1.730 788 HB3 PRO 99 HB3 PRO 99 -17.069 12.949 -0.844 789 HG2 PRO 99 HG2 PRO 99 -17.620 12.875 -3.822 790 HG3 PRO 99 HG3 PRO 99 -17.581 14.303 -2.739 791 HD2 PRO 99 HD2 PRO 99 -15.444 13.695 -4.238 792 HD3 PRO 99 HD3 PRO 99 -15.208 14.191 -2.538 793 H GLU 100 H GLU 100 -16.726 10.725 -4.386 794 HA GLU 100 HA GLU 100 -17.949 8.233 -3.665 795 HB2 GLU 100 HB2 GLU 100 -17.177 9.388 -6.358 796 HB3 GLU 100 HB3 GLU 100 -17.954 7.806 -6.142 797 HG2 GLU 100 HG2 GLU 100 -19.761 8.978 -4.773 798 HG3 GLU 100 HG3 GLU 100 -19.077 10.508 -5.309 799 H GLN 101 H GLN 101 -14.691 9.035 -4.991 800 HA GLN 101 HA GLN 101 -14.054 6.242 -5.246 801 HB2 GLN 101 HB2 GLN 101 -12.288 8.704 -5.194 802 HB3 GLN 101 HB3 GLN 101 -11.717 7.024 -5.462 803 HG2 GLN 101 HG2 GLN 101 -13.397 6.850 -7.357 804 HG3 GLN 101 HG3 GLN 101 -13.678 8.584 -7.192 805 HE21 GLN 101 HE21 GLN 101 -13.009 8.282 -9.543 806 HE22 GLN 101 HE22 GLN 101 -11.279 8.516 -9.914 807 H ALA 102 H ALA 102 -13.778 8.537 -2.533 808 HA ALA 102 HA ALA 102 -12.031 6.793 -0.988 809 HB1 ALA 102 HB1 ALA 102 -13.882 9.041 -0.059 810 HB2 ALA 102 HB2 ALA 102 -12.579 8.285 0.880 811 HB3 ALA 102 HB3 ALA 102 -12.184 9.241 -0.558 812 H LYS 103 H LYS 103 -15.580 7.558 -0.898 813 HA LYS 103 HA LYS 103 -16.150 5.678 1.131 814 HB2 LYS 103 HB2 LYS 103 -18.438 6.063 0.720 815 HB3 LYS 103 HB3 LYS 103 -17.635 7.588 0.343 816 HG2 LYS 103 HG2 LYS 103 -17.631 6.865 -2.069 817 HG3 LYS 103 HG3 LYS 103 -18.620 5.503 -1.644 818 HD2 LYS 103 HD2 LYS 103 -19.386 8.424 -1.392 819 HD3 LYS 103 HD3 LYS 103 -19.896 7.285 -2.654 820 HE2 LYS 103 HE2 LYS 103 -21.040 5.890 -0.930 821 HE3 LYS 103 HE3 LYS 103 -20.598 7.080 0.301 822 HZ1 LYS 103 HZ1 LYS 103 -22.810 7.452 -0.452 823 HZ2 LYS 103 HZ2 LYS 103 -21.889 8.723 -0.980 824 HZ3 LYS 103 HZ3 LYS 103 -22.342 7.579 -2.035 825 H TYR 104 H TYR 104 -15.782 5.155 -2.349 826 HA TYR 104 HA TYR 104 -16.963 2.642 -2.738 827 HB2 TYR 104 HB2 TYR 104 -14.889 4.319 -4.014 828 HB3 TYR 104 HB3 TYR 104 -14.465 2.635 -4.088 829 HD1 TYR 104 HD1 TYR 104 -17.803 4.380 -4.424 830 HD2 TYR 104 HD2 TYR 104 -14.760 1.968 -6.291 831 HE1 TYR 104 HE1 TYR 104 -19.287 4.021 -6.368 832 HE2 TYR 104 HE2 TYR 104 -16.247 1.600 -8.240 833 HH TYR 104 HH TYR 104 -19.651 2.717 -8.265 834 H ALA 105 H ALA 105 -13.981 3.446 -0.953 835 HA ALA 105 HA ALA 105 -12.746 0.940 -0.959 836 HB1 ALA 105 HB1 ALA 105 -11.859 3.102 -0.062 837 HB2 ALA 105 HB2 ALA 105 -12.934 2.897 1.327 838 HB3 ALA 105 HB3 ALA 105 -11.636 1.730 1.049 839 H TYR 106 H TYR 106 -15.638 2.009 0.847 840 HA TYR 106 HA TYR 106 -15.656 -0.007 2.799 841 HB2 TYR 106 HB2 TYR 106 -17.692 0.801 3.380 842 HB3 TYR 106 HB3 TYR 106 -17.228 2.145 2.369 843 HD1 TYR 106 HD1 TYR 106 -17.959 1.626 -0.362 844 HD2 TYR 106 HD2 TYR 106 -19.836 -0.040 3.159 845 HE1 TYR 106 HE1 TYR 106 -19.969 1.121 -1.662 846 HE2 TYR 106 HE2 TYR 106 -21.847 -0.546 1.822 847 HH TYR 106 HH TYR 106 -23.010 0.262 -0.356 848 H GLN 107 H GLN 107 -16.770 -0.049 -0.540 849 HA GLN 107 HA GLN 107 -18.122 -2.525 -0.477 850 HB2 GLN 107 HB2 GLN 107 -18.666 -2.126 -2.546 851 HB3 GLN 107 HB3 GLN 107 -18.070 -0.510 -2.147 852 HG2 GLN 107 HG2 GLN 107 -16.008 -0.950 -3.304 853 HG3 GLN 107 HG3 GLN 107 -16.506 -2.555 -3.660 854 HE21 GLN 107 HE21 GLN 107 -17.344 0.904 -4.408 855 HE22 GLN 107 HE22 GLN 107 -18.174 0.469 -5.875 856 H ARG 108 H ARG 108 -14.939 -1.571 -1.386 857 HA ARG 108 HA ARG 108 -13.890 -4.219 -1.910 858 HB2 ARG 108 HB2 ARG 108 -12.116 -2.040 -0.796 859 HB3 ARG 108 HB3 ARG 108 -11.689 -3.324 -1.912 860 HG2 ARG 108 HG2 ARG 108 -13.323 -0.822 -2.460 861 HG3 ARG 108 HG3 ARG 108 -11.719 -1.194 -3.070 862 HD2 ARG 108 HD2 ARG 108 -14.297 -2.641 -3.812 863 HD3 ARG 108 HD3 ARG 108 -13.443 -1.474 -4.827 864 HE ARG 108 HE ARG 108 -11.509 -3.142 -4.731 865 HH11 ARG 108 HH11 ARG 108 -15.011 -4.207 -4.938 866 HH12 ARG 108 HH12 ARG 108 -14.564 -5.767 -5.407 867 HH21 ARG 108 HH21 ARG 108 -11.077 -5.270 -5.378 868 HH22 ARG 108 HH22 ARG 108 -12.361 -6.386 -5.656 869 H TYR 109 H TYR 109 -14.307 -2.511 1.198 870 HA TYR 109 HA TYR 109 -12.712 -4.369 2.747 871 HB2 TYR 109 HB2 TYR 109 -13.295 -2.123 3.489 872 HB3 TYR 109 HB3 TYR 109 -14.983 -2.480 3.564 873 HD1 TYR 109 HD1 TYR 109 -15.840 -4.400 5.133 874 HD2 TYR 109 HD2 TYR 109 -11.996 -2.459 5.507 875 HE1 TYR 109 HE1 TYR 109 -15.648 -5.240 7.424 876 HE2 TYR 109 HE2 TYR 109 -11.835 -3.259 7.822 877 HH TYR 109 HH TYR 109 -12.848 -4.494 9.536 878 H GLN 110 H GLN 110 -16.300 -4.009 2.246 879 HA GLN 110 HA GLN 110 -16.883 -6.393 3.654 880 HB2 GLN 110 HB2 GLN 110 -19.133 -6.261 2.793 881 HB3 GLN 110 HB3 GLN 110 -18.557 -4.675 3.317 882 HG2 GLN 110 HG2 GLN 110 -18.069 -4.096 0.973 883 HG3 GLN 110 HG3 GLN 110 -18.743 -5.634 0.423 884 HE21 GLN 110 HE21 GLN 110 -21.135 -5.997 1.359 885 HE22 GLN 110 HE22 GLN 110 -22.165 -4.550 1.299 886 H GLU 111 H GLU 111 -15.891 -5.919 0.341 887 HA GLU 111 HA GLU 111 -16.752 -8.377 -0.799 888 HB2 GLU 111 HB2 GLU 111 -14.354 -6.575 -1.241 889 HB3 GLU 111 HB3 GLU 111 -14.533 -8.057 -2.172 890 HG2 GLU 111 HG2 GLU 111 -16.931 -6.261 -2.069 891 HG3 GLU 111 HG3 GLU 111 -15.507 -5.611 -2.879 892 H ARG 112 H ARG 112 -14.074 -7.719 1.412 893 HA ARG 112 HA ARG 112 -13.274 -10.597 1.313 894 HB2 ARG 112 HB2 ARG 112 -11.634 -8.154 2.076 895 HB3 ARG 112 HB3 ARG 112 -11.081 -9.826 2.159 896 HG2 ARG 112 HG2 ARG 112 -11.994 -8.423 -0.411 897 HG3 ARG 112 HG3 ARG 112 -10.324 -8.602 0.090 898 HD2 ARG 112 HD2 ARG 112 -10.419 -10.997 -0.075 899 HD3 ARG 112 HD3 ARG 112 -12.157 -10.995 -0.341 900 HE ARG 112 HE ARG 112 -10.067 -10.103 -2.241 901 HH11 ARG 112 HH11 ARG 112 -13.568 -10.802 -1.788 902 HH12 ARG 112 HH12 ARG 112 -13.806 -11.171 -3.464 903 HH21 ARG 112 HH21 ARG 112 -10.436 -10.606 -4.426 904 HH22 ARG 112 HH22 ARG 112 -11.972 -11.250 -4.914 905 H TYR 113 H TYR 113 -13.690 -7.904 3.573 906 HA TYR 113 HA TYR 113 -13.815 -9.759 5.843 907 HB2 TYR 113 HB2 TYR 113 -13.656 -6.744 5.845 908 HB3 TYR 113 HB3 TYR 113 -13.234 -7.845 7.153 909 HD1 TYR 113 HD1 TYR 113 -11.868 -5.726 4.750 910 HD2 TYR 113 HD2 TYR 113 -11.384 -9.733 6.274 911 HE1 TYR 113 HE1 TYR 113 -9.518 -5.774 3.882 912 HE2 TYR 113 HE2 TYR 113 -9.077 -9.798 5.407 913 HH TYR 113 HH TYR 113 -7.232 -8.282 4.634 914 H GLY 114 H GLY 114 -16.093 -9.375 3.920 915 HA2 GLY 114 HA2 GLY 114 -18.221 -8.910 5.877 916 HA3 GLY 114 HA3 GLY 114 -18.242 -7.912 4.411 917 H ASN 115 H ASN 115 -19.860 -8.821 3.211 918 HA ASN 115 HA ASN 115 -20.945 -10.202 1.832 919 HB2 ASN 115 HB2 ASN 115 -18.937 -10.969 0.829 920 HB3 ASN 115 HB3 ASN 115 -18.632 -12.120 2.142 921 HD21 ASN 115 HD21 ASN 115 -19.398 -14.183 1.921 922 HD22 ASN 115 HD22 ASN 115 -20.478 -14.660 0.613 923 H LYS 116 H LYS 116 -22.681 -10.266 3.164 924 HA LYS 116 HA LYS 116 -22.974 -12.605 5.017 925 HB2 LYS 116 HB2 LYS 116 -23.984 -9.734 5.264 926 HB3 LYS 116 HB3 LYS 116 -24.798 -11.069 6.056 927 HG2 LYS 116 HG2 LYS 116 -22.847 -11.585 7.409 928 HG3 LYS 116 HG3 LYS 116 -21.908 -10.311 6.597 929 HD2 LYS 116 HD2 LYS 116 -23.378 -8.586 7.407 930 HD3 LYS 116 HD3 LYS 116 -24.537 -9.749 8.052 931 HE2 LYS 116 HE2 LYS 116 -21.667 -9.629 9.060 932 HE3 LYS 116 HE3 LYS 116 -22.913 -8.543 9.667 933 HZ1 LYS 116 HZ1 LYS 116 -22.935 -11.489 9.954 934 HZ2 LYS 116 HZ2 LYS 116 -22.862 -10.325 11.100 935 HZ3 LYS 116 HZ3 LYS 116 -24.234 -10.490 10.272 936 H LYS 117 H LYS 117 -24.894 -13.703 4.728 937 HA LYS 117 HA LYS 117 -26.818 -14.463 3.825 938 HB2 LYS 117 HB2 LYS 117 -27.516 -12.090 4.499 939 HB3 LYS 117 HB3 LYS 117 -27.350 -11.648 2.797 940 HG2 LYS 117 HG2 LYS 117 -29.156 -13.213 2.184 941 HG3 LYS 117 HG3 LYS 117 -29.273 -13.731 3.891 942 HD2 LYS 117 HD2 LYS 117 -29.648 -11.323 4.518 943 HD3 LYS 117 HD3 LYS 117 -29.685 -10.903 2.797 944 HE2 LYS 117 HE2 LYS 117 -31.714 -12.053 2.433 945 HE3 LYS 117 HE3 LYS 117 -31.551 -13.002 3.932 946 HZ1 LYS 117 HZ1 LYS 117 -33.137 -11.158 4.160 947 HZ2 LYS 117 HZ2 LYS 117 -31.855 -11.025 5.207 948 HZ3 LYS 117 HZ3 LYS 117 -31.920 -10.080 3.862 949 H SER 118 H SER 118 -27.943 -14.885 1.689 950 HA SER 118 HA SER 118 -25.946 -15.347 -0.349 951 HB2 SER 118 HB2 SER 118 -27.995 -16.266 -1.558 952 HB3 SER 118 HB3 SER 118 -27.518 -17.060 -0.049 953 HG SER 118 HG SER 118 -29.817 -16.496 -0.514 954 H GLN 119 H GLN 119 -29.174 -13.684 -0.563 955 HA GLN 119 HA GLN 119 -28.135 -11.258 -1.527 956 HB2 GLN 119 HB2 GLN 119 -28.286 -13.341 -3.517 957 HB3 GLN 119 HB3 GLN 119 -29.638 -12.265 -3.833 958 HG2 GLN 119 HG2 GLN 119 -26.805 -11.237 -3.378 959 HG3 GLN 119 HG3 GLN 119 -27.420 -11.729 -4.954 960 HE21 GLN 119 HE21 GLN 119 -27.658 -9.202 -2.472 961 HE22 GLN 119 HE22 GLN 119 -28.705 -8.148 -3.403 962 H ASP 120 H ASP 120 -30.142 -10.016 -2.669 963 HA ASP 120 HA ASP 120 -32.715 -10.755 -1.506 964 HB2 ASP 120 HB2 ASP 120 -32.593 -8.000 -1.082 965 HB3 ASP 120 HB3 ASP 120 -32.620 -9.266 0.124 966 H LEU 121 H LEU 121 -34.281 -10.365 -2.958 967 HA LEU 121 HA LEU 121 -34.017 -8.478 -5.160 968 HB2 LEU 121 HB2 LEU 121 -34.501 -11.477 -5.592 969 HB3 LEU 121 HB3 LEU 121 -34.838 -10.224 -6.763 970 HG LEU 121 HG LEU 121 -32.239 -9.634 -6.409 971 HD11 LEU 121 HD11 LEU 121 -32.415 -12.658 -6.027 972 HD12 LEU 121 HD12 LEU 121 -30.924 -11.708 -6.276 973 HD13 LEU 121 HD13 LEU 121 -31.854 -11.503 -4.785 974 HD21 LEU 121 HD21 LEU 121 -33.331 -11.848 -8.201 975 HD22 LEU 121 HD22 LEU 121 -33.325 -10.108 -8.561 976 HD23 LEU 121 HD23 LEU 121 -31.797 -10.988 -8.434 977 H LYS 122 H LYS 122 -36.384 -8.914 -6.432 978 HA LYS 122 HA LYS 122 -38.513 -9.358 -4.456 979 HB2 LYS 122 HB2 LYS 122 -38.432 -7.023 -4.335 980 HB3 LYS 122 HB3 LYS 122 -37.895 -6.810 -5.992 981 HG2 LYS 122 HG2 LYS 122 -40.669 -7.936 -5.498 982 HG3 LYS 122 HG3 LYS 122 -40.380 -6.235 -5.220 983 HD2 LYS 122 HD2 LYS 122 -40.405 -5.704 -7.366 984 HD3 LYS 122 HD3 LYS 122 -39.244 -6.933 -7.812 985 HE2 LYS 122 HE2 LYS 122 -42.214 -7.507 -7.423 986 HE3 LYS 122 HE3 LYS 122 -41.485 -7.033 -8.967 987 HZ1 LYS 122 HZ1 LYS 122 -41.525 -9.411 -8.954 988 HZ2 LYS 122 HZ2 LYS 122 -39.944 -9.011 -8.576 989 HZ3 LYS 122 HZ3 LYS 122 -40.874 -9.488 -7.433 Start of MODEL 7 1 H1 GLY 1 H GLY 1 21.906 -4.458 21.836 2 HA2 GLY 1 HA2 GLY 1 19.917 -5.332 20.749 3 HA3 GLY 1 HA3 GLY 1 20.475 -3.856 19.924 4 H SER 2 H SER 2 18.943 -5.490 18.357 5 HA SER 2 HA SER 2 20.893 -6.621 16.453 6 HB2 SER 2 HB2 SER 2 18.376 -8.024 17.458 7 HB3 SER 2 HB3 SER 2 19.351 -8.535 16.075 8 HG SER 2 HG SER 2 20.188 -8.409 18.795 9 H ASN 3 H ASN 3 20.254 -6.187 14.364 10 HA ASN 3 HA ASN 3 17.576 -5.130 13.753 11 HB2 ASN 3 HB2 ASN 3 20.187 -3.650 13.171 12 HB3 ASN 3 HB3 ASN 3 18.658 -3.301 12.389 13 HD21 ASN 3 HD21 ASN 3 20.643 -2.311 14.959 14 HD22 ASN 3 HD22 ASN 3 19.405 -1.393 15.780 15 H GLN 4 H GLN 4 17.168 -5.354 11.436 16 HA GLN 4 HA GLN 4 18.893 -7.418 10.146 17 HB2 GLN 4 HB2 GLN 4 15.939 -6.940 10.339 18 HB3 GLN 4 HB3 GLN 4 16.528 -7.407 8.764 19 HG2 GLN 4 HG2 GLN 4 15.841 -9.366 10.046 20 HG3 GLN 4 HG3 GLN 4 17.532 -9.412 9.576 21 HE21 GLN 4 HE21 GLN 4 15.979 -7.722 12.459 22 HE22 GLN 4 HE22 GLN 4 16.806 -8.723 13.619 23 H GLN 5 H GLN 5 18.963 -7.400 7.869 24 HA GLN 5 HA GLN 5 18.572 -4.909 6.365 25 HB2 GLN 5 HB2 GLN 5 20.935 -4.992 5.498 26 HB3 GLN 5 HB3 GLN 5 20.732 -4.356 7.117 27 HG2 GLN 5 HG2 GLN 5 21.428 -7.293 6.828 28 HG3 GLN 5 HG3 GLN 5 22.658 -6.087 6.491 29 HE21 GLN 5 HE21 GLN 5 21.035 -7.755 9.085 30 HE22 GLN 5 HE22 GLN 5 21.708 -6.781 10.384 31 H LEU 6 H LEU 6 19.162 -8.377 6.548 32 HA LEU 6 HA LEU 6 19.306 -8.814 3.669 33 HB2 LEU 6 HB2 LEU 6 19.074 -10.598 6.124 34 HB3 LEU 6 HB3 LEU 6 18.623 -11.223 4.547 35 HG LEU 6 HG LEU 6 20.834 -10.758 3.627 36 HD11 LEU 6 HD11 LEU 6 21.574 -8.887 5.081 37 HD12 LEU 6 HD12 LEU 6 21.738 -10.034 6.438 38 HD13 LEU 6 HD13 LEU 6 22.745 -10.198 5.001 39 HD21 LEU 6 HD21 LEU 6 22.020 -12.552 4.830 40 HD22 LEU 6 HD22 LEU 6 20.873 -12.418 6.185 41 HD23 LEU 6 HD23 LEU 6 20.314 -12.957 4.588 42 H ASN 7 H ASN 7 16.886 -10.029 6.000 43 HA ASN 7 HA ASN 7 14.703 -9.317 4.105 44 HB2 ASN 7 HB2 ASN 7 13.471 -11.246 5.083 45 HB3 ASN 7 HB3 ASN 7 14.949 -11.723 4.278 46 HD21 ASN 7 HD21 ASN 7 15.053 -10.361 7.670 47 HD22 ASN 7 HD22 ASN 7 15.634 -11.874 8.289 48 H ALA 8 H ALA 8 12.601 -8.983 5.173 49 HA ALA 8 HA ALA 8 12.818 -7.077 7.353 50 HB1 ALA 8 HB1 ALA 8 11.237 -6.738 5.511 51 HB2 ALA 8 HB2 ALA 8 10.377 -8.241 5.911 52 HB3 ALA 8 HB3 ALA 8 10.367 -6.880 7.049 53 H THR 9 H THR 9 10.652 -9.920 7.051 54 HA THR 9 HA THR 9 11.361 -10.778 9.811 55 HB THR 9 HB THR 9 8.932 -11.248 10.169 56 HG1 THR 9 HG1 THR 9 8.238 -9.346 8.245 57 HG21 THR 9 HG21 THR 9 10.009 -9.252 11.173 58 HG22 THR 9 HG22 THR 9 9.565 -8.290 9.756 59 HG23 THR 9 HG23 THR 9 8.302 -8.976 10.803 60 H LYS 10 H LYS 10 8.867 -12.088 7.742 61 HA LYS 10 HA LYS 10 10.582 -14.244 6.686 62 HB2 LYS 10 HB2 LYS 10 10.023 -14.971 8.991 63 HB3 LYS 10 HB3 LYS 10 8.294 -14.858 8.617 64 HG2 LYS 10 HG2 LYS 10 8.508 -16.627 6.933 65 HG3 LYS 10 HG3 LYS 10 10.276 -16.637 7.131 66 HD2 LYS 10 HD2 LYS 10 9.969 -17.350 9.494 67 HD3 LYS 10 HD3 LYS 10 8.211 -17.320 9.240 68 HE2 LYS 10 HE2 LYS 10 8.546 -19.002 7.367 69 HE3 LYS 10 HE3 LYS 10 10.235 -19.141 7.885 70 HZ1 LYS 10 HZ1 LYS 10 7.894 -19.672 9.633 71 HZ2 LYS 10 HZ2 LYS 10 8.812 -20.833 8.888 72 HZ3 LYS 10 HZ3 LYS 10 9.465 -19.849 10.032 73 H LYS 11 H LYS 11 7.358 -12.687 6.838 74 HA LYS 11 HA LYS 11 6.237 -14.318 4.660 75 HB2 LYS 11 HB2 LYS 11 5.498 -11.638 5.858 76 HB3 LYS 11 HB3 LYS 11 4.522 -12.429 4.621 77 HG2 LYS 11 HG2 LYS 11 5.097 -14.004 7.134 78 HG3 LYS 11 HG3 LYS 11 4.044 -12.607 7.291 79 HD2 LYS 11 HD2 LYS 11 2.746 -14.624 6.965 80 HD3 LYS 11 HD3 LYS 11 2.486 -13.492 5.627 81 HE2 LYS 11 HE2 LYS 11 3.927 -14.758 4.165 82 HE3 LYS 11 HE3 LYS 11 4.503 -15.770 5.499 83 HZ1 LYS 11 HZ1 LYS 11 2.849 -16.906 4.145 84 HZ2 LYS 11 HZ2 LYS 11 2.294 -16.729 5.669 85 HZ3 LYS 11 HZ3 LYS 11 1.727 -15.762 4.456 86 H ASP 12 H ASP 12 6.804 -14.235 2.615 87 HA ASP 12 HA ASP 12 8.778 -12.502 1.594 88 HB2 ASP 12 HB2 ASP 12 6.666 -14.320 0.384 89 HB3 ASP 12 HB3 ASP 12 7.684 -13.340 -0.631 90 H LYS 13 H LYS 13 5.261 -12.351 1.501 91 HA LYS 13 HA LYS 13 4.995 -10.181 -0.341 92 HB2 LYS 13 HB2 LYS 13 3.193 -11.132 1.948 93 HB3 LYS 13 HB3 LYS 13 2.691 -9.982 0.709 94 HG2 LYS 13 HG2 LYS 13 3.722 -12.776 0.031 95 HG3 LYS 13 HG3 LYS 13 2.026 -12.469 0.408 96 HD2 LYS 13 HD2 LYS 13 1.766 -10.905 -1.422 97 HD3 LYS 13 HD3 LYS 13 3.482 -10.950 -1.804 98 HE2 LYS 13 HE2 LYS 13 1.566 -13.313 -2.042 99 HE3 LYS 13 HE3 LYS 13 2.095 -12.264 -3.369 100 HZ1 LYS 13 HZ1 LYS 13 3.760 -14.125 -1.810 101 HZ2 LYS 13 HZ2 LYS 13 3.464 -14.142 -3.418 102 HZ3 LYS 13 HZ3 LYS 13 4.414 -12.955 -2.762 103 H LEU 14 H LEU 14 5.041 -10.242 3.252 104 HA LEU 14 HA LEU 14 4.862 -7.414 3.522 105 HB2 LEU 14 HB2 LEU 14 6.099 -9.391 5.473 106 HB3 LEU 14 HB3 LEU 14 5.448 -7.801 5.845 107 HG LEU 14 HG LEU 14 3.827 -10.203 4.899 108 HD11 LEU 14 HD11 LEU 14 3.744 -8.730 7.550 109 HD12 LEU 14 HD12 LEU 14 2.871 -10.217 7.105 110 HD13 LEU 14 HD13 LEU 14 4.635 -10.232 7.294 111 HD21 LEU 14 HD21 LEU 14 2.787 -8.192 3.993 112 HD22 LEU 14 HD22 LEU 14 1.843 -8.760 5.373 113 HD23 LEU 14 HD23 LEU 14 2.962 -7.392 5.568 114 H GLN 15 H GLN 15 7.624 -9.532 2.950 115 HA GLN 15 HA GLN 15 9.657 -7.723 3.730 116 HB2 GLN 15 HB2 GLN 15 9.834 -10.206 3.368 117 HB3 GLN 15 HB3 GLN 15 9.828 -9.918 1.624 118 HG2 GLN 15 HG2 GLN 15 11.880 -8.534 1.867 119 HG3 GLN 15 HG3 GLN 15 11.864 -8.818 3.598 120 HE21 GLN 15 HE21 GLN 15 13.942 -9.662 1.437 121 HE22 GLN 15 HE22 GLN 15 14.081 -11.376 1.729 122 H VAL 16 H VAL 16 8.243 -8.280 0.389 123 HA VAL 16 HA VAL 16 9.994 -6.328 -0.744 124 HB VAL 16 HB VAL 16 8.608 -6.238 -2.698 125 HG11 VAL 16 HG11 VAL 16 10.054 -8.209 -2.440 126 HG12 VAL 16 HG12 VAL 16 8.706 -9.110 -1.697 127 HG13 VAL 16 HG13 VAL 16 8.600 -8.564 -3.393 128 HG21 VAL 16 HG21 VAL 16 6.515 -7.852 -1.211 129 HG22 VAL 16 HG22 VAL 16 6.359 -6.167 -1.785 130 HG23 VAL 16 HG23 VAL 16 6.504 -7.492 -2.942 131 H ILE 17 H ILE 17 6.925 -5.945 0.975 132 HA ILE 17 HA ILE 17 6.621 -3.196 0.177 133 HB ILE 17 HB ILE 17 5.364 -4.315 2.677 134 HG12 ILE 17 HG12 ILE 17 4.081 -4.497 -0.089 135 HG13 ILE 17 HG13 ILE 17 4.896 -5.844 0.669 136 HG21 ILE 17 HG21 ILE 17 5.213 -1.916 2.271 137 HG22 ILE 17 HG22 ILE 17 4.611 -2.180 0.626 138 HG23 ILE 17 HG23 ILE 17 3.617 -2.626 2.015 139 HD11 ILE 17 HD11 ILE 17 3.351 -5.490 2.711 140 HD12 ILE 17 HD12 ILE 17 2.361 -4.503 1.605 141 HD13 ILE 17 HD13 ILE 17 2.667 -6.213 1.257 142 H ASP 18 H ASP 18 8.083 -4.831 2.965 143 HA ASP 18 HA ASP 18 8.674 -2.440 4.461 144 HB2 ASP 18 HB2 ASP 18 8.886 -4.991 5.138 145 HB3 ASP 18 HB3 ASP 18 10.534 -4.816 4.529 146 H TRP 19 H TRP 19 10.372 -4.135 1.828 147 HA TRP 19 HA TRP 19 12.766 -2.596 1.840 148 HB2 TRP 19 HB2 TRP 19 12.715 -4.672 0.649 149 HB3 TRP 19 HB3 TRP 19 11.327 -4.197 -0.306 150 HD1 TRP 19 HD1 TRP 19 11.713 -2.436 -2.308 151 HE1 TRP 19 HE1 TRP 19 13.841 -1.689 -3.604 152 HE3 TRP 19 HE3 TRP 19 15.346 -4.448 0.704 153 HZ2 TRP 19 HZ2 TRP 19 16.605 -2.033 -3.461 154 HZ3 TRP 19 HZ3 TRP 19 17.728 -4.202 0.095 155 HH2 TRP 19 HH2 TRP 19 18.378 -2.938 -1.972 156 H LEU 20 H LEU 20 9.796 -2.195 -0.210 157 HA LEU 20 HA LEU 20 10.811 0.188 -1.439 158 HB2 LEU 20 HB2 LEU 20 8.563 0.633 -2.223 159 HB3 LEU 20 HB3 LEU 20 9.103 -1.008 -2.558 160 HG LEU 20 HG LEU 20 7.743 -1.398 -0.266 161 HD11 LEU 20 HD11 LEU 20 5.674 -0.157 -0.166 162 HD12 LEU 20 HD12 LEU 20 6.999 1.006 -0.119 163 HD13 LEU 20 HD13 LEU 20 6.101 0.766 -1.619 164 HD21 LEU 20 HD21 LEU 20 7.404 -2.728 -2.172 165 HD22 LEU 20 HD22 LEU 20 5.822 -2.153 -1.630 166 HD23 LEU 20 HD23 LEU 20 6.597 -1.410 -3.046 167 H ILE 21 H ILE 21 8.995 -0.286 1.565 168 HA ILE 21 HA ILE 21 8.379 2.463 2.056 169 HB ILE 21 HB ILE 21 8.693 -0.057 3.720 170 HG12 ILE 21 HG12 ILE 21 6.244 1.700 3.290 171 HG13 ILE 21 HG13 ILE 21 6.646 0.344 2.266 172 HG21 ILE 21 HG21 ILE 21 7.920 1.113 5.732 173 HG22 ILE 21 HG22 ILE 21 9.496 1.682 5.196 174 HG23 ILE 21 HG23 ILE 21 8.070 2.664 4.907 175 HD11 ILE 21 HD11 ILE 21 6.008 0.232 5.234 176 HD12 ILE 21 HD12 ILE 21 4.994 -0.322 3.909 177 HD13 ILE 21 HD13 ILE 21 6.518 -1.168 4.268 178 H GLU 22 H GLU 22 11.142 0.361 2.949 179 HA GLU 22 HA GLU 22 12.568 2.266 4.458 180 HB2 GLU 22 HB2 GLU 22 12.787 -0.160 4.596 181 HB3 GLU 22 HB3 GLU 22 13.456 -0.233 2.963 182 HG2 GLU 22 HG2 GLU 22 15.462 0.976 3.704 183 HG3 GLU 22 HG3 GLU 22 14.747 1.195 5.315 184 H ASN 23 H ASN 23 12.618 1.487 1.017 185 HA ASN 23 HA ASN 23 14.972 2.956 0.292 186 HB2 ASN 23 HB2 ASN 23 12.602 1.812 -1.187 187 HB3 ASN 23 HB3 ASN 23 13.648 2.950 -2.010 188 HD21 ASN 23 HD21 ASN 23 14.026 -0.008 0.037 189 HD22 ASN 23 HD22 ASN 23 15.370 -0.634 -0.888 190 H PHE 24 H PHE 24 11.522 3.938 0.497 191 HA PHE 24 HA PHE 24 12.398 6.737 -0.060 192 HB2 PHE 24 HB2 PHE 24 9.866 5.369 -0.943 193 HB3 PHE 24 HB3 PHE 24 10.045 7.116 -0.871 194 HD1 PHE 24 HD1 PHE 24 12.806 7.621 -1.883 195 HD2 PHE 24 HD2 PHE 24 9.794 4.855 -3.270 196 HE1 PHE 24 HE1 PHE 24 13.796 7.651 -4.119 197 HE2 PHE 24 HE2 PHE 24 10.764 4.997 -5.557 198 HZ PHE 24 HZ PHE 24 12.725 6.417 -5.998 199 HA PRO 25 HA PRO 25 10.881 6.529 4.211 200 HB2 PRO 25 HB2 PRO 25 12.904 7.844 5.464 201 HB3 PRO 25 HB3 PRO 25 13.048 6.138 4.943 202 HG2 PRO 25 HG2 PRO 25 13.969 8.611 3.438 203 HG3 PRO 25 HG3 PRO 25 14.935 7.150 3.856 204 HD2 PRO 25 HD2 PRO 25 13.713 7.415 1.440 205 HD3 PRO 25 HD3 PRO 25 13.792 5.838 2.274 206 H ASN 26 H ASN 26 10.764 8.837 1.824 207 HA ASN 26 HA ASN 26 10.609 11.187 3.513 208 HB2 ASN 26 HB2 ASN 26 9.490 12.258 1.464 209 HB3 ASN 26 HB3 ASN 26 11.190 11.827 1.408 210 HD21 ASN 26 HD21 ASN 26 11.864 10.104 0.228 211 HD22 ASN 26 HD22 ASN 26 10.847 9.546 -1.139 212 H ALA 27 H ALA 27 8.436 8.602 2.551 213 HA ALA 27 HA ALA 27 6.361 9.400 4.389 214 HB1 ALA 27 HB1 ALA 27 6.030 9.743 1.351 215 HB2 ALA 27 HB2 ALA 27 4.668 9.676 2.515 216 HB3 ALA 27 HB3 ALA 27 5.859 11.003 2.582 217 H PHE 28 H PHE 28 5.949 7.337 5.055 218 HA PHE 28 HA PHE 28 4.530 5.483 3.562 219 HB2 PHE 28 HB2 PHE 28 7.474 5.093 3.393 220 HB3 PHE 28 HB3 PHE 28 6.564 3.704 3.940 221 HD1 PHE 28 HD1 PHE 28 4.295 3.233 2.510 222 HD2 PHE 28 HD2 PHE 28 7.859 5.206 1.052 223 HE1 PHE 28 HE1 PHE 28 3.691 2.605 0.190 224 HE2 PHE 28 HE2 PHE 28 7.256 4.546 -1.256 225 HZ PHE 28 HZ PHE 28 5.146 3.283 -1.698 226 H PHE 29 H PHE 29 4.389 3.311 5.016 227 HA PHE 29 HA PHE 29 5.186 3.680 7.808 228 HB2 PHE 29 HB2 PHE 29 2.265 3.587 7.022 229 HB3 PHE 29 HB3 PHE 29 2.910 3.344 8.641 230 HD1 PHE 29 HD1 PHE 29 2.222 5.834 6.049 231 HD2 PHE 29 HD2 PHE 29 3.823 5.226 9.984 232 HE1 PHE 29 HE1 PHE 29 2.051 8.278 6.490 233 HE2 PHE 29 HE2 PHE 29 3.487 7.617 10.496 234 HZ PHE 29 HZ PHE 29 2.581 9.151 8.760 235 H LYS 30 H LYS 30 5.469 1.630 8.732 236 HA LYS 30 HA LYS 30 5.015 -0.706 6.974 237 HB2 LYS 30 HB2 LYS 30 6.293 -0.555 9.740 238 HB3 LYS 30 HB3 LYS 30 6.109 -2.002 8.777 239 HG2 LYS 30 HG2 LYS 30 8.250 -1.539 8.343 240 HG3 LYS 30 HG3 LYS 30 7.499 -0.782 6.946 241 HD2 LYS 30 HD2 LYS 30 7.740 1.448 8.013 242 HD3 LYS 30 HD3 LYS 30 8.273 0.719 9.499 243 HE2 LYS 30 HE2 LYS 30 9.805 1.033 6.921 244 HE3 LYS 30 HE3 LYS 30 10.233 1.557 8.534 245 HZ1 LYS 30 HZ1 LYS 30 10.386 -1.186 7.424 246 HZ2 LYS 30 HZ2 LYS 30 11.585 -0.248 7.967 247 HZ3 LYS 30 HZ3 LYS 30 10.525 -0.881 9.040 248 H LYS 31 H LYS 31 3.773 0.424 10.123 249 HA LYS 31 HA LYS 31 2.257 -2.009 10.572 250 HB2 LYS 31 HB2 LYS 31 3.161 0.122 12.200 251 HB3 LYS 31 HB3 LYS 31 1.487 0.486 12.026 252 HG2 LYS 31 HG2 LYS 31 1.199 -0.874 13.785 253 HG3 LYS 31 HG3 LYS 31 1.273 -2.180 12.618 254 HD2 LYS 31 HD2 LYS 31 3.497 -1.147 14.422 255 HD3 LYS 31 HD3 LYS 31 2.599 -2.655 14.592 256 HE2 LYS 31 HE2 LYS 31 3.565 -3.404 12.371 257 HE3 LYS 31 HE3 LYS 31 4.598 -1.965 12.398 258 HZ1 LYS 31 HZ1 LYS 31 5.536 -2.792 14.494 259 HZ2 LYS 31 HZ2 LYS 31 4.592 -4.140 14.421 260 HZ3 LYS 31 HZ3 LYS 31 5.740 -3.890 13.302 261 H GLY 32 H GLY 32 -0.264 -1.067 11.400 262 HA2 GLY 32 HA2 GLY 32 -1.535 -0.135 8.837 263 HA3 GLY 32 HA3 GLY 32 -2.276 -1.176 10.052 264 H ASN 33 H ASN 33 -1.800 0.203 12.410 265 HA ASN 33 HA ASN 33 -3.787 2.141 12.480 266 HB2 ASN 33 HB2 ASN 33 -3.113 2.694 14.685 267 HB3 ASN 33 HB3 ASN 33 -2.787 0.989 14.491 268 HD21 ASN 33 HD21 ASN 33 -0.283 0.886 13.316 269 HD22 ASN 33 HD22 ASN 33 0.900 1.747 14.289 270 H GLN 34 H GLN 34 -0.291 2.824 11.867 271 HA GLN 34 HA GLN 34 -0.909 5.716 11.938 272 HB2 GLN 34 HB2 GLN 34 1.545 5.983 11.946 273 HB3 GLN 34 HB3 GLN 34 0.856 5.058 13.285 274 HG2 GLN 34 HG2 GLN 34 1.591 2.937 12.188 275 HG3 GLN 34 HG3 GLN 34 2.408 3.909 10.970 276 HE21 GLN 34 HE21 GLN 34 2.486 4.914 14.430 277 HE22 GLN 34 HE22 GLN 34 4.065 4.270 14.755 278 H VAL 35 H VAL 35 -1.220 3.328 9.703 279 HA VAL 35 HA VAL 35 0.093 4.558 7.444 280 HB VAL 35 HB VAL 35 -0.799 2.121 7.901 281 HG11 VAL 35 HG11 VAL 35 -2.825 1.415 7.088 282 HG12 VAL 35 HG12 VAL 35 -3.292 2.924 7.883 283 HG13 VAL 35 HG13 VAL 35 -3.110 2.910 6.136 284 HG21 VAL 35 HG21 VAL 35 -0.836 3.335 5.142 285 HG22 VAL 35 HG22 VAL 35 0.546 2.616 6.002 286 HG23 VAL 35 HG23 VAL 35 -0.796 1.589 5.518 287 H LYS 36 H LYS 36 -0.868 5.711 5.591 288 HA LYS 36 HA LYS 36 -3.563 6.725 5.768 289 HB2 LYS 36 HB2 LYS 36 -3.142 9.019 5.821 290 HB3 LYS 36 HB3 LYS 36 -2.202 8.334 7.103 291 HG2 LYS 36 HG2 LYS 36 -0.148 8.593 5.851 292 HG3 LYS 36 HG3 LYS 36 -1.027 9.205 4.443 293 HD2 LYS 36 HD2 LYS 36 -1.239 10.579 7.162 294 HD3 LYS 36 HD3 LYS 36 0.104 10.901 6.073 295 HE2 LYS 36 HE2 LYS 36 -1.494 11.549 4.279 296 HE3 LYS 36 HE3 LYS 36 -2.843 11.352 5.412 297 HZ1 LYS 36 HZ1 LYS 36 -1.989 13.207 6.692 298 HZ2 LYS 36 HZ2 LYS 36 -0.619 13.298 5.759 299 HZ3 LYS 36 HZ3 LYS 36 -2.086 13.661 5.163 300 HA PRO 37 HA PRO 37 -3.050 6.012 1.492 301 HB2 PRO 37 HB2 PRO 37 -4.419 7.942 0.118 302 HB3 PRO 37 HB3 PRO 37 -5.194 6.675 1.121 303 HG2 PRO 37 HG2 PRO 37 -4.535 9.525 1.924 304 HG3 PRO 37 HG3 PRO 37 -6.093 8.661 2.120 305 HD2 PRO 37 HD2 PRO 37 -4.312 8.842 4.131 306 HD3 PRO 37 HD3 PRO 37 -5.246 7.335 3.883 307 H LEU 38 H LEU 38 -1.778 6.295 -0.227 308 HA LEU 38 HA LEU 38 0.215 8.488 -0.260 309 HB2 LEU 38 HB2 LEU 38 0.129 5.643 -1.384 310 HB3 LEU 38 HB3 LEU 38 1.237 6.845 -1.983 311 HG LEU 38 HG LEU 38 2.494 5.562 -0.576 312 HD11 LEU 38 HD11 LEU 38 1.842 7.952 1.197 313 HD12 LEU 38 HD12 LEU 38 3.365 7.052 1.082 314 HD13 LEU 38 HD13 LEU 38 2.839 8.036 -0.276 315 HD21 LEU 38 HD21 LEU 38 2.016 5.074 1.747 316 HD22 LEU 38 HD22 LEU 38 0.384 5.770 1.562 317 HD23 LEU 38 HD23 LEU 38 0.884 4.341 0.617 318 H LYS 39 H LYS 39 0.952 9.023 -2.609 319 HA LYS 39 HA LYS 39 -1.223 10.182 -3.947 320 HB2 LYS 39 HB2 LYS 39 1.221 10.854 -4.074 321 HB3 LYS 39 HB3 LYS 39 1.473 9.523 -5.189 322 HG2 LYS 39 HG2 LYS 39 -0.820 11.149 -6.040 323 HG3 LYS 39 HG3 LYS 39 0.501 12.193 -5.680 324 HD2 LYS 39 HD2 LYS 39 1.116 9.844 -7.418 325 HD3 LYS 39 HD3 LYS 39 0.169 11.179 -8.103 326 HE2 LYS 39 HE2 LYS 39 1.971 12.752 -7.248 327 HE3 LYS 39 HE3 LYS 39 2.919 11.321 -6.834 328 HZ1 LYS 39 HZ1 LYS 39 3.542 12.201 -8.909 329 HZ2 LYS 39 HZ2 LYS 39 2.866 10.717 -9.189 330 HZ3 LYS 39 HZ3 LYS 39 2.036 12.105 -9.541 331 H ILE 40 H ILE 40 -1.891 9.740 -6.260 332 HA ILE 40 HA ILE 40 -2.895 7.084 -6.619 333 HB ILE 40 HB ILE 40 -4.078 9.036 -7.212 334 HG12 ILE 40 HG12 ILE 40 -3.536 7.843 -9.920 335 HG13 ILE 40 HG13 ILE 40 -4.017 6.747 -8.619 336 HG21 ILE 40 HG21 ILE 40 -2.279 10.619 -7.868 337 HG22 ILE 40 HG22 ILE 40 -1.995 9.679 -9.336 338 HG23 ILE 40 HG23 ILE 40 -3.539 10.503 -9.088 339 HD11 ILE 40 HD11 ILE 40 -5.556 9.246 -9.373 340 HD12 ILE 40 HD12 ILE 40 -5.979 7.575 -9.833 341 HD13 ILE 40 HD13 ILE 40 -5.956 8.047 -8.116 342 H GLY 41 H GLY 41 -2.075 5.468 -8.053 343 HA2 GLY 41 HA2 GLY 41 -0.525 4.329 -9.286 344 HA3 GLY 41 HA3 GLY 41 -0.210 5.868 -10.084 345 H ILE 42 H ILE 42 0.521 5.823 -6.659 346 HA ILE 42 HA ILE 42 3.130 6.581 -7.026 347 HB ILE 42 HB ILE 42 1.824 6.863 -4.973 348 HG12 ILE 42 HG12 ILE 42 4.468 5.498 -4.373 349 HG13 ILE 42 HG13 ILE 42 4.339 7.064 -5.173 350 HG21 ILE 42 HG21 ILE 42 0.850 4.588 -4.751 351 HG22 ILE 42 HG22 ILE 42 2.464 3.932 -4.392 352 HG23 ILE 42 HG23 ILE 42 1.699 5.059 -3.277 353 HD11 ILE 42 HD11 ILE 42 4.733 7.509 -2.862 354 HD12 ILE 42 HD12 ILE 42 3.042 7.923 -3.181 355 HD13 ILE 42 HD13 ILE 42 3.472 6.391 -2.365 356 H PHE 43 H PHE 43 1.927 3.207 -7.071 357 HA PHE 43 HA PHE 43 4.488 2.002 -6.649 358 HB2 PHE 43 HB2 PHE 43 2.937 0.337 -6.576 359 HB3 PHE 43 HB3 PHE 43 1.870 1.116 -7.734 360 HD1 PHE 43 HD1 PHE 43 1.878 0.593 -10.028 361 HD2 PHE 43 HD2 PHE 43 5.060 -0.947 -7.541 362 HE1 PHE 43 HE1 PHE 43 2.731 -0.773 -11.921 363 HE2 PHE 43 HE2 PHE 43 5.873 -2.298 -9.408 364 HZ PHE 43 HZ PHE 43 4.764 -2.156 -11.640 365 H ASP 44 H ASP 44 2.888 3.321 -9.574 366 HA ASP 44 HA ASP 44 4.740 2.306 -11.445 367 HB2 ASP 44 HB2 ASP 44 2.325 3.482 -11.597 368 HB3 ASP 44 HB3 ASP 44 3.316 4.907 -11.919 369 H ASP 45 H ASP 45 4.959 4.977 -9.250 370 HA ASP 45 HA ASP 45 7.117 6.385 -10.666 371 HB2 ASP 45 HB2 ASP 45 5.855 6.759 -7.914 372 HB3 ASP 45 HB3 ASP 45 7.021 7.824 -8.696 373 H LEU 46 H LEU 46 6.530 4.550 -7.796 374 HA LEU 46 HA LEU 46 9.044 4.370 -6.576 375 HB2 LEU 46 HB2 LEU 46 7.057 4.053 -5.321 376 HB3 LEU 46 HB3 LEU 46 6.415 2.924 -6.510 377 HG LEU 46 HG LEU 46 7.929 1.189 -5.858 378 HD11 LEU 46 HD11 LEU 46 8.711 2.831 -3.426 379 HD12 LEU 46 HD12 LEU 46 9.408 1.311 -4.066 380 HD13 LEU 46 HD13 LEU 46 9.710 2.837 -4.898 381 HD21 LEU 46 HD21 LEU 46 6.842 0.660 -3.781 382 HD22 LEU 46 HD22 LEU 46 6.299 2.347 -3.599 383 HD23 LEU 46 HD23 LEU 46 5.710 1.339 -4.944 384 H ILE 47 H ILE 47 7.460 2.278 -8.891 385 HA ILE 47 HA ILE 47 9.061 -0.048 -8.731 386 HB ILE 47 HB ILE 47 6.909 0.330 -9.958 387 HG12 ILE 47 HG12 ILE 47 8.113 -1.769 -10.187 388 HG13 ILE 47 HG13 ILE 47 7.039 -1.325 -11.501 389 HG21 ILE 47 HG21 ILE 47 8.616 1.421 -12.240 390 HG22 ILE 47 HG22 ILE 47 6.830 1.234 -12.174 391 HG23 ILE 47 HG23 ILE 47 7.671 2.377 -11.138 392 HD11 ILE 47 HD11 ILE 47 9.111 -0.598 -12.824 393 HD12 ILE 47 HD12 ILE 47 10.030 -1.444 -11.553 394 HD13 ILE 47 HD13 ILE 47 8.841 -2.308 -12.531 395 H ASP 48 H ASP 48 9.676 3.141 -10.243 396 HA ASP 48 HA ASP 48 11.787 2.167 -11.875 397 HB2 ASP 48 HB2 ASP 48 10.771 4.828 -11.209 398 HB3 ASP 48 HB3 ASP 48 12.506 4.797 -11.520 399 H PHE 49 H PHE 49 11.765 3.011 -8.467 400 HA PHE 49 HA PHE 49 14.624 3.111 -8.310 401 HB2 PHE 49 HB2 PHE 49 12.839 4.005 -6.624 402 HB3 PHE 49 HB3 PHE 49 12.897 2.387 -5.954 403 HD1 PHE 49 HD1 PHE 49 13.398 4.125 -4.016 404 HD2 PHE 49 HD2 PHE 49 16.273 3.111 -7.081 405 HE1 PHE 49 HE1 PHE 49 15.244 4.970 -2.604 406 HE2 PHE 49 HE2 PHE 49 18.072 3.996 -5.697 407 HZ PHE 49 HZ PHE 49 17.581 4.960 -3.446 408 H TYR 50 H TYR 50 12.242 0.539 -8.333 409 HA TYR 50 HA TYR 50 13.971 -1.566 -7.290 410 HB2 TYR 50 HB2 TYR 50 11.731 -2.070 -6.973 411 HB3 TYR 50 HB3 TYR 50 11.219 -1.415 -8.512 412 HD1 TYR 50 HD1 TYR 50 12.486 -4.380 -6.777 413 HD2 TYR 50 HD2 TYR 50 11.597 -2.655 -10.626 414 HE1 TYR 50 HE1 TYR 50 12.497 -6.631 -7.788 415 HE2 TYR 50 HE2 TYR 50 11.635 -4.909 -11.657 416 HH TYR 50 HH TYR 50 12.163 -7.839 -9.680 417 H GLU 51 H GLU 51 13.180 -0.046 -10.436 418 HA GLU 51 HA GLU 51 14.378 -2.033 -12.090 419 HB2 GLU 51 HB2 GLU 51 14.104 0.946 -12.622 420 HB3 GLU 51 HB3 GLU 51 14.512 -0.265 -13.824 421 HG2 GLU 51 HG2 GLU 51 12.052 -0.848 -12.273 422 HG3 GLU 51 HG3 GLU 51 11.960 0.606 -13.282 423 H ARG 52 H ARG 52 15.677 0.383 -9.975 424 HA ARG 52 HA ARG 52 18.278 0.697 -11.178 425 HB2 ARG 52 HB2 ARG 52 16.838 2.061 -9.247 426 HB3 ARG 52 HB3 ARG 52 17.898 1.106 -8.220 427 HG2 ARG 52 HG2 ARG 52 19.097 3.093 -8.560 428 HG3 ARG 52 HG3 ARG 52 19.832 1.992 -9.733 429 HD2 ARG 52 HD2 ARG 52 17.612 3.148 -11.094 430 HD3 ARG 52 HD3 ARG 52 18.269 4.471 -10.142 431 HE ARG 52 HE ARG 52 19.292 3.379 -12.538 432 HH11 ARG 52 HH11 ARG 52 20.483 4.803 -9.488 433 HH12 ARG 52 HH12 ARG 52 21.941 5.390 -10.245 434 HH21 ARG 52 HH21 ARG 52 21.091 4.242 -13.457 435 HH22 ARG 52 HH22 ARG 52 22.296 5.093 -12.543 436 H LEU 53 H LEU 53 16.854 -1.784 -9.028 437 HA LEU 53 HA LEU 53 19.292 -2.645 -7.842 438 HB2 LEU 53 HB2 LEU 53 16.860 -4.344 -8.367 439 HB3 LEU 53 HB3 LEU 53 18.057 -4.525 -7.085 440 HG LEU 53 HG LEU 53 16.032 -2.262 -7.364 441 HD11 LEU 53 HD11 LEU 53 15.048 -4.377 -6.626 442 HD12 LEU 53 HD12 LEU 53 16.183 -4.422 -5.249 443 HD13 LEU 53 HD13 LEU 53 14.978 -3.112 -5.389 444 HD21 LEU 53 HD21 LEU 53 16.789 -1.289 -5.386 445 HD22 LEU 53 HD22 LEU 53 18.016 -2.586 -5.117 446 HD23 LEU 53 HD23 LEU 53 18.150 -1.411 -6.439 447 H ASP 54 H ASP 54 20.898 -3.528 -8.751 448 HA ASP 54 HA ASP 54 21.027 -4.403 -11.503 449 HB2 ASP 54 HB2 ASP 54 22.846 -3.368 -9.951 450 HB3 ASP 54 HB3 ASP 54 23.082 -5.008 -9.346 451 H THR 55 H THR 55 20.363 -5.871 -8.432 452 HA THR 55 HA THR 55 19.918 -8.572 -9.586 453 HB THR 55 HB THR 55 20.887 -9.458 -7.426 454 HG1 THR 55 HG1 THR 55 20.751 -7.655 -6.222 455 HG21 THR 55 HG21 THR 55 23.255 -9.221 -7.959 456 HG22 THR 55 HG22 THR 55 22.319 -9.456 -9.450 457 HG23 THR 55 HG23 THR 55 22.930 -7.828 -9.010 458 HA PRO 56 HA PRO 56 16.304 -6.955 -7.300 459 HB2 PRO 56 HB2 PRO 56 14.435 -7.653 -9.163 460 HB3 PRO 56 HB3 PRO 56 15.323 -6.097 -9.200 461 HG2 PRO 56 HG2 PRO 56 15.698 -8.582 -10.855 462 HG3 PRO 56 HG3 PRO 56 15.923 -6.863 -11.313 463 HD2 PRO 56 HD2 PRO 56 17.958 -8.655 -10.590 464 HD3 PRO 56 HD3 PRO 56 18.098 -6.875 -10.559 465 HA PRO 57 HA PRO 57 15.992 -11.389 -6.184 466 HB2 PRO 57 HB2 PRO 57 14.641 -11.141 -3.790 467 HB3 PRO 57 HB3 PRO 57 16.397 -10.857 -3.990 468 HG2 PRO 57 HG2 PRO 57 14.155 -8.835 -3.930 469 HG3 PRO 57 HG3 PRO 57 15.733 -8.770 -3.077 470 HD2 PRO 57 HD2 PRO 57 15.279 -7.440 -5.419 471 HD3 PRO 57 HD3 PRO 57 16.868 -8.174 -5.048 472 H PHE 58 H PHE 58 13.159 -9.219 -5.837 473 HA PHE 58 HA PHE 58 11.297 -11.397 -6.651 474 HB2 PHE 58 HB2 PHE 58 11.034 -8.939 -4.925 475 HB3 PHE 58 HB3 PHE 58 9.622 -9.548 -5.773 476 HD1 PHE 58 HD1 PHE 58 8.439 -11.464 -5.022 477 HD2 PHE 58 HD2 PHE 58 12.294 -10.524 -3.335 478 HE1 PHE 58 HE1 PHE 58 8.105 -13.206 -3.286 479 HE2 PHE 58 HE2 PHE 58 11.951 -12.298 -1.616 480 HZ PHE 58 HZ PHE 58 9.901 -13.627 -1.596 481 H SER 59 H SER 59 9.348 -10.445 -7.890 482 HA SER 59 HA SER 59 10.360 -9.029 -10.312 483 HB2 SER 59 HB2 SER 59 8.298 -9.787 -11.317 484 HB3 SER 59 HB3 SER 59 9.200 -11.151 -10.642 485 HG SER 59 HG SER 59 7.809 -11.275 -8.965 486 H LYS 60 H LYS 60 9.380 -7.178 -11.083 487 HA LYS 60 HA LYS 60 8.349 -5.170 -9.340 488 HB2 LYS 60 HB2 LYS 60 7.495 -4.193 -11.607 489 HB3 LYS 60 HB3 LYS 60 9.223 -4.334 -11.322 490 HG2 LYS 60 HG2 LYS 60 9.341 -6.381 -12.697 491 HG3 LYS 60 HG3 LYS 60 7.584 -6.342 -12.897 492 HD2 LYS 60 HD2 LYS 60 8.578 -5.617 -14.900 493 HD3 LYS 60 HD3 LYS 60 7.826 -4.199 -14.148 494 HE2 LYS 60 HE2 LYS 60 10.141 -3.547 -13.312 495 HE3 LYS 60 HE3 LYS 60 10.803 -4.902 -14.216 496 HZ1 LYS 60 HZ1 LYS 60 10.858 -2.669 -15.300 497 HZ2 LYS 60 HZ2 LYS 60 10.262 -3.858 -16.238 498 HZ3 LYS 60 HZ3 LYS 60 9.247 -2.753 -15.536 499 H LYS 61 H LYS 61 6.766 -7.797 -11.038 500 HA LYS 61 HA LYS 61 4.065 -6.904 -10.753 501 HB2 LYS 61 HB2 LYS 61 5.144 -8.774 -12.284 502 HB3 LYS 61 HB3 LYS 61 4.911 -9.811 -10.884 503 HG2 LYS 61 HG2 LYS 61 3.029 -10.090 -12.316 504 HG3 LYS 61 HG3 LYS 61 2.441 -9.169 -10.923 505 HD2 LYS 61 HD2 LYS 61 2.458 -7.101 -12.219 506 HD3 LYS 61 HD3 LYS 61 3.351 -7.886 -13.548 507 HE2 LYS 61 HE2 LYS 61 1.410 -9.404 -13.916 508 HE3 LYS 61 HE3 LYS 61 0.521 -8.557 -12.639 509 HZ1 LYS 61 HZ1 LYS 61 -0.028 -7.778 -14.842 510 HZ2 LYS 61 HZ2 LYS 61 0.611 -6.558 -13.959 511 HZ3 LYS 61 HZ3 LYS 61 1.512 -7.314 -15.133 512 H SER 62 H SER 62 6.072 -9.239 -8.758 513 HA SER 62 HA SER 62 4.064 -9.677 -6.842 514 HB2 SER 62 HB2 SER 62 6.224 -10.965 -7.343 515 HB3 SER 62 HB3 SER 62 7.068 -9.761 -6.350 516 HG SER 62 HG SER 62 4.870 -11.430 -5.582 517 H LEU 63 H LEU 63 6.628 -7.180 -7.077 518 HA LEU 63 HA LEU 63 6.391 -6.006 -4.556 519 HB2 LEU 63 HB2 LEU 63 8.109 -5.530 -6.232 520 HB3 LEU 63 HB3 LEU 63 6.966 -4.655 -7.226 521 HG LEU 63 HG LEU 63 7.136 -3.725 -4.390 522 HD11 LEU 63 HD11 LEU 63 9.501 -4.239 -4.800 523 HD12 LEU 63 HD12 LEU 63 9.464 -3.270 -6.302 524 HD13 LEU 63 HD13 LEU 63 9.231 -2.492 -4.724 525 HD21 LEU 63 HD21 LEU 63 5.809 -2.514 -6.109 526 HD22 LEU 63 HD22 LEU 63 7.113 -1.503 -5.466 527 HD23 LEU 63 HD23 LEU 63 7.302 -2.227 -7.059 528 H ARG 64 H ARG 64 4.567 -5.101 -7.533 529 HA ARG 64 HA ARG 64 2.906 -3.211 -6.231 530 HB2 ARG 64 HB2 ARG 64 3.095 -3.286 -8.675 531 HB3 ARG 64 HB3 ARG 64 2.432 -4.906 -8.735 532 HG2 ARG 64 HG2 ARG 64 0.849 -3.153 -9.494 533 HG3 ARG 64 HG3 ARG 64 0.225 -4.130 -8.166 534 HD2 ARG 64 HD2 ARG 64 0.646 -2.391 -6.565 535 HD3 ARG 64 HD3 ARG 64 1.512 -1.422 -7.753 536 HE ARG 64 HE ARG 64 -0.912 -1.614 -8.932 537 HH11 ARG 64 HH11 ARG 64 0.066 -0.739 -5.665 538 HH12 ARG 64 HH12 ARG 64 -1.362 0.159 -5.270 539 HH21 ARG 64 HH21 ARG 64 -2.789 -0.371 -8.496 540 HH22 ARG 64 HH22 ARG 64 -2.936 0.564 -7.041 541 H GLU 65 H GLU 65 2.281 -6.684 -6.970 542 HA GLU 65 HA GLU 65 -0.318 -6.712 -5.948 543 HB2 GLU 65 HB2 GLU 65 1.376 -8.575 -7.146 544 HB3 GLU 65 HB3 GLU 65 1.214 -9.219 -5.512 545 HG2 GLU 65 HG2 GLU 65 -0.560 -10.179 -6.772 546 HG3 GLU 65 HG3 GLU 65 -1.318 -8.923 -5.790 547 H ALA 66 H ALA 66 2.767 -7.249 -4.146 548 HA ALA 66 HA ALA 66 1.422 -7.894 -1.691 549 HB1 ALA 66 HB1 ALA 66 3.797 -8.461 -2.128 550 HB2 ALA 66 HB2 ALA 66 4.180 -6.719 -2.134 551 HB3 ALA 66 HB3 ALA 66 3.590 -7.500 -0.651 552 H LEU 67 H LEU 67 2.683 -4.789 -3.018 553 HA LEU 67 HA LEU 67 2.196 -3.123 -0.800 554 HB2 LEU 67 HB2 LEU 67 3.294 -2.795 -3.200 555 HB3 LEU 67 HB3 LEU 67 1.703 -2.213 -3.659 556 HG LEU 67 HG LEU 67 3.461 -1.090 -1.422 557 HD11 LEU 67 HD11 LEU 67 4.448 -0.819 -3.706 558 HD12 LEU 67 HD12 LEU 67 2.965 -0.007 -4.239 559 HD13 LEU 67 HD13 LEU 67 3.985 0.727 -2.989 560 HD21 LEU 67 HD21 LEU 67 2.013 0.926 -1.589 561 HD22 LEU 67 HD22 LEU 67 0.947 0.068 -2.733 562 HD23 LEU 67 HD23 LEU 67 1.129 -0.501 -1.058 563 H SER 68 H SER 68 -0.036 -4.305 -3.309 564 HA SER 68 HA SER 68 -2.282 -2.755 -2.761 565 HB2 SER 68 HB2 SER 68 -1.934 -4.455 -4.621 566 HB3 SER 68 HB3 SER 68 -2.366 -5.708 -3.450 567 HG SER 68 HG SER 68 -3.991 -3.560 -4.382 568 H TYR 69 H TYR 69 -1.193 -5.761 -1.121 569 HA TYR 69 HA TYR 69 -3.400 -6.229 0.548 570 HB2 TYR 69 HB2 TYR 69 -0.800 -7.300 0.184 571 HB3 TYR 69 HB3 TYR 69 -0.903 -6.894 1.882 572 HD1 TYR 69 HD1 TYR 69 -2.516 -8.104 3.339 573 HD2 TYR 69 HD2 TYR 69 -2.342 -8.833 -0.886 574 HE1 TYR 69 HE1 TYR 69 -3.765 -10.211 3.661 575 HE2 TYR 69 HE2 TYR 69 -3.555 -10.966 -0.596 576 HH TYR 69 HH TYR 69 -4.165 -12.582 1.013 577 H TYR 70 H TYR 70 -0.692 -3.928 0.978 578 HA TYR 70 HA TYR 70 -1.402 -3.331 3.763 579 HB2 TYR 70 HB2 TYR 70 0.657 -2.384 1.778 580 HB3 TYR 70 HB3 TYR 70 0.146 -1.266 3.045 581 HD1 TYR 70 HD1 TYR 70 0.101 -4.860 3.989 582 HD2 TYR 70 HD2 TYR 70 2.506 -1.265 3.810 583 HE1 TYR 70 HE1 TYR 70 1.608 -5.787 5.643 584 HE2 TYR 70 HE2 TYR 70 4.138 -2.305 5.349 585 HH TYR 70 HH TYR 70 3.534 -5.283 7.088 586 H SER 71 H SER 71 -2.012 -1.846 0.544 587 HA SER 71 HA SER 71 -3.588 0.286 1.736 588 HB2 SER 71 HB2 SER 71 -4.386 0.445 -0.720 589 HB3 SER 71 HB3 SER 71 -2.745 0.911 -0.266 590 HG SER 71 HG SER 71 -3.407 -1.672 -1.228 591 H ALA 72 H ALA 72 -4.237 -2.963 1.507 592 HA ALA 72 HA ALA 72 -7.186 -2.591 1.454 593 HB1 ALA 72 HB1 ALA 72 -5.544 -5.030 0.647 594 HB2 ALA 72 HB2 ALA 72 -7.320 -4.899 0.637 595 HB3 ALA 72 HB3 ALA 72 -6.351 -3.913 -0.472 596 H SER 73 H SER 73 -4.862 -2.455 3.594 597 HA SER 73 HA SER 73 -5.397 -4.754 5.294 598 HB2 SER 73 HB2 SER 73 -3.985 -3.685 6.906 599 HB3 SER 73 HB3 SER 73 -3.270 -3.408 5.326 600 HG SER 73 HG SER 73 -3.175 -1.499 6.199 601 HA PRO 74 HA PRO 74 -9.144 -3.363 7.140 602 HB2 PRO 74 HB2 PRO 74 -8.807 -3.804 9.873 603 HB3 PRO 74 HB3 PRO 74 -9.241 -5.068 8.673 604 HG2 PRO 74 HG2 PRO 74 -6.562 -4.387 9.862 605 HG3 PRO 74 HG3 PRO 74 -7.243 -6.008 9.528 606 HD2 PRO 74 HD2 PRO 74 -5.414 -4.816 7.897 607 HD3 PRO 74 HD3 PRO 74 -6.715 -5.847 7.227 608 H ALA 75 H ALA 75 -6.215 -2.397 9.003 609 HA ALA 75 HA ALA 75 -7.316 -0.106 10.153 610 HB1 ALA 75 HB1 ALA 75 -5.300 -1.246 10.881 611 HB2 ALA 75 HB2 ALA 75 -4.434 -0.694 9.420 612 HB3 ALA 75 HB3 ALA 75 -5.006 0.493 10.628 613 H TYR 76 H TYR 76 -5.576 -0.401 6.964 614 HA TYR 76 HA TYR 76 -5.451 2.398 6.482 615 HB2 TYR 76 HB2 TYR 76 -4.162 0.774 5.162 616 HB3 TYR 76 HB3 TYR 76 -5.629 0.021 4.579 617 HD1 TYR 76 HD1 TYR 76 -3.136 2.602 3.884 618 HD2 TYR 76 HD2 TYR 76 -7.152 1.284 2.983 619 HE1 TYR 76 HE1 TYR 76 -3.083 3.868 1.805 620 HE2 TYR 76 HE2 TYR 76 -7.122 2.590 0.911 621 HH TYR 76 HH TYR 76 -5.923 4.033 -0.397 622 H LEU 77 H LEU 77 -7.951 0.003 5.547 623 HA LEU 77 HA LEU 77 -9.599 1.979 4.245 624 HB2 LEU 77 HB2 LEU 77 -10.420 -0.731 5.339 625 HB3 LEU 77 HB3 LEU 77 -11.298 0.234 4.169 626 HG LEU 77 HG LEU 77 -8.462 -0.695 3.571 627 HD11 LEU 77 HD11 LEU 77 -11.015 -2.215 3.081 628 HD12 LEU 77 HD12 LEU 77 -9.384 -2.694 2.541 629 HD13 LEU 77 HD13 LEU 77 -9.763 -2.615 4.279 630 HD21 LEU 77 HD21 LEU 77 -9.153 -0.509 1.242 631 HD22 LEU 77 HD22 LEU 77 -10.758 0.073 1.758 632 HD23 LEU 77 HD23 LEU 77 -9.308 1.032 2.094 633 H SER 78 H SER 78 -9.761 0.438 7.465 634 HA SER 78 HA SER 78 -12.091 1.762 8.395 635 HB2 SER 78 HB2 SER 78 -10.714 -0.183 9.423 636 HB3 SER 78 HB3 SER 78 -9.729 1.066 10.189 637 HG SER 78 HG SER 78 -11.381 1.508 11.515 638 H CYS 79 H CYS 79 -8.667 2.824 8.326 639 HA CYS 79 HA CYS 79 -9.136 5.279 9.734 640 HB2 CYS 79 HB2 CYS 79 -6.931 3.961 9.670 641 HB3 CYS 79 HB3 CYS 79 -6.681 4.704 8.056 642 HG CYS 79 HG CYS 79 -7.116 7.126 8.927 643 H GLN 80 H GLN 80 -10.506 4.641 6.881 644 HA GLN 80 HA GLN 80 -9.729 6.386 4.914 645 HB2 GLN 80 HB2 GLN 80 -12.134 6.727 4.423 646 HB3 GLN 80 HB3 GLN 80 -11.678 5.056 4.505 647 HG2 GLN 80 HG2 GLN 80 -13.275 4.626 5.978 648 HG3 GLN 80 HG3 GLN 80 -12.533 5.718 7.144 649 HE21 GLN 80 HE21 GLN 80 -15.300 5.327 7.179 650 HE22 GLN 80 HE22 GLN 80 -16.065 6.816 6.656 651 H LYS 81 H LYS 81 -8.937 8.393 5.248 652 HA LYS 81 HA LYS 81 -10.606 10.374 6.663 653 HB2 LYS 81 HB2 LYS 81 -7.654 9.773 6.924 654 HB3 LYS 81 HB3 LYS 81 -8.278 11.388 7.258 655 HG2 LYS 81 HG2 LYS 81 -9.471 8.896 8.556 656 HG3 LYS 81 HG3 LYS 81 -8.125 9.783 9.237 657 HD2 LYS 81 HD2 LYS 81 -10.195 11.704 8.563 658 HD3 LYS 81 HD3 LYS 81 -10.982 10.319 9.373 659 HE2 LYS 81 HE2 LYS 81 -9.325 10.402 11.140 660 HE3 LYS 81 HE3 LYS 81 -8.464 11.716 10.309 661 HZ1 LYS 81 HZ1 LYS 81 -10.310 13.161 10.687 662 HZ2 LYS 81 HZ2 LYS 81 -11.256 11.952 11.305 663 HZ3 LYS 81 HZ3 LYS 81 -9.948 12.483 12.135 664 HA PRO 82 HA PRO 82 -9.818 11.959 2.461 665 HB2 PRO 82 HB2 PRO 82 -11.974 13.637 2.302 666 HB3 PRO 82 HB3 PRO 82 -12.134 11.872 2.105 667 HG2 PRO 82 HG2 PRO 82 -12.657 13.535 4.586 668 HG3 PRO 82 HG3 PRO 82 -13.687 12.248 3.895 669 HD2 PRO 82 HD2 PRO 82 -11.930 11.845 5.964 670 HD3 PRO 82 HD3 PRO 82 -12.338 10.561 4.788 671 H ASP 83 H ASP 83 -9.776 14.453 1.859 672 HA ASP 83 HA ASP 83 -8.617 16.440 2.208 673 HB2 ASP 83 HB2 ASP 83 -10.000 16.671 4.849 674 HB3 ASP 83 HB3 ASP 83 -9.644 17.918 3.657 675 H THR 84 H THR 84 -7.105 14.140 3.035 676 HA THR 84 HA THR 84 -5.657 15.089 5.436 677 HB THR 84 HB THR 84 -6.726 12.827 5.317 678 HG1 THR 84 HG1 THR 84 -5.133 13.303 6.769 679 HG21 THR 84 HG21 THR 84 -5.589 11.023 4.146 680 HG22 THR 84 HG22 THR 84 -6.121 12.262 2.996 681 HG23 THR 84 HG23 THR 84 -4.403 12.164 3.462 682 H ALA 85 H ALA 85 -5.268 15.290 2.107 683 HA ALA 85 HA ALA 85 -3.525 15.812 0.693 684 HB1 ALA 85 HB1 ALA 85 -3.498 17.826 1.967 685 HB2 ALA 85 HB2 ALA 85 -2.464 17.094 3.197 686 HB3 ALA 85 HB3 ALA 85 -1.835 17.351 1.545 687 H ARG 86 H ARG 86 -2.813 14.044 -0.054 688 HA ARG 86 HA ARG 86 -0.880 12.390 1.457 689 HB2 ARG 86 HB2 ARG 86 -1.049 10.750 -0.317 690 HB3 ARG 86 HB3 ARG 86 -2.621 11.196 0.322 691 HG2 ARG 86 HG2 ARG 86 -2.479 12.894 -1.797 692 HG3 ARG 86 HG3 ARG 86 -1.467 11.573 -2.378 693 HD2 ARG 86 HD2 ARG 86 -3.491 10.073 -1.638 694 HD3 ARG 86 HD3 ARG 86 -4.411 11.579 -1.619 695 HE ARG 86 HE ARG 86 -3.940 9.977 -3.793 696 HH11 ARG 86 HH11 ARG 86 -3.440 13.566 -3.317 697 HH12 ARG 86 HH12 ARG 86 -3.488 13.807 -5.035 698 HH21 ARG 86 HH21 ARG 86 -4.468 10.664 -5.994 699 HH22 ARG 86 HH22 ARG 86 -3.902 12.233 -6.460 700 H VAL 87 H VAL 87 0.996 11.539 -0.164 701 HA VAL 87 HA VAL 87 2.407 13.807 -1.368 702 HB VAL 87 HB VAL 87 4.417 13.185 -0.011 703 HG11 VAL 87 HG11 VAL 87 3.813 14.400 2.025 704 HG12 VAL 87 HG12 VAL 87 3.161 15.204 0.589 705 HG13 VAL 87 HG13 VAL 87 2.092 14.257 1.652 706 HG21 VAL 87 HG21 VAL 87 2.391 11.655 1.698 707 HG22 VAL 87 HG22 VAL 87 3.757 10.985 0.788 708 HG23 VAL 87 HG23 VAL 87 4.026 12.073 2.174 709 H ASP 88 H ASP 88 4.296 13.050 -2.514 710 HA ASP 88 HA ASP 88 3.853 10.416 -3.796 711 HB2 ASP 88 HB2 ASP 88 4.922 11.285 -5.701 712 HB3 ASP 88 HB3 ASP 88 3.734 12.484 -5.208 713 H ILE 89 H ILE 89 6.143 9.541 -4.648 714 HA ILE 89 HA ILE 89 7.655 8.871 -2.304 715 HB ILE 89 HB ILE 89 9.256 7.880 -4.057 716 HG12 ILE 89 HG12 ILE 89 7.097 8.150 -6.143 717 HG13 ILE 89 HG13 ILE 89 8.123 9.552 -5.885 718 HG21 ILE 89 HG21 ILE 89 7.493 6.566 -2.912 719 HG22 ILE 89 HG22 ILE 89 6.417 6.910 -4.285 720 HG23 ILE 89 HG23 ILE 89 7.892 5.988 -4.544 721 HD11 ILE 89 HD11 ILE 89 10.135 8.216 -6.195 722 HD12 ILE 89 HD12 ILE 89 9.141 6.762 -6.508 723 HD13 ILE 89 HD13 ILE 89 9.074 8.156 -7.617 724 H TYR 90 H TYR 90 7.811 11.698 -4.060 725 HA TYR 90 HA TYR 90 10.715 12.206 -3.574 726 HB2 TYR 90 HB2 TYR 90 8.616 13.650 -5.195 727 HB3 TYR 90 HB3 TYR 90 10.186 14.336 -4.836 728 HD1 TYR 90 HD1 TYR 90 9.999 10.731 -5.814 729 HD2 TYR 90 HD2 TYR 90 10.453 14.786 -7.189 730 HE1 TYR 90 HE1 TYR 90 10.752 9.900 -7.993 731 HE2 TYR 90 HE2 TYR 90 11.174 13.960 -9.382 732 HH TYR 90 HH TYR 90 11.486 12.069 -10.747 733 H GLY 91 H GLY 91 7.753 12.345 -1.894 734 HA2 GLY 91 HA2 GLY 91 7.266 13.267 0.085 735 HA3 GLY 91 HA3 GLY 91 8.763 14.207 0.057 736 H ASN 92 H ASN 92 7.038 14.675 -2.837 737 HA ASN 92 HA ASN 92 6.442 17.479 -2.199 738 HB2 ASN 92 HB2 ASN 92 5.445 15.833 -4.557 739 HB3 ASN 92 HB3 ASN 92 5.399 17.570 -4.392 740 HD21 ASN 92 HD21 ASN 92 7.108 15.063 -5.748 741 HD22 ASN 92 HD22 ASN 92 8.612 15.958 -6.110 742 H GLU 93 H GLU 93 4.418 18.437 -1.921 743 HA GLU 93 HA GLU 93 2.362 16.708 -0.744 744 HB2 GLU 93 HB2 GLU 93 3.036 19.622 -0.883 745 HB3 GLU 93 HB3 GLU 93 1.329 19.214 -0.869 746 HG2 GLU 93 HG2 GLU 93 1.494 17.992 1.190 747 HG3 GLU 93 HG3 GLU 93 3.264 18.053 1.152 748 H VAL 94 H VAL 94 0.521 16.151 -1.673 749 HA VAL 94 HA VAL 94 -0.155 17.087 -4.364 750 HB VAL 94 HB VAL 94 -0.846 14.865 -5.032 751 HG11 VAL 94 HG11 VAL 94 2.124 15.091 -4.315 752 HG12 VAL 94 HG12 VAL 94 1.432 14.099 -5.606 753 HG13 VAL 94 HG13 VAL 94 1.327 15.846 -5.708 754 HG21 VAL 94 HG21 VAL 94 -0.871 14.048 -2.576 755 HG22 VAL 94 HG22 VAL 94 -0.417 12.925 -3.864 756 HG23 VAL 94 HG23 VAL 94 0.837 13.674 -2.865 757 H ASP 95 H ASP 95 -2.579 16.159 -4.751 758 HA ASP 95 HA ASP 95 -4.098 17.803 -2.980 759 HB2 ASP 95 HB2 ASP 95 -5.388 15.746 -4.786 760 HB3 ASP 95 HB3 ASP 95 -5.875 17.402 -4.466 761 H VAL 96 H VAL 96 -6.476 16.683 -2.423 762 HA VAL 96 HA VAL 96 -5.754 14.500 -0.564 763 HB VAL 96 HB VAL 96 -7.379 15.280 0.870 764 HG11 VAL 96 HG11 VAL 96 -6.678 17.423 1.475 765 HG12 VAL 96 HG12 VAL 96 -5.311 16.840 0.527 766 HG13 VAL 96 HG13 VAL 96 -6.452 17.953 -0.199 767 HG21 VAL 96 HG21 VAL 96 -8.907 17.281 0.250 768 HG22 VAL 96 HG22 VAL 96 -8.422 16.999 -1.428 769 HG23 VAL 96 HG23 VAL 96 -9.295 15.736 -0.528 770 H VAL 97 H VAL 97 -7.222 12.930 0.024 771 HA VAL 97 HA VAL 97 -8.602 11.763 -2.243 772 HB VAL 97 HB VAL 97 -8.729 10.904 0.687 773 HG11 VAL 97 HG11 VAL 97 -9.370 8.704 -0.228 774 HG12 VAL 97 HG12 VAL 97 -10.513 9.934 -0.764 775 HG13 VAL 97 HG13 VAL 97 -9.278 9.336 -1.881 776 HG21 VAL 97 HG21 VAL 97 -6.784 10.113 -1.526 777 HG22 VAL 97 HG22 VAL 97 -6.409 10.843 0.047 778 HG23 VAL 97 HG23 VAL 97 -7.006 9.200 -0.017 779 H THR 98 H THR 98 -10.799 12.007 -2.741 780 HA THR 98 HA THR 98 -12.172 14.178 -1.487 781 HB THR 98 HB THR 98 -14.051 13.361 -3.043 782 HG1 THR 98 HG1 THR 98 -13.199 11.855 -4.655 783 HG21 THR 98 HG21 THR 98 -12.926 14.164 -5.024 784 HG22 THR 98 HG22 THR 98 -12.298 15.057 -3.632 785 HG23 THR 98 HG23 THR 98 -11.325 13.768 -4.355 786 HA PRO 99 HA PRO 99 -14.274 12.259 1.781 787 HB2 PRO 99 HB2 PRO 99 -16.906 13.204 1.542 788 HB3 PRO 99 HB3 PRO 99 -15.533 14.053 2.320 789 HG2 PRO 99 HG2 PRO 99 -16.616 14.357 -0.474 790 HG3 PRO 99 HG3 PRO 99 -16.046 15.635 0.648 791 HD2 PRO 99 HD2 PRO 99 -14.515 14.728 -1.383 792 HD3 PRO 99 HD3 PRO 99 -13.790 15.129 0.202 793 H GLU 100 H GLU 100 -16.009 11.908 -1.338 794 HA GLU 100 HA GLU 100 -17.458 9.584 -0.481 795 HB2 GLU 100 HB2 GLU 100 -16.815 10.720 -3.218 796 HB3 GLU 100 HB3 GLU 100 -17.695 9.195 -2.984 797 HG2 GLU 100 HG2 GLU 100 -19.300 10.445 -1.460 798 HG3 GLU 100 HG3 GLU 100 -18.526 11.933 -1.999 799 H GLN 101 H GLN 101 -14.451 9.988 -2.470 800 HA GLN 101 HA GLN 101 -14.175 7.170 -2.821 801 HB2 GLN 101 HB2 GLN 101 -12.088 9.404 -2.973 802 HB3 GLN 101 HB3 GLN 101 -11.770 7.716 -3.389 803 HG2 GLN 101 HG2 GLN 101 -13.884 7.962 -4.943 804 HG3 GLN 101 HG3 GLN 101 -13.608 9.667 -4.802 805 HE21 GLN 101 HE21 GLN 101 -13.171 7.306 -6.984 806 HE22 GLN 101 HE22 GLN 101 -11.621 7.743 -7.622 807 H ALA 102 H ALA 102 -13.103 9.293 -0.184 808 HA ALA 102 HA ALA 102 -11.451 7.268 1.029 809 HB1 ALA 102 HB1 ALA 102 -12.876 9.666 2.279 810 HB2 ALA 102 HB2 ALA 102 -11.586 8.719 3.042 811 HB3 ALA 102 HB3 ALA 102 -11.236 9.688 1.587 812 H LYS 103 H LYS 103 -14.883 8.351 1.699 813 HA LYS 103 HA LYS 103 -15.187 6.367 3.691 814 HB2 LYS 103 HB2 LYS 103 -17.526 6.870 3.740 815 HB3 LYS 103 HB3 LYS 103 -16.674 8.386 3.474 816 HG2 LYS 103 HG2 LYS 103 -17.198 8.255 1.079 817 HG3 LYS 103 HG3 LYS 103 -18.021 6.726 1.297 818 HD2 LYS 103 HD2 LYS 103 -18.931 9.450 2.275 819 HD3 LYS 103 HD3 LYS 103 -19.634 8.461 0.998 820 HE2 LYS 103 HE2 LYS 103 -19.992 6.648 2.788 821 HE3 LYS 103 HE3 LYS 103 -19.622 7.895 3.986 822 HZ1 LYS 103 HZ1 LYS 103 -21.951 7.741 3.713 823 HZ2 LYS 103 HZ2 LYS 103 -21.508 9.163 3.069 824 HZ3 LYS 103 HZ3 LYS 103 -21.899 7.887 2.083 825 H TYR 104 H TYR 104 -15.631 6.088 0.234 826 HA TYR 104 HA TYR 104 -17.043 3.751 0.053 827 HB2 TYR 104 HB2 TYR 104 -15.211 5.277 -1.668 828 HB3 TYR 104 HB3 TYR 104 -15.293 3.567 -2.069 829 HD1 TYR 104 HD1 TYR 104 -16.638 6.556 -3.076 830 HD2 TYR 104 HD2 TYR 104 -17.940 2.636 -1.812 831 HE1 TYR 104 HE1 TYR 104 -18.806 6.945 -4.138 832 HE2 TYR 104 HE2 TYR 104 -20.129 3.018 -2.884 833 HH TYR 104 HH TYR 104 -20.980 6.186 -4.362 834 H ALA 105 H ALA 105 -13.740 4.179 1.130 835 HA ALA 105 HA ALA 105 -12.588 1.664 0.671 836 HB1 ALA 105 HB1 ALA 105 -12.340 3.480 3.100 837 HB2 ALA 105 HB2 ALA 105 -11.183 2.238 2.619 838 HB3 ALA 105 HB3 ALA 105 -11.424 3.657 1.573 839 H TYR 106 H TYR 106 -15.067 2.635 3.064 840 HA TYR 106 HA TYR 106 -14.785 0.451 4.811 841 HB2 TYR 106 HB2 TYR 106 -16.580 1.284 5.861 842 HB3 TYR 106 HB3 TYR 106 -16.332 2.675 4.825 843 HD1 TYR 106 HD1 TYR 106 -17.641 2.579 2.442 844 HD2 TYR 106 HD2 TYR 106 -18.569 0.055 5.847 845 HE1 TYR 106 HE1 TYR 106 -19.915 2.206 1.580 846 HE2 TYR 106 HE2 TYR 106 -20.829 -0.352 4.927 847 HH TYR 106 HH TYR 106 -21.828 1.008 1.764 848 H GLN 107 H GLN 107 -16.520 0.645 1.684 849 HA GLN 107 HA GLN 107 -17.927 -1.801 1.928 850 HB2 GLN 107 HB2 GLN 107 -16.885 -0.301 -0.488 851 HB3 GLN 107 HB3 GLN 107 -17.698 -1.859 -0.621 852 HG2 GLN 107 HG2 GLN 107 -19.464 -0.524 1.015 853 HG3 GLN 107 HG3 GLN 107 -18.858 0.795 -0.005 854 HE21 GLN 107 HE21 GLN 107 -18.690 0.014 -2.502 855 HE22 GLN 107 HE22 GLN 107 -20.136 -0.806 -3.043 856 H ARG 108 H ARG 108 -14.609 -1.072 1.068 857 HA ARG 108 HA ARG 108 -13.941 -3.776 0.184 858 HB2 ARG 108 HB2 ARG 108 -12.072 -1.505 1.000 859 HB3 ARG 108 HB3 ARG 108 -11.693 -2.840 -0.062 860 HG2 ARG 108 HG2 ARG 108 -13.722 -0.624 -0.743 861 HG3 ARG 108 HG3 ARG 108 -12.023 -0.614 -1.204 862 HD2 ARG 108 HD2 ARG 108 -12.285 -2.745 -2.419 863 HD3 ARG 108 HD3 ARG 108 -13.999 -2.809 -1.980 864 HE ARG 108 HE ARG 108 -13.593 -0.339 -3.252 865 HH11 ARG 108 HH11 ARG 108 -13.333 -3.793 -4.233 866 HH12 ARG 108 HH12 ARG 108 -13.960 -3.475 -5.808 867 HH21 ARG 108 HH21 ARG 108 -13.966 0.024 -5.441 868 HH22 ARG 108 HH22 ARG 108 -14.465 -1.275 -6.469 869 H TYR 109 H TYR 109 -13.975 -1.998 3.275 870 HA TYR 109 HA TYR 109 -12.234 -3.848 4.652 871 HB2 TYR 109 HB2 TYR 109 -12.738 -1.548 5.424 872 HB3 TYR 109 HB3 TYR 109 -14.410 -1.958 5.683 873 HD1 TYR 109 HD1 TYR 109 -15.009 -3.858 7.393 874 HD2 TYR 109 HD2 TYR 109 -11.209 -1.785 7.241 875 HE1 TYR 109 HE1 TYR 109 -14.559 -4.510 9.720 876 HE2 TYR 109 HE2 TYR 109 -10.795 -2.410 9.596 877 HH TYR 109 HH TYR 109 -12.494 -4.766 11.284 878 H GLN 110 H GLN 110 -15.788 -3.393 4.454 879 HA GLN 110 HA GLN 110 -16.456 -5.705 5.947 880 HB2 GLN 110 HB2 GLN 110 -18.728 -5.480 5.115 881 HB3 GLN 110 HB3 GLN 110 -18.082 -3.907 5.621 882 HG2 GLN 110 HG2 GLN 110 -17.645 -3.324 3.312 883 HG3 GLN 110 HG3 GLN 110 -18.204 -4.895 2.736 884 HE21 GLN 110 HE21 GLN 110 -19.989 -4.432 1.497 885 HE22 GLN 110 HE22 GLN 110 -21.264 -3.357 1.984 886 H GLU 111 H GLU 111 -15.633 -5.338 2.552 887 HA GLU 111 HA GLU 111 -16.900 -7.669 1.599 888 HB2 GLU 111 HB2 GLU 111 -15.875 -7.303 -0.242 889 HB3 GLU 111 HB3 GLU 111 -15.498 -5.708 0.385 890 HG2 GLU 111 HG2 GLU 111 -13.252 -6.526 0.884 891 HG3 GLU 111 HG3 GLU 111 -13.655 -8.088 0.141 892 H ARG 112 H ARG 112 -13.851 -7.243 2.867 893 HA ARG 112 HA ARG 112 -13.110 -10.178 2.977 894 HB2 ARG 112 HB2 ARG 112 -11.526 -7.609 3.306 895 HB3 ARG 112 HB3 ARG 112 -10.891 -9.142 3.908 896 HG2 ARG 112 HG2 ARG 112 -11.038 -10.175 1.712 897 HG3 ARG 112 HG3 ARG 112 -11.690 -8.676 1.019 898 HD2 ARG 112 HD2 ARG 112 -9.634 -7.465 1.562 899 HD3 ARG 112 HD3 ARG 112 -9.023 -8.856 2.470 900 HE ARG 112 HE ARG 112 -8.370 -9.890 0.595 901 HH11 ARG 112 HH11 ARG 112 -10.370 -7.082 -0.449 902 HH12 ARG 112 HH12 ARG 112 -10.388 -7.649 -2.115 903 HH21 ARG 112 HH21 ARG 112 -8.037 -10.166 -1.702 904 HH22 ARG 112 HH22 ARG 112 -8.833 -9.103 -2.829 905 H TYR 113 H TYR 113 -13.617 -7.486 5.291 906 HA TYR 113 HA TYR 113 -13.078 -9.376 7.518 907 HB2 TYR 113 HB2 TYR 113 -13.158 -6.378 7.638 908 HB3 TYR 113 HB3 TYR 113 -12.450 -7.496 8.795 909 HD1 TYR 113 HD1 TYR 113 -11.506 -5.078 6.621 910 HD2 TYR 113 HD2 TYR 113 -10.727 -9.275 7.242 911 HE1 TYR 113 HE1 TYR 113 -9.440 -4.888 5.264 912 HE2 TYR 113 HE2 TYR 113 -8.669 -9.095 5.897 913 HH TYR 113 HH TYR 113 -7.635 -6.018 4.347 914 H GLY 114 H GLY 114 -15.753 -8.349 5.880 915 HA2 GLY 114 HA2 GLY 114 -17.485 -8.433 8.308 916 HA3 GLY 114 HA3 GLY 114 -17.787 -7.355 6.929 917 H ASN 115 H ASN 115 -19.321 -8.183 5.560 918 HA ASN 115 HA ASN 115 -19.187 -10.852 4.479 919 HB2 ASN 115 HB2 ASN 115 -20.485 -10.752 6.898 920 HB3 ASN 115 HB3 ASN 115 -21.835 -10.347 5.854 921 HD21 ASN 115 HD21 ASN 115 -22.329 -12.191 3.977 922 HD22 ASN 115 HD22 ASN 115 -21.553 -13.735 4.329 923 H LYS 116 H LYS 116 -21.274 -11.106 3.082 924 HA LYS 116 HA LYS 116 -22.429 -8.540 2.119 925 HB2 LYS 116 HB2 LYS 116 -21.354 -10.881 0.458 926 HB3 LYS 116 HB3 LYS 116 -22.484 -9.683 -0.161 927 HG2 LYS 116 HG2 LYS 116 -20.858 -7.870 0.267 928 HG3 LYS 116 HG3 LYS 116 -19.670 -9.062 0.823 929 HD2 LYS 116 HD2 LYS 116 -19.768 -10.196 -1.367 930 HD3 LYS 116 HD3 LYS 116 -21.030 -9.079 -1.913 931 HE2 LYS 116 HE2 LYS 116 -19.433 -7.178 -1.691 932 HE3 LYS 116 HE3 LYS 116 -18.170 -8.322 -1.199 933 HZ1 LYS 116 HZ1 LYS 116 -19.559 -8.240 -3.799 934 HZ2 LYS 116 HZ2 LYS 116 -17.960 -7.913 -3.521 935 HZ3 LYS 116 HZ3 LYS 116 -18.521 -9.440 -3.363 936 H LYS 117 H LYS 117 -24.531 -8.986 1.044 937 HA LYS 117 HA LYS 117 -25.879 -11.463 1.988 938 HB2 LYS 117 HB2 LYS 117 -26.567 -9.735 3.514 939 HB3 LYS 117 HB3 LYS 117 -26.760 -8.569 2.195 940 HG2 LYS 117 HG2 LYS 117 -28.649 -10.148 1.298 941 HG3 LYS 117 HG3 LYS 117 -28.503 -10.997 2.830 942 HD2 LYS 117 HD2 LYS 117 -30.307 -9.465 2.945 943 HD3 LYS 117 HD3 LYS 117 -29.008 -8.838 3.988 944 HE2 LYS 117 HE2 LYS 117 -28.305 -7.290 2.160 945 HE3 LYS 117 HE3 LYS 117 -29.553 -7.945 1.101 946 HZ1 LYS 117 HZ1 LYS 117 -30.183 -5.855 2.109 947 HZ2 LYS 117 HZ2 LYS 117 -31.205 -7.039 2.635 948 HZ3 LYS 117 HZ3 LYS 117 -30.005 -6.471 3.619 949 H SER 118 H SER 118 -26.709 -12.467 0.394 950 HA SER 118 HA SER 118 -27.551 -13.143 -1.545 951 HB2 SER 118 HB2 SER 118 -29.330 -11.436 -0.853 952 HB3 SER 118 HB3 SER 118 -28.588 -10.322 -2.023 953 HG SER 118 HG SER 118 -30.240 -11.458 -3.034 954 H GLN 119 H GLN 119 -27.668 -12.561 -4.005 955 HA GLN 119 HA GLN 119 -24.933 -11.681 -4.783 956 HB2 GLN 119 HB2 GLN 119 -26.826 -13.556 -6.225 957 HB3 GLN 119 HB3 GLN 119 -25.322 -12.884 -6.869 958 HG2 GLN 119 HG2 GLN 119 -24.299 -13.771 -4.565 959 HG3 GLN 119 HG3 GLN 119 -25.694 -14.841 -4.612 960 HE21 GLN 119 HE21 GLN 119 -23.221 -13.575 -6.932 961 HE22 GLN 119 HE22 GLN 119 -22.818 -15.152 -7.608 962 H ASP 120 H ASP 120 -27.769 -11.807 -6.836 963 HA ASP 120 HA ASP 120 -28.668 -9.113 -6.752 964 HB2 ASP 120 HB2 ASP 120 -26.707 -8.450 -7.906 965 HB3 ASP 120 HB3 ASP 120 -26.689 -9.878 -8.913 966 H LEU 121 H LEU 121 -27.934 -11.554 -9.097 967 HA LEU 121 HA LEU 121 -30.710 -11.788 -9.876 968 HB2 LEU 121 HB2 LEU 121 -28.143 -13.113 -10.766 969 HB3 LEU 121 HB3 LEU 121 -29.635 -13.935 -11.158 970 HG LEU 121 HG LEU 121 -29.101 -11.053 -11.941 971 HD11 LEU 121 HD11 LEU 121 -27.518 -12.640 -13.049 972 HD12 LEU 121 HD12 LEU 121 -28.883 -13.624 -13.598 973 HD13 LEU 121 HD13 LEU 121 -28.666 -11.964 -14.206 974 HD21 LEU 121 HD21 LEU 121 -30.967 -11.458 -13.541 975 HD22 LEU 121 HD22 LEU 121 -31.242 -13.057 -12.810 976 HD23 LEU 121 HD23 LEU 121 -31.503 -11.561 -11.869 977 H LYS 122 H LYS 122 -31.750 -13.998 -9.982 978 HA LYS 122 HA LYS 122 -31.663 -15.278 -7.329 979 HB2 LYS 122 HB2 LYS 122 -33.759 -16.344 -8.001 980 HB3 LYS 122 HB3 LYS 122 -33.846 -14.593 -8.197 981 HG2 LYS 122 HG2 LYS 122 -33.320 -14.988 -10.697 982 HG3 LYS 122 HG3 LYS 122 -33.598 -16.708 -10.370 983 HD2 LYS 122 HD2 LYS 122 -35.882 -16.218 -9.618 984 HD3 LYS 122 HD3 LYS 122 -35.627 -14.490 -10.008 985 HE2 LYS 122 HE2 LYS 122 -35.048 -15.105 -12.345 986 HE3 LYS 122 HE3 LYS 122 -35.256 -16.816 -11.961 987 HZ1 LYS 122 HZ1 LYS 122 -37.582 -16.379 -11.523 988 HZ2 LYS 122 HZ2 LYS 122 -37.392 -14.779 -11.882 989 HZ3 LYS 122 HZ3 LYS 122 -37.185 -15.919 -13.053 Start of MODEL 8 1 H1 GLY 1 H GLY 1 13.895 -19.031 -4.760 2 HA2 GLY 1 HA2 GLY 1 11.481 -17.598 -3.794 3 HA3 GLY 1 HA3 GLY 1 11.856 -19.286 -3.402 4 H SER 2 H SER 2 11.540 -16.875 -1.644 5 HA SER 2 HA SER 2 14.168 -17.064 -0.243 6 HB2 SER 2 HB2 SER 2 12.552 -14.520 -0.553 7 HB3 SER 2 HB3 SER 2 14.188 -14.689 0.091 8 HG SER 2 HG SER 2 14.153 -13.965 -2.122 9 H ASN 3 H ASN 3 11.087 -17.948 0.087 10 HA ASN 3 HA ASN 3 10.593 -16.844 2.764 11 HB2 ASN 3 HB2 ASN 3 8.928 -18.527 0.884 12 HB3 ASN 3 HB3 ASN 3 8.488 -18.312 2.580 13 HD21 ASN 3 HD21 ASN 3 9.142 -16.498 -0.423 14 HD22 ASN 3 HD22 ASN 3 8.473 -14.984 0.153 15 H GLN 4 H GLN 4 12.870 -18.018 3.235 16 HA GLN 4 HA GLN 4 12.389 -20.817 4.074 17 HB2 GLN 4 HB2 GLN 4 14.865 -19.083 4.512 18 HB3 GLN 4 HB3 GLN 4 14.627 -20.739 5.035 19 HG2 GLN 4 HG2 GLN 4 15.750 -21.188 3.133 20 HG3 GLN 4 HG3 GLN 4 14.126 -21.187 2.451 21 HE21 GLN 4 HE21 GLN 4 16.849 -20.578 1.159 22 HE22 GLN 4 HE22 GLN 4 16.699 -18.960 0.550 23 H GLN 5 H GLN 5 13.550 -17.869 5.772 24 HA GLN 5 HA GLN 5 11.327 -17.850 7.649 25 HB2 GLN 5 HB2 GLN 5 12.604 -18.459 9.658 26 HB3 GLN 5 HB3 GLN 5 12.501 -19.790 8.518 27 HG2 GLN 5 HG2 GLN 5 14.874 -19.076 7.713 28 HG3 GLN 5 HG3 GLN 5 14.913 -18.026 9.139 29 HE21 GLN 5 HE21 GLN 5 16.758 -19.314 9.971 30 HE22 GLN 5 HE22 GLN 5 16.482 -20.941 10.568 31 H LEU 6 H LEU 6 14.374 -16.490 6.513 32 HA LEU 6 HA LEU 6 14.541 -14.455 8.579 33 HB2 LEU 6 HB2 LEU 6 16.022 -14.729 5.926 34 HB3 LEU 6 HB3 LEU 6 16.306 -13.521 7.174 35 HG LEU 6 HG LEU 6 16.464 -15.766 8.721 36 HD11 LEU 6 HD11 LEU 6 17.767 -16.651 6.121 37 HD12 LEU 6 HD12 LEU 6 17.674 -17.539 7.646 38 HD13 LEU 6 HD13 LEU 6 16.209 -17.282 6.685 39 HD21 LEU 6 HD21 LEU 6 18.726 -14.538 7.114 40 HD22 LEU 6 HD22 LEU 6 18.142 -14.044 8.726 41 HD23 LEU 6 HD23 LEU 6 18.913 -15.614 8.516 42 H ASN 7 H ASN 7 12.792 -13.326 8.635 43 HA ASN 7 HA ASN 7 11.784 -11.898 6.236 44 HB2 ASN 7 HB2 ASN 7 9.520 -12.150 6.974 45 HB3 ASN 7 HB3 ASN 7 10.223 -13.763 6.950 46 HD21 ASN 7 HD21 ASN 7 11.121 -14.563 9.200 47 HD22 ASN 7 HD22 ASN 7 10.370 -13.914 10.634 48 H ALA 8 H ALA 8 11.307 -9.763 6.524 49 HA ALA 8 HA ALA 8 12.546 -8.436 8.754 50 HB1 ALA 8 HB1 ALA 8 10.794 -7.308 6.523 51 HB2 ALA 8 HB2 ALA 8 11.870 -6.393 7.595 52 HB3 ALA 8 HB3 ALA 8 12.559 -7.549 6.442 53 H THR 9 H THR 9 9.166 -9.258 7.948 54 HA THR 9 HA THR 9 8.337 -8.215 10.601 55 HB THR 9 HB THR 9 6.289 -7.249 9.475 56 HG1 THR 9 HG1 THR 9 6.688 -6.617 7.263 57 HG21 THR 9 HG21 THR 9 7.358 -5.158 8.970 58 HG22 THR 9 HG22 THR 9 8.300 -5.901 10.253 59 HG23 THR 9 HG23 THR 9 8.896 -5.930 8.583 60 H LYS 10 H LYS 10 6.752 -9.665 7.744 61 HA LYS 10 HA LYS 10 6.449 -12.268 8.762 62 HB2 LYS 10 HB2 LYS 10 4.560 -10.520 9.951 63 HB3 LYS 10 HB3 LYS 10 3.694 -11.126 8.558 64 HG2 LYS 10 HG2 LYS 10 3.163 -12.631 10.274 65 HG3 LYS 10 HG3 LYS 10 4.318 -13.475 9.243 66 HD2 LYS 10 HD2 LYS 10 4.956 -13.921 11.522 67 HD3 LYS 10 HD3 LYS 10 6.142 -12.786 10.887 68 HE2 LYS 10 HE2 LYS 10 4.219 -11.059 11.872 69 HE3 LYS 10 HE3 LYS 10 4.030 -12.412 12.986 70 HZ1 LYS 10 HZ1 LYS 10 6.574 -11.039 12.369 71 HZ2 LYS 10 HZ2 LYS 10 5.647 -10.704 13.671 72 HZ3 LYS 10 HZ3 LYS 10 6.355 -12.194 13.542 73 H LYS 11 H LYS 11 6.013 -13.518 6.905 74 HA LYS 11 HA LYS 11 5.519 -14.101 4.755 75 HB2 LYS 11 HB2 LYS 11 3.674 -11.671 4.604 76 HB3 LYS 11 HB3 LYS 11 3.644 -13.091 3.569 77 HG2 LYS 11 HG2 LYS 11 2.964 -14.499 5.451 78 HG3 LYS 11 HG3 LYS 11 2.993 -13.091 6.540 79 HD2 LYS 11 HD2 LYS 11 1.298 -11.993 4.976 80 HD3 LYS 11 HD3 LYS 11 1.155 -13.572 4.160 81 HE2 LYS 11 HE2 LYS 11 0.616 -14.599 6.398 82 HE3 LYS 11 HE3 LYS 11 0.681 -12.983 7.119 83 HZ1 LYS 11 HZ1 LYS 11 -1.165 -12.403 5.495 84 HZ2 LYS 11 HZ2 LYS 11 -1.286 -13.999 5.163 85 HZ3 LYS 11 HZ3 LYS 11 -1.557 -13.479 6.672 86 H ASP 12 H ASP 12 5.606 -13.396 2.395 87 HA ASP 12 HA ASP 12 7.902 -11.625 2.044 88 HB2 ASP 12 HB2 ASP 12 7.519 -13.766 0.793 89 HB3 ASP 12 HB3 ASP 12 6.204 -12.979 -0.089 90 H LYS 13 H LYS 13 4.420 -11.666 1.387 91 HA LYS 13 HA LYS 13 4.194 -9.356 -0.222 92 HB2 LYS 13 HB2 LYS 13 2.332 -10.610 1.842 93 HB3 LYS 13 HB3 LYS 13 1.842 -9.232 0.874 94 HG2 LYS 13 HG2 LYS 13 2.830 -11.777 -0.481 95 HG3 LYS 13 HG3 LYS 13 1.203 -11.667 0.159 96 HD2 LYS 13 HD2 LYS 13 0.770 -11.007 -1.976 97 HD3 LYS 13 HD3 LYS 13 1.023 -9.444 -1.221 98 HE2 LYS 13 HE2 LYS 13 2.257 -9.312 -3.223 99 HE3 LYS 13 HE3 LYS 13 3.496 -9.666 -2.016 100 HZ1 LYS 13 HZ1 LYS 13 2.190 -11.597 -3.826 101 HZ2 LYS 13 HZ2 LYS 13 3.732 -11.066 -3.953 102 HZ3 LYS 13 HZ3 LYS 13 3.324 -12.013 -2.683 103 H LEU 14 H LEU 14 3.984 -9.535 3.429 104 HA LEU 14 HA LEU 14 3.769 -6.679 3.531 105 HB2 LEU 14 HB2 LEU 14 4.786 -8.407 5.772 106 HB3 LEU 14 HB3 LEU 14 3.999 -6.892 5.911 107 HG LEU 14 HG LEU 14 2.640 -9.457 4.992 108 HD11 LEU 14 HD11 LEU 14 1.422 -9.294 7.092 109 HD12 LEU 14 HD12 LEU 14 3.169 -9.293 7.407 110 HD13 LEU 14 HD13 LEU 14 2.270 -7.778 7.503 111 HD21 LEU 14 HD21 LEU 14 1.607 -7.549 3.837 112 HD22 LEU 14 HD22 LEU 14 0.529 -8.114 5.126 113 HD23 LEU 14 HD23 LEU 14 1.526 -6.656 5.366 114 H GLN 15 H GLN 15 6.506 -8.851 3.290 115 HA GLN 15 HA GLN 15 8.557 -7.236 4.348 116 HB2 GLN 15 HB2 GLN 15 8.456 -9.757 3.556 117 HB3 GLN 15 HB3 GLN 15 8.948 -9.103 2.001 118 HG2 GLN 15 HG2 GLN 15 10.977 -8.158 3.126 119 HG3 GLN 15 HG3 GLN 15 10.435 -8.855 4.641 120 HE21 GLN 15 HE21 GLN 15 10.553 -10.192 1.203 121 HE22 GLN 15 HE22 GLN 15 11.436 -11.608 1.685 122 H VAL 16 H VAL 16 7.341 -7.443 0.901 123 HA VAL 16 HA VAL 16 9.338 -5.539 0.037 124 HB VAL 16 HB VAL 16 8.156 -5.360 -2.057 125 HG11 VAL 16 HG11 VAL 16 9.597 -7.332 -1.702 126 HG12 VAL 16 HG12 VAL 16 8.197 -8.246 -1.096 127 HG13 VAL 16 HG13 VAL 16 8.231 -7.704 -2.781 128 HG21 VAL 16 HG21 VAL 16 5.832 -5.333 -1.387 129 HG22 VAL 16 HG22 VAL 16 6.092 -6.685 -2.496 130 HG23 VAL 16 HG23 VAL 16 5.951 -7.003 -0.770 131 H ILE 17 H ILE 17 6.000 -5.138 1.241 132 HA ILE 17 HA ILE 17 5.868 -2.325 0.658 133 HB ILE 17 HB ILE 17 4.358 -3.754 2.832 134 HG12 ILE 17 HG12 ILE 17 3.457 -3.550 -0.071 135 HG13 ILE 17 HG13 ILE 17 4.073 -4.999 0.707 136 HG21 ILE 17 HG21 ILE 17 2.655 -2.040 2.553 137 HG22 ILE 17 HG22 ILE 17 4.208 -1.232 2.741 138 HG23 ILE 17 HG23 ILE 17 3.493 -1.379 1.125 139 HD11 ILE 17 HD11 ILE 17 2.190 -4.656 2.477 140 HD12 ILE 17 HD12 ILE 17 1.450 -3.611 1.233 141 HD13 ILE 17 HD13 ILE 17 1.783 -5.322 0.904 142 H ASP 18 H ASP 18 6.932 -4.252 3.462 143 HA ASP 18 HA ASP 18 7.308 -1.984 5.192 144 HB2 ASP 18 HB2 ASP 18 7.072 -4.398 5.921 145 HB3 ASP 18 HB3 ASP 18 8.760 -4.637 5.438 146 H TRP 19 H TRP 19 9.393 -3.635 2.818 147 HA TRP 19 HA TRP 19 11.813 -2.302 3.556 148 HB2 TRP 19 HB2 TRP 19 12.158 -4.114 2.148 149 HB3 TRP 19 HB3 TRP 19 10.827 -3.702 1.061 150 HD1 TRP 19 HD1 TRP 19 11.355 -2.205 -1.012 151 HE1 TRP 19 HE1 TRP 19 13.439 -1.011 -1.939 152 HE3 TRP 19 HE3 TRP 19 14.586 -3.007 2.898 153 HZ2 TRP 19 HZ2 TRP 19 16.215 -0.753 -1.237 154 HZ3 TRP 19 HZ3 TRP 19 16.967 -2.325 2.696 155 HH2 TRP 19 HH2 TRP 19 17.783 -1.229 0.616 156 H LEU 20 H LEU 20 9.445 -1.571 0.880 157 HA LEU 20 HA LEU 20 10.734 0.827 0.203 158 HB2 LEU 20 HB2 LEU 20 8.675 1.463 -0.972 159 HB3 LEU 20 HB3 LEU 20 9.270 -0.162 -1.318 160 HG LEU 20 HG LEU 20 7.526 -0.824 0.541 161 HD11 LEU 20 HD11 LEU 20 6.045 1.534 -0.652 162 HD12 LEU 20 HD12 LEU 20 5.603 0.452 0.720 163 HD13 LEU 20 HD13 LEU 20 6.865 1.659 0.907 164 HD21 LEU 20 HD21 LEU 20 5.833 -1.253 -1.162 165 HD22 LEU 20 HD22 LEU 20 6.703 -0.177 -2.276 166 HD23 LEU 20 HD23 LEU 20 7.463 -1.686 -1.678 167 H ILE 21 H ILE 21 8.407 0.241 2.805 168 HA ILE 21 HA ILE 21 7.841 2.986 3.388 169 HB ILE 21 HB ILE 21 7.696 0.394 4.957 170 HG12 ILE 21 HG12 ILE 21 5.449 2.318 4.246 171 HG13 ILE 21 HG13 ILE 21 5.973 1.073 3.151 172 HG21 ILE 21 HG21 ILE 21 6.487 1.759 6.768 173 HG22 ILE 21 HG22 ILE 21 8.255 1.896 6.695 174 HG23 ILE 21 HG23 ILE 21 7.260 3.185 6.055 175 HD11 ILE 21 HD11 ILE 21 4.852 0.621 5.952 176 HD12 ILE 21 HD12 ILE 21 4.026 0.340 4.421 177 HD13 ILE 21 HD13 ILE 21 5.422 -0.661 4.874 178 H GLU 22 H GLU 22 10.428 0.741 4.611 179 HA GLU 22 HA GLU 22 11.530 2.897 6.240 180 HB2 GLU 22 HB2 GLU 22 11.628 0.319 6.675 181 HB3 GLU 22 HB3 GLU 22 12.990 0.338 5.542 182 HG2 GLU 22 HG2 GLU 22 13.959 2.241 7.046 183 HG3 GLU 22 HG3 GLU 22 12.678 1.846 8.180 184 H ASN 23 H ASN 23 11.983 1.759 2.966 185 HA ASN 23 HA ASN 23 14.623 2.823 2.571 186 HB2 ASN 23 HB2 ASN 23 14.520 1.794 0.731 187 HB3 ASN 23 HB3 ASN 23 12.945 1.180 1.056 188 HD21 ASN 23 HD21 ASN 23 11.129 3.094 0.220 189 HD22 ASN 23 HD22 ASN 23 11.567 3.557 -1.414 190 H PHE 24 H PHE 24 11.509 3.989 1.961 191 HA PHE 24 HA PHE 24 12.453 6.834 1.736 192 HB2 PHE 24 HB2 PHE 24 10.501 5.343 0.080 193 HB3 PHE 24 HB3 PHE 24 9.920 6.885 0.617 194 HD1 PHE 24 HD1 PHE 24 11.833 8.859 0.576 195 HD2 PHE 24 HD2 PHE 24 11.436 5.500 -2.107 196 HE1 PHE 24 HE1 PHE 24 12.857 10.184 -1.236 197 HE2 PHE 24 HE2 PHE 24 12.379 6.844 -3.902 198 HZ PHE 24 HZ PHE 24 13.132 9.189 -3.499 199 HA PRO 25 HA PRO 25 9.824 6.593 5.507 200 HB2 PRO 25 HB2 PRO 25 11.541 7.511 7.356 201 HB3 PRO 25 HB3 PRO 25 11.802 5.906 6.610 202 HG2 PRO 25 HG2 PRO 25 13.084 8.550 5.797 203 HG3 PRO 25 HG3 PRO 25 13.905 7.003 6.189 204 HD2 PRO 25 HD2 PRO 25 13.262 7.735 3.624 205 HD3 PRO 25 HD3 PRO 25 13.279 6.036 4.179 206 H ASN 26 H ASN 26 10.084 8.910 3.337 207 HA ASN 26 HA ASN 26 10.079 11.320 5.056 208 HB2 ASN 26 HB2 ASN 26 9.407 11.055 2.101 209 HB3 ASN 26 HB3 ASN 26 9.672 12.533 2.995 210 HD21 ASN 26 HD21 ASN 26 11.891 11.383 4.594 211 HD22 ASN 26 HD22 ASN 26 13.278 11.337 3.549 212 H ALA 27 H ALA 27 7.841 9.086 3.749 213 HA ALA 27 HA ALA 27 5.677 9.951 5.474 214 HB1 ALA 27 HB1 ALA 27 5.390 11.600 3.649 215 HB2 ALA 27 HB2 ALA 27 5.551 10.320 2.430 216 HB3 ALA 27 HB3 ALA 27 4.132 10.350 3.510 217 H PHE 28 H PHE 28 5.095 7.939 6.086 218 HA PHE 28 HA PHE 28 3.830 6.131 4.458 219 HB2 PHE 28 HB2 PHE 28 6.744 5.615 4.518 220 HB3 PHE 28 HB3 PHE 28 5.775 4.258 5.022 221 HD1 PHE 28 HD1 PHE 28 3.336 4.382 3.339 222 HD2 PHE 28 HD2 PHE 28 7.461 5.144 2.285 223 HE1 PHE 28 HE1 PHE 28 2.814 3.919 0.995 224 HE2 PHE 28 HE2 PHE 28 6.952 4.534 -0.060 225 HZ PHE 28 HZ PHE 28 4.596 3.923 -0.719 226 H PHE 29 H PHE 29 3.342 3.938 5.657 227 HA PHE 29 HA PHE 29 3.673 4.052 8.571 228 HB2 PHE 29 HB2 PHE 29 1.015 4.370 7.127 229 HB3 PHE 29 HB3 PHE 29 1.126 3.794 8.781 230 HD1 PHE 29 HD1 PHE 29 1.370 6.796 6.620 231 HD2 PHE 29 HD2 PHE 29 1.938 5.254 10.598 232 HE1 PHE 29 HE1 PHE 29 1.340 9.111 7.555 233 HE2 PHE 29 HE2 PHE 29 1.719 7.555 11.517 234 HZ PHE 29 HZ PHE 29 1.415 9.477 9.980 235 H LYS 30 H LYS 30 3.122 1.988 9.541 236 HA LYS 30 HA LYS 30 2.916 -0.276 7.615 237 HB2 LYS 30 HB2 LYS 30 3.942 -0.156 10.496 238 HB3 LYS 30 HB3 LYS 30 3.646 -1.629 9.610 239 HG2 LYS 30 HG2 LYS 30 5.812 -1.521 9.274 240 HG3 LYS 30 HG3 LYS 30 5.335 -0.610 7.841 241 HD2 LYS 30 HD2 LYS 30 5.867 1.490 9.037 242 HD3 LYS 30 HD3 LYS 30 6.200 0.592 10.513 243 HE2 LYS 30 HE2 LYS 30 7.761 0.298 7.894 244 HE3 LYS 30 HE3 LYS 30 8.296 1.228 9.298 245 HZ1 LYS 30 HZ1 LYS 30 9.357 -0.855 9.364 246 HZ2 LYS 30 HZ2 LYS 30 8.183 -0.984 10.517 247 HZ3 LYS 30 HZ3 LYS 30 8.016 -1.687 9.030 248 H LYS 31 H LYS 31 1.668 0.718 10.901 249 HA LYS 31 HA LYS 31 -0.231 -1.496 10.835 250 HB2 LYS 31 HB2 LYS 31 0.104 0.929 12.626 251 HB3 LYS 31 HB3 LYS 31 -1.278 -0.151 12.797 252 HG2 LYS 31 HG2 LYS 31 1.620 -1.078 12.984 253 HG3 LYS 31 HG3 LYS 31 0.654 -0.565 14.374 254 HD2 LYS 31 HD2 LYS 31 -1.009 -2.367 13.888 255 HD3 LYS 31 HD3 LYS 31 -0.022 -2.871 12.515 256 HE2 LYS 31 HE2 LYS 31 0.496 -4.389 14.218 257 HE3 LYS 31 HE3 LYS 31 1.887 -3.323 14.064 258 HZ1 LYS 31 HZ1 LYS 31 1.332 -3.765 16.325 259 HZ2 LYS 31 HZ2 LYS 31 1.141 -2.172 16.078 260 HZ3 LYS 31 HZ3 LYS 31 -0.173 -3.178 16.212 261 H GLY 32 H GLY 32 -2.064 -1.576 9.673 262 HA2 GLY 32 HA2 GLY 32 -2.953 0.342 7.864 263 HA3 GLY 32 HA3 GLY 32 -3.953 -0.946 8.551 264 H ASN 33 H ASN 33 -3.778 0.061 11.310 265 HA ASN 33 HA ASN 33 -5.996 1.804 11.308 266 HB2 ASN 33 HB2 ASN 33 -5.621 2.082 13.721 267 HB3 ASN 33 HB3 ASN 33 -5.562 0.410 13.210 268 HD21 ASN 33 HD21 ASN 33 -2.813 2.971 13.317 269 HD22 ASN 33 HD22 ASN 33 -1.927 1.937 14.429 270 H GLN 34 H GLN 34 -2.641 2.650 10.908 271 HA GLN 34 HA GLN 34 -3.297 5.514 11.335 272 HB2 GLN 34 HB2 GLN 34 -0.950 5.896 11.956 273 HB3 GLN 34 HB3 GLN 34 -1.775 4.850 13.088 274 HG2 GLN 34 HG2 GLN 34 -0.688 2.889 12.142 275 HG3 GLN 34 HG3 GLN 34 0.154 3.891 10.966 276 HE21 GLN 34 HE21 GLN 34 0.558 2.390 13.981 277 HE22 GLN 34 HE22 GLN 34 1.761 3.494 14.630 278 H VAL 35 H VAL 35 -3.167 3.420 8.916 279 HA VAL 35 HA VAL 35 -1.114 4.486 7.263 280 HB VAL 35 HB VAL 35 -2.213 2.301 7.043 281 HG11 VAL 35 HG11 VAL 35 -4.282 1.889 6.090 282 HG12 VAL 35 HG12 VAL 35 -4.648 3.352 6.986 283 HG13 VAL 35 HG13 VAL 35 -4.342 3.479 5.262 284 HG21 VAL 35 HG21 VAL 35 -0.694 3.148 5.376 285 HG22 VAL 35 HG22 VAL 35 -1.954 2.165 4.620 286 HG23 VAL 35 HG23 VAL 35 -2.026 3.939 4.503 287 H LYS 36 H LYS 36 -0.906 6.317 6.143 288 HA LYS 36 HA LYS 36 -3.243 8.117 6.015 289 HB2 LYS 36 HB2 LYS 36 -1.865 9.895 6.161 290 HB3 LYS 36 HB3 LYS 36 -0.853 8.742 6.945 291 HG2 LYS 36 HG2 LYS 36 0.799 9.418 5.513 292 HG3 LYS 36 HG3 LYS 36 -0.028 8.562 4.249 293 HD2 LYS 36 HD2 LYS 36 0.222 10.704 3.346 294 HD3 LYS 36 HD3 LYS 36 -1.424 10.785 3.982 295 HE2 LYS 36 HE2 LYS 36 -0.217 11.723 6.155 296 HE3 LYS 36 HE3 LYS 36 1.118 12.034 5.043 297 HZ1 LYS 36 HZ1 LYS 36 -1.598 13.174 4.978 298 HZ2 LYS 36 HZ2 LYS 36 -0.156 13.953 5.158 299 HZ3 LYS 36 HZ3 LYS 36 -0.526 13.359 3.712 300 HA PRO 37 HA PRO 37 -3.727 7.505 1.690 301 HB2 PRO 37 HB2 PRO 37 -4.691 9.909 0.793 302 HB3 PRO 37 HB3 PRO 37 -5.619 8.833 1.874 303 HG2 PRO 37 HG2 PRO 37 -3.980 11.265 2.652 304 HG3 PRO 37 HG3 PRO 37 -5.637 10.814 3.174 305 HD2 PRO 37 HD2 PRO 37 -3.449 10.280 4.683 306 HD3 PRO 37 HD3 PRO 37 -4.859 9.196 4.643 307 H LEU 38 H LEU 38 -2.199 7.347 0.060 308 HA LEU 38 HA LEU 38 0.050 9.297 -0.002 309 HB2 LEU 38 HB2 LEU 38 -0.237 6.499 -1.199 310 HB3 LEU 38 HB3 LEU 38 1.117 7.571 -1.424 311 HG LEU 38 HG LEU 38 1.975 6.180 0.112 312 HD11 LEU 38 HD11 LEU 38 0.756 8.243 1.989 313 HD12 LEU 38 HD12 LEU 38 2.244 7.289 2.230 314 HD13 LEU 38 HD13 LEU 38 2.187 8.500 0.953 315 HD21 LEU 38 HD21 LEU 38 0.106 4.788 0.540 316 HD22 LEU 38 HD22 LEU 38 0.788 5.279 2.103 317 HD23 LEU 38 HD23 LEU 38 -0.701 6.033 1.498 318 H LYS 39 H LYS 39 0.973 9.707 -2.194 319 HA LYS 39 HA LYS 39 -0.782 11.078 -3.882 320 HB2 LYS 39 HB2 LYS 39 1.697 11.404 -3.700 321 HB3 LYS 39 HB3 LYS 39 1.950 9.817 -4.382 322 HG2 LYS 39 HG2 LYS 39 0.765 10.796 -6.531 323 HG3 LYS 39 HG3 LYS 39 1.085 12.351 -5.799 324 HD2 LYS 39 HD2 LYS 39 3.508 11.515 -5.531 325 HD3 LYS 39 HD3 LYS 39 3.012 10.125 -6.525 326 HE2 LYS 39 HE2 LYS 39 2.547 11.579 -8.411 327 HE3 LYS 39 HE3 LYS 39 2.917 13.027 -7.447 328 HZ1 LYS 39 HZ1 LYS 39 5.193 12.281 -7.286 329 HZ2 LYS 39 HZ2 LYS 39 4.851 10.869 -8.084 330 HZ3 LYS 39 HZ3 LYS 39 4.769 12.307 -8.855 331 H ILE 40 H ILE 40 -1.626 10.650 -5.962 332 HA ILE 40 HA ILE 40 -2.379 7.905 -6.455 333 HB ILE 40 HB ILE 40 -3.854 9.783 -7.010 334 HG12 ILE 40 HG12 ILE 40 -4.621 9.098 -9.190 335 HG13 ILE 40 HG13 ILE 40 -3.075 8.341 -9.581 336 HG21 ILE 40 HG21 ILE 40 -1.979 11.357 -7.829 337 HG22 ILE 40 HG22 ILE 40 -2.060 10.476 -9.345 338 HG23 ILE 40 HG23 ILE 40 -3.488 11.352 -8.771 339 HD11 ILE 40 HD11 ILE 40 -3.427 6.591 -7.985 340 HD12 ILE 40 HD12 ILE 40 -4.798 7.437 -7.247 341 HD13 ILE 40 HD13 ILE 40 -4.937 6.761 -8.892 342 H GLY 41 H GLY 41 -1.262 6.428 -7.680 343 HA2 GLY 41 HA2 GLY 41 0.206 5.585 -9.281 344 HA3 GLY 41 HA3 GLY 41 0.644 7.227 -9.746 345 H ILE 42 H ILE 42 1.004 6.861 -6.400 346 HA ILE 42 HA ILE 42 3.698 7.318 -6.324 347 HB ILE 42 HB ILE 42 2.058 7.631 -4.505 348 HG12 ILE 42 HG12 ILE 42 4.588 6.262 -3.563 349 HG13 ILE 42 HG13 ILE 42 4.530 7.841 -4.324 350 HG21 ILE 42 HG21 ILE 42 1.611 5.851 -2.876 351 HG22 ILE 42 HG22 ILE 42 1.003 5.400 -4.468 352 HG23 ILE 42 HG23 ILE 42 2.507 4.688 -3.857 353 HD11 ILE 42 HD11 ILE 42 3.286 7.074 -1.688 354 HD12 ILE 42 HD12 ILE 42 4.635 8.180 -1.976 355 HD13 ILE 42 HD13 ILE 42 3.010 8.642 -2.501 356 H PHE 43 H PHE 43 2.292 4.178 -6.943 357 HA PHE 43 HA PHE 43 4.535 2.584 -6.046 358 HB2 PHE 43 HB2 PHE 43 2.655 1.250 -6.429 359 HB3 PHE 43 HB3 PHE 43 2.121 2.197 -7.812 360 HD1 PHE 43 HD1 PHE 43 2.868 1.774 -10.045 361 HD2 PHE 43 HD2 PHE 43 4.595 -0.403 -6.754 362 HE1 PHE 43 HE1 PHE 43 4.151 0.372 -11.642 363 HE2 PHE 43 HE2 PHE 43 5.874 -1.806 -8.357 364 HZ PHE 43 HZ PHE 43 5.670 -1.384 -10.808 365 H ASP 44 H ASP 44 3.661 4.331 -9.059 366 HA ASP 44 HA ASP 44 5.758 3.216 -10.665 367 HB2 ASP 44 HB2 ASP 44 3.673 4.225 -11.529 368 HB3 ASP 44 HB3 ASP 44 4.237 5.816 -11.007 369 H ASP 45 H ASP 45 5.609 5.868 -8.438 370 HA ASP 45 HA ASP 45 8.094 7.177 -9.292 371 HB2 ASP 45 HB2 ASP 45 6.466 7.373 -6.714 372 HB3 ASP 45 HB3 ASP 45 7.895 8.317 -7.097 373 H LEU 46 H LEU 46 6.992 5.148 -6.581 374 HA LEU 46 HA LEU 46 9.488 4.894 -5.254 375 HB2 LEU 46 HB2 LEU 46 7.323 4.532 -4.198 376 HB3 LEU 46 HB3 LEU 46 6.974 3.169 -5.245 377 HG LEU 46 HG LEU 46 7.583 2.639 -2.891 378 HD11 LEU 46 HD11 LEU 46 9.604 1.239 -4.634 379 HD12 LEU 46 HD12 LEU 46 8.611 0.625 -3.338 380 HD13 LEU 46 HD13 LEU 46 7.857 1.025 -4.884 381 HD21 LEU 46 HD21 LEU 46 9.323 4.250 -2.449 382 HD22 LEU 46 HD22 LEU 46 9.971 2.607 -2.244 383 HD23 LEU 46 HD23 LEU 46 10.388 3.526 -3.678 384 H ILE 47 H ILE 47 7.895 2.784 -7.689 385 HA ILE 47 HA ILE 47 9.703 0.639 -7.417 386 HB ILE 47 HB ILE 47 7.542 0.660 -8.685 387 HG12 ILE 47 HG12 ILE 47 9.394 -1.149 -8.684 388 HG13 ILE 47 HG13 ILE 47 8.048 -1.227 -9.798 389 HG21 ILE 47 HG21 ILE 47 7.781 2.516 -10.173 390 HG22 ILE 47 HG22 ILE 47 9.206 1.836 -10.964 391 HG23 ILE 47 HG23 ILE 47 7.620 1.038 -11.136 392 HD11 ILE 47 HD11 ILE 47 10.473 -1.700 -10.680 393 HD12 ILE 47 HD12 ILE 47 9.342 -0.770 -11.679 394 HD13 ILE 47 HD13 ILE 47 10.610 0.047 -10.768 395 H ASP 48 H ASP 48 9.967 3.708 -9.166 396 HA ASP 48 HA ASP 48 12.162 3.165 -10.757 397 HB2 ASP 48 HB2 ASP 48 10.560 5.310 -10.283 398 HB3 ASP 48 HB3 ASP 48 12.000 5.869 -9.437 399 H PHE 49 H PHE 49 11.933 3.989 -7.312 400 HA PHE 49 HA PHE 49 14.791 4.287 -6.911 401 HB2 PHE 49 HB2 PHE 49 12.704 5.235 -5.546 402 HB3 PHE 49 HB3 PHE 49 12.931 3.765 -4.615 403 HD1 PHE 49 HD1 PHE 49 14.123 7.136 -5.285 404 HD2 PHE 49 HD2 PHE 49 15.205 3.368 -3.487 405 HE1 PHE 49 HE1 PHE 49 15.900 8.265 -3.982 406 HE2 PHE 49 HE2 PHE 49 16.949 4.511 -2.152 407 HZ PHE 49 HZ PHE 49 17.295 6.963 -2.388 408 H TYR 50 H TYR 50 12.462 1.606 -6.793 409 HA TYR 50 HA TYR 50 14.197 -0.280 -5.367 410 HB2 TYR 50 HB2 TYR 50 12.129 -1.145 -5.199 411 HB3 TYR 50 HB3 TYR 50 11.541 -0.366 -6.651 412 HD1 TYR 50 HD1 TYR 50 13.164 -3.436 -5.344 413 HD2 TYR 50 HD2 TYR 50 11.826 -1.340 -8.844 414 HE1 TYR 50 HE1 TYR 50 13.537 -5.485 -6.725 415 HE2 TYR 50 HE2 TYR 50 12.248 -3.320 -10.243 416 HH TYR 50 HH TYR 50 13.392 -5.353 -10.257 417 H GLU 51 H GLU 51 13.705 0.769 -8.731 418 HA GLU 51 HA GLU 51 15.276 -1.256 -10.006 419 HB2 GLU 51 HB2 GLU 51 14.403 1.526 -10.802 420 HB3 GLU 51 HB3 GLU 51 15.371 0.530 -11.868 421 HG2 GLU 51 HG2 GLU 51 12.839 -0.500 -10.597 422 HG3 GLU 51 HG3 GLU 51 12.784 0.474 -12.063 423 H ARG 52 H ARG 52 16.059 1.394 -8.010 424 HA ARG 52 HA ARG 52 18.670 1.962 -9.138 425 HB2 ARG 52 HB2 ARG 52 16.938 3.395 -7.539 426 HB3 ARG 52 HB3 ARG 52 18.057 2.785 -6.310 427 HG2 ARG 52 HG2 ARG 52 18.977 4.855 -7.035 428 HG3 ARG 52 HG3 ARG 52 19.920 3.606 -7.879 429 HD2 ARG 52 HD2 ARG 52 18.102 3.912 -9.773 430 HD3 ARG 52 HD3 ARG 52 17.756 5.444 -8.962 431 HE ARG 52 HE ARG 52 20.514 5.372 -9.259 432 HH11 ARG 52 HH11 ARG 52 17.722 5.050 -11.495 433 HH12 ARG 52 HH12 ARG 52 18.545 5.743 -12.836 434 HH21 ARG 52 HH21 ARG 52 21.619 6.250 -11.098 435 HH22 ARG 52 HH22 ARG 52 20.854 6.271 -12.653 436 H LEU 53 H LEU 53 17.556 -0.446 -6.609 437 HA LEU 53 HA LEU 53 19.817 -0.836 -5.204 438 HB2 LEU 53 HB2 LEU 53 17.549 -2.585 -6.309 439 HB3 LEU 53 HB3 LEU 53 18.726 -3.153 -5.136 440 HG LEU 53 HG LEU 53 18.142 -1.466 -3.638 441 HD11 LEU 53 HD11 LEU 53 16.237 -0.211 -5.385 442 HD12 LEU 53 HD12 LEU 53 16.074 -0.131 -3.623 443 HD13 LEU 53 HD13 LEU 53 17.527 0.467 -4.423 444 HD21 LEU 53 HD21 LEU 53 15.618 -2.872 -4.622 445 HD22 LEU 53 HD22 LEU 53 16.902 -3.673 -3.690 446 HD23 LEU 53 HD23 LEU 53 15.928 -2.410 -2.932 447 H ASP 54 H ASP 54 21.469 -2.288 -5.392 448 HA ASP 54 HA ASP 54 22.523 -2.835 -8.062 449 HB2 ASP 54 HB2 ASP 54 23.973 -2.068 -6.244 450 HB3 ASP 54 HB3 ASP 54 23.463 -3.415 -5.232 451 H THR 55 H THR 55 21.012 -4.628 -5.420 452 HA THR 55 HA THR 55 20.913 -7.077 -7.132 453 HB THR 55 HB THR 55 21.202 -8.376 -4.958 454 HG1 THR 55 HG1 THR 55 21.478 -5.888 -3.988 455 HG21 THR 55 HG21 THR 55 23.593 -6.841 -6.053 456 HG22 THR 55 HG22 THR 55 23.653 -8.343 -5.107 457 HG23 THR 55 HG23 THR 55 22.903 -8.332 -6.712 458 HA PRO 56 HA PRO 56 16.742 -5.653 -5.811 459 HB2 PRO 56 HB2 PRO 56 15.505 -6.316 -8.200 460 HB3 PRO 56 HB3 PRO 56 16.208 -4.721 -7.807 461 HG2 PRO 56 HG2 PRO 56 17.411 -7.028 -9.367 462 HG3 PRO 56 HG3 PRO 56 17.454 -5.284 -9.774 463 HD2 PRO 56 HD2 PRO 56 19.544 -6.528 -8.600 464 HD3 PRO 56 HD3 PRO 56 19.106 -4.859 -8.131 465 HA PRO 57 HA PRO 57 15.949 -10.073 -5.077 466 HB2 PRO 57 HB2 PRO 57 14.135 -9.879 -3.041 467 HB3 PRO 57 HB3 PRO 57 15.862 -9.483 -2.850 468 HG2 PRO 57 HG2 PRO 57 13.553 -7.589 -3.307 469 HG3 PRO 57 HG3 PRO 57 14.876 -7.458 -2.109 470 HD2 PRO 57 HD2 PRO 57 14.903 -6.167 -4.558 471 HD3 PRO 57 HD3 PRO 57 16.385 -6.692 -3.713 472 H PHE 58 H PHE 58 12.653 -9.176 -4.277 473 HA PHE 58 HA PHE 58 11.620 -10.676 -6.522 474 HB2 PHE 58 HB2 PHE 58 10.385 -9.069 -4.269 475 HB3 PHE 58 HB3 PHE 58 9.411 -9.622 -5.618 476 HD1 PHE 58 HD1 PHE 58 8.197 -11.591 -5.264 477 HD2 PHE 58 HD2 PHE 58 11.990 -11.126 -3.263 478 HE1 PHE 58 HE1 PHE 58 7.897 -13.775 -4.170 479 HE2 PHE 58 HE2 PHE 58 11.677 -13.303 -2.184 480 HZ PHE 58 HZ PHE 58 9.634 -14.650 -2.614 481 H SER 59 H SER 59 10.070 -9.767 -8.135 482 HA SER 59 HA SER 59 11.176 -7.348 -9.343 483 HB2 SER 59 HB2 SER 59 8.985 -9.237 -10.308 484 HB3 SER 59 HB3 SER 59 9.865 -8.050 -11.279 485 HG SER 59 HG SER 59 11.724 -9.203 -11.031 486 H LYS 60 H LYS 60 9.771 -5.782 -10.317 487 HA LYS 60 HA LYS 60 8.173 -4.347 -8.637 488 HB2 LYS 60 HB2 LYS 60 7.329 -3.134 -10.567 489 HB3 LYS 60 HB3 LYS 60 9.065 -3.364 -10.593 490 HG2 LYS 60 HG2 LYS 60 7.285 -5.226 -12.197 491 HG3 LYS 60 HG3 LYS 60 7.546 -3.591 -12.769 492 HD2 LYS 60 HD2 LYS 60 9.787 -5.553 -12.177 493 HD3 LYS 60 HD3 LYS 60 9.100 -5.273 -13.764 494 HE2 LYS 60 HE2 LYS 60 10.369 -3.070 -12.079 495 HE3 LYS 60 HE3 LYS 60 11.276 -4.056 -13.180 496 HZ1 LYS 60 HZ1 LYS 60 9.963 -3.244 -14.984 497 HZ2 LYS 60 HZ2 LYS 60 9.070 -2.275 -13.973 498 HZ3 LYS 60 HZ3 LYS 60 10.688 -2.029 -14.134 499 H LYS 61 H LYS 61 7.019 -7.072 -10.569 500 HA LYS 61 HA LYS 61 4.261 -6.327 -10.402 501 HB2 LYS 61 HB2 LYS 61 5.797 -8.533 -11.477 502 HB3 LYS 61 HB3 LYS 61 4.522 -9.204 -10.472 503 HG2 LYS 61 HG2 LYS 61 4.152 -7.230 -12.767 504 HG3 LYS 61 HG3 LYS 61 3.797 -8.961 -12.800 505 HD2 LYS 61 HD2 LYS 61 2.119 -8.565 -10.917 506 HD3 LYS 61 HD3 LYS 61 2.367 -6.825 -11.163 507 HE2 LYS 61 HE2 LYS 61 1.872 -7.359 -13.682 508 HE3 LYS 61 HE3 LYS 61 1.187 -8.865 -13.052 509 HZ1 LYS 61 HZ1 LYS 61 -0.561 -7.279 -13.140 510 HZ2 LYS 61 HZ2 LYS 61 -0.183 -7.391 -11.557 511 HZ3 LYS 61 HZ3 LYS 61 0.317 -6.098 -12.405 512 H SER 62 H SER 62 6.323 -8.504 -8.374 513 HA SER 62 HA SER 62 4.344 -9.140 -6.512 514 HB2 SER 62 HB2 SER 62 7.363 -8.897 -6.158 515 HB3 SER 62 HB3 SER 62 6.260 -9.848 -5.142 516 HG SER 62 HG SER 62 7.412 -10.533 -7.510 517 H LEU 63 H LEU 63 6.672 -6.408 -6.626 518 HA LEU 63 HA LEU 63 6.043 -5.280 -4.132 519 HB2 LEU 63 HB2 LEU 63 7.917 -4.689 -5.641 520 HB3 LEU 63 HB3 LEU 63 6.835 -3.747 -6.650 521 HG LEU 63 HG LEU 63 6.987 -3.198 -3.668 522 HD11 LEU 63 HD11 LEU 63 8.978 -2.040 -5.681 523 HD12 LEU 63 HD12 LEU 63 8.860 -1.675 -3.940 524 HD13 LEU 63 HD13 LEU 63 9.355 -3.281 -4.464 525 HD21 LEU 63 HD21 LEU 63 5.315 -1.944 -5.024 526 HD22 LEU 63 HD22 LEU 63 6.554 -0.884 -4.363 527 HD23 LEU 63 HD23 LEU 63 6.642 -1.344 -6.065 528 H ARG 64 H ARG 64 4.575 -4.525 -7.341 529 HA ARG 64 HA ARG 64 2.623 -2.751 -6.262 530 HB2 ARG 64 HB2 ARG 64 3.291 -2.844 -8.669 531 HB3 ARG 64 HB3 ARG 64 2.527 -4.415 -8.821 532 HG2 ARG 64 HG2 ARG 64 1.158 -2.706 -9.814 533 HG3 ARG 64 HG3 ARG 64 0.320 -3.412 -8.448 534 HD2 ARG 64 HD2 ARG 64 0.082 -1.441 -7.428 535 HD3 ARG 64 HD3 ARG 64 1.790 -1.055 -7.578 536 HE ARG 64 HE ARG 64 1.252 -0.398 -9.991 537 HH11 ARG 64 HH11 ARG 64 -1.058 0.181 -7.343 538 HH12 ARG 64 HH12 ARG 64 -2.091 1.187 -8.310 539 HH21 ARG 64 HH21 ARG 64 0.235 1.363 -11.001 540 HH22 ARG 64 HH22 ARG 64 -1.164 2.117 -10.317 541 H GLU 65 H GLU 65 2.447 -6.292 -6.896 542 HA GLU 65 HA GLU 65 -0.286 -6.659 -6.307 543 HB2 GLU 65 HB2 GLU 65 1.241 -8.365 -7.320 544 HB3 GLU 65 HB3 GLU 65 2.051 -8.536 -5.758 545 HG2 GLU 65 HG2 GLU 65 -0.299 -9.167 -4.816 546 HG3 GLU 65 HG3 GLU 65 -0.781 -9.326 -6.507 547 H ALA 66 H ALA 66 2.584 -6.537 -4.162 548 HA ALA 66 HA ALA 66 1.116 -7.218 -1.775 549 HB1 ALA 66 HB1 ALA 66 3.571 -7.538 -2.035 550 HB2 ALA 66 HB2 ALA 66 3.749 -5.772 -2.116 551 HB3 ALA 66 HB3 ALA 66 3.126 -6.546 -0.645 552 H LEU 67 H LEU 67 2.419 -4.118 -3.080 553 HA LEU 67 HA LEU 67 1.424 -2.429 -1.095 554 HB2 LEU 67 HB2 LEU 67 2.889 -2.095 -3.378 555 HB3 LEU 67 HB3 LEU 67 1.378 -1.368 -3.898 556 HG LEU 67 HG LEU 67 3.087 -0.612 -1.480 557 HD11 LEU 67 HD11 LEU 67 4.041 -0.008 -3.688 558 HD12 LEU 67 HD12 LEU 67 2.548 0.877 -4.083 559 HD13 LEU 67 HD13 LEU 67 3.591 1.422 -2.758 560 HD21 LEU 67 HD21 LEU 67 0.458 0.558 -2.447 561 HD22 LEU 67 HD22 LEU 67 0.870 -0.023 -0.822 562 HD23 LEU 67 HD23 LEU 67 1.609 1.469 -1.432 563 H SER 68 H SER 68 -0.317 -3.750 -3.964 564 HA SER 68 HA SER 68 -2.502 -2.026 -3.682 565 HB2 SER 68 HB2 SER 68 -3.787 -3.656 -5.038 566 HB3 SER 68 HB3 SER 68 -2.310 -2.995 -5.730 567 HG SER 68 HG SER 68 -2.523 -5.566 -4.523 568 H TYR 69 H TYR 69 -1.745 -4.998 -1.893 569 HA TYR 69 HA TYR 69 -4.339 -5.487 -0.801 570 HB2 TYR 69 HB2 TYR 69 -1.542 -6.070 0.189 571 HB3 TYR 69 HB3 TYR 69 -2.944 -6.388 1.185 572 HD1 TYR 69 HD1 TYR 69 -4.838 -7.851 0.289 573 HD2 TYR 69 HD2 TYR 69 -0.906 -7.689 -1.463 574 HE1 TYR 69 HE1 TYR 69 -5.224 -10.034 -0.753 575 HE2 TYR 69 HE2 TYR 69 -1.288 -9.887 -2.548 576 HH TYR 69 HH TYR 69 -2.863 -11.616 -2.963 577 H TYR 70 H TYR 70 -1.614 -3.367 0.261 578 HA TYR 70 HA TYR 70 -2.931 -2.516 2.679 579 HB2 TYR 70 HB2 TYR 70 -0.483 -1.683 1.165 580 HB3 TYR 70 HB3 TYR 70 -1.227 -0.495 2.230 581 HD1 TYR 70 HD1 TYR 70 -0.937 -4.264 2.667 582 HD2 TYR 70 HD2 TYR 70 0.091 -0.335 4.172 583 HE1 TYR 70 HE1 TYR 70 -0.075 -5.269 4.725 584 HE2 TYR 70 HE2 TYR 70 1.088 -1.361 6.149 585 HH TYR 70 HH TYR 70 1.842 -3.497 7.022 586 H SER 71 H SER 71 -2.762 -1.097 -0.622 587 HA SER 71 HA SER 71 -4.460 1.138 0.130 588 HB2 SER 71 HB2 SER 71 -4.865 1.385 -2.269 589 HB3 SER 71 HB3 SER 71 -3.146 1.301 -1.835 590 HG SER 71 HG SER 71 -4.274 -1.164 -2.443 591 H ALA 72 H ALA 72 -5.231 -2.158 -0.221 592 HA ALA 72 HA ALA 72 -8.118 -1.695 -0.692 593 HB1 ALA 72 HB1 ALA 72 -6.934 -3.201 -2.279 594 HB2 ALA 72 HB2 ALA 72 -6.365 -4.191 -0.917 595 HB3 ALA 72 HB3 ALA 72 -8.079 -4.106 -1.289 596 H SER 73 H SER 73 -6.139 -1.580 1.827 597 HA SER 73 HA SER 73 -7.108 -3.720 3.548 598 HB2 SER 73 HB2 SER 73 -6.035 -2.470 5.402 599 HB3 SER 73 HB3 SER 73 -4.966 -2.716 4.020 600 HG SER 73 HG SER 73 -5.312 -0.617 3.395 601 HA PRO 74 HA PRO 74 -10.999 -2.153 4.749 602 HB2 PRO 74 HB2 PRO 74 -11.138 -2.662 7.485 603 HB3 PRO 74 HB3 PRO 74 -11.397 -3.891 6.196 604 HG2 PRO 74 HG2 PRO 74 -8.934 -3.279 7.815 605 HG3 PRO 74 HG3 PRO 74 -9.584 -4.891 7.361 606 HD2 PRO 74 HD2 PRO 74 -7.500 -3.768 6.061 607 HD3 PRO 74 HD3 PRO 74 -8.719 -4.727 5.190 608 H ALA 75 H ALA 75 -8.532 -1.341 7.252 609 HA ALA 75 HA ALA 75 -9.695 0.974 8.192 610 HB1 ALA 75 HB1 ALA 75 -7.449 1.513 9.033 611 HB2 ALA 75 HB2 ALA 75 -7.831 -0.212 9.232 612 HB3 ALA 75 HB3 ALA 75 -6.735 0.313 7.931 613 H TYR 76 H TYR 76 -7.343 0.754 5.442 614 HA TYR 76 HA TYR 76 -7.227 3.546 4.993 615 HB2 TYR 76 HB2 TYR 76 -5.654 2.078 3.851 616 HB3 TYR 76 HB3 TYR 76 -6.964 1.198 3.074 617 HD1 TYR 76 HD1 TYR 76 -5.232 4.535 3.141 618 HD2 TYR 76 HD2 TYR 76 -8.049 1.977 1.083 619 HE1 TYR 76 HE1 TYR 76 -5.255 6.088 1.211 620 HE2 TYR 76 HE2 TYR 76 -8.036 3.509 -0.845 621 HH TYR 76 HH TYR 76 -6.368 6.650 -0.822 622 H LEU 77 H LEU 77 -9.447 1.117 3.499 623 HA LEU 77 HA LEU 77 -10.765 3.085 1.883 624 HB2 LEU 77 HB2 LEU 77 -11.858 0.416 2.817 625 HB3 LEU 77 HB3 LEU 77 -12.451 1.390 1.489 626 HG LEU 77 HG LEU 77 -9.600 0.366 1.456 627 HD11 LEU 77 HD11 LEU 77 -12.095 -1.077 0.553 628 HD12 LEU 77 HD12 LEU 77 -10.412 -1.611 0.276 629 HD13 LEU 77 HD13 LEU 77 -11.062 -1.509 1.925 630 HD21 LEU 77 HD21 LEU 77 -9.916 0.548 -0.974 631 HD22 LEU 77 HD22 LEU 77 -11.546 1.207 -0.708 632 HD23 LEU 77 HD23 LEU 77 -10.129 2.106 -0.149 633 H SER 78 H SER 78 -11.628 1.611 5.014 634 HA SER 78 HA SER 78 -14.064 3.016 5.391 635 HB2 SER 78 HB2 SER 78 -12.848 1.015 6.668 636 HB3 SER 78 HB3 SER 78 -12.327 2.314 7.754 637 HG SER 78 HG SER 78 -14.225 1.474 8.477 638 H CYS 79 H CYS 79 -10.706 4.025 5.963 639 HA CYS 79 HA CYS 79 -11.354 6.497 7.312 640 HB2 CYS 79 HB2 CYS 79 -9.198 5.091 7.521 641 HB3 CYS 79 HB3 CYS 79 -8.715 5.832 5.976 642 HG CYS 79 HG CYS 79 -9.587 7.227 8.873 643 H GLN 80 H GLN 80 -12.260 5.771 4.297 644 HA GLN 80 HA GLN 80 -11.334 7.449 2.404 645 HB2 GLN 80 HB2 GLN 80 -13.788 7.627 1.688 646 HB3 GLN 80 HB3 GLN 80 -13.065 6.032 1.816 647 HG2 GLN 80 HG2 GLN 80 -14.211 5.713 4.032 648 HG3 GLN 80 HG3 GLN 80 -14.914 7.304 3.869 649 HE21 GLN 80 HE21 GLN 80 -16.617 7.647 2.480 650 HE22 GLN 80 HE22 GLN 80 -17.582 6.315 1.856 651 H LYS 81 H LYS 81 -10.506 9.451 2.948 652 HA LYS 81 HA LYS 81 -12.467 11.504 3.783 653 HB2 LYS 81 HB2 LYS 81 -9.690 11.076 4.868 654 HB3 LYS 81 HB3 LYS 81 -10.525 12.623 4.978 655 HG2 LYS 81 HG2 LYS 81 -11.600 10.021 6.138 656 HG3 LYS 81 HG3 LYS 81 -10.726 11.268 7.030 657 HD2 LYS 81 HD2 LYS 81 -12.600 12.840 6.337 658 HD3 LYS 81 HD3 LYS 81 -13.470 11.388 5.755 659 HE2 LYS 81 HE2 LYS 81 -13.267 10.388 8.027 660 HE3 LYS 81 HE3 LYS 81 -12.475 11.868 8.589 661 HZ1 LYS 81 HZ1 LYS 81 -14.580 13.026 7.831 662 HZ2 LYS 81 HZ2 LYS 81 -15.281 11.532 7.754 663 HZ3 LYS 81 HZ3 LYS 81 -14.697 12.068 9.170 664 HA PRO 82 HA PRO 82 -10.628 13.198 -0.011 665 HB2 PRO 82 HB2 PRO 82 -12.591 15.005 -0.573 666 HB3 PRO 82 HB3 PRO 82 -12.858 13.253 -0.736 667 HG2 PRO 82 HG2 PRO 82 -13.630 15.058 1.580 668 HG3 PRO 82 HG3 PRO 82 -14.648 13.844 0.745 669 HD2 PRO 82 HD2 PRO 82 -13.284 13.327 3.094 670 HD3 PRO 82 HD3 PRO 82 -13.651 12.074 1.884 671 H ASP 83 H ASP 83 -10.340 15.652 -0.662 672 HA ASP 83 HA ASP 83 -9.229 17.637 -0.236 673 HB2 ASP 83 HB2 ASP 83 -11.620 17.966 0.466 674 HB3 ASP 83 HB3 ASP 83 -11.112 17.727 2.136 675 H THR 84 H THR 84 -8.018 15.276 0.896 676 HA THR 84 HA THR 84 -6.865 16.067 3.462 677 HB THR 84 HB THR 84 -7.821 13.859 3.164 678 HG1 THR 84 HG1 THR 84 -5.124 14.222 3.738 679 HG21 THR 84 HG21 THR 84 -5.552 13.297 1.205 680 HG22 THR 84 HG22 THR 84 -6.776 12.150 1.789 681 HG23 THR 84 HG23 THR 84 -7.268 13.480 0.757 682 H ALA 85 H ALA 85 -5.668 16.448 0.235 683 HA ALA 85 HA ALA 85 -3.507 16.871 -0.580 684 HB1 ALA 85 HB1 ALA 85 -2.169 18.390 0.728 685 HB2 ALA 85 HB2 ALA 85 -3.880 18.878 0.719 686 HB3 ALA 85 HB3 ALA 85 -3.182 18.098 2.160 687 H ARG 86 H ARG 86 -3.006 14.742 -0.885 688 HA ARG 86 HA ARG 86 -1.498 13.275 1.143 689 HB2 ARG 86 HB2 ARG 86 -1.656 12.713 -1.861 690 HB3 ARG 86 HB3 ARG 86 -1.027 11.643 -0.620 691 HG2 ARG 86 HG2 ARG 86 -3.102 10.765 -0.801 692 HG3 ARG 86 HG3 ARG 86 -3.384 11.921 0.489 693 HD2 ARG 86 HD2 ARG 86 -5.175 11.967 -1.100 694 HD3 ARG 86 HD3 ARG 86 -4.354 13.513 -1.140 695 HE ARG 86 HE ARG 86 -3.780 13.204 -3.312 696 HH11 ARG 86 HH11 ARG 86 -4.142 9.888 -2.116 697 HH12 ARG 86 HH12 ARG 86 -4.971 9.279 -3.478 698 HH21 ARG 86 HH21 ARG 86 -4.401 12.232 -5.392 699 HH22 ARG 86 HH22 ARG 86 -5.037 10.614 -5.403 700 H VAL 87 H VAL 87 0.719 12.285 0.265 701 HA VAL 87 HA VAL 87 2.412 14.423 -0.752 702 HB VAL 87 HB VAL 87 4.122 13.767 0.992 703 HG11 VAL 87 HG11 VAL 87 3.249 15.296 2.638 704 HG12 VAL 87 HG12 VAL 87 2.734 15.857 1.042 705 HG13 VAL 87 HG13 VAL 87 1.574 15.042 2.092 706 HG21 VAL 87 HG21 VAL 87 1.713 12.581 2.457 707 HG22 VAL 87 HG22 VAL 87 3.064 11.649 1.764 708 HG23 VAL 87 HG23 VAL 87 3.350 12.793 3.092 709 H ASP 88 H ASP 88 4.469 13.610 -1.480 710 HA ASP 88 HA ASP 88 4.167 11.092 -2.977 711 HB2 ASP 88 HB2 ASP 88 5.513 12.075 -4.591 712 HB3 ASP 88 HB3 ASP 88 4.593 13.422 -4.012 713 H ILE 89 H ILE 89 6.576 10.109 -3.442 714 HA ILE 89 HA ILE 89 7.348 8.947 -0.965 715 HB ILE 89 HB ILE 89 9.332 8.008 -2.232 716 HG12 ILE 89 HG12 ILE 89 8.358 9.840 -4.444 717 HG13 ILE 89 HG13 ILE 89 9.923 9.803 -3.610 718 HG21 ILE 89 HG21 ILE 89 8.038 6.553 -3.573 719 HG22 ILE 89 HG22 ILE 89 6.979 7.022 -2.237 720 HG23 ILE 89 HG23 ILE 89 6.774 7.766 -3.845 721 HD11 ILE 89 HD11 ILE 89 8.935 7.576 -5.385 722 HD12 ILE 89 HD12 ILE 89 10.006 8.905 -5.885 723 HD13 ILE 89 HD13 ILE 89 10.524 7.740 -4.661 724 H TYR 90 H TYR 90 8.489 11.930 -2.444 725 HA TYR 90 HA TYR 90 10.879 12.089 -0.783 726 HB2 TYR 90 HB2 TYR 90 9.482 14.074 -2.608 727 HB3 TYR 90 HB3 TYR 90 10.910 14.456 -1.676 728 HD1 TYR 90 HD1 TYR 90 9.740 11.857 -4.183 729 HD2 TYR 90 HD2 TYR 90 12.903 14.451 -2.824 730 HE1 TYR 90 HE1 TYR 90 11.202 10.985 -5.961 731 HE2 TYR 90 HE2 TYR 90 14.322 13.688 -4.686 732 HH TYR 90 HH TYR 90 13.407 10.945 -6.803 733 H GLY 91 H GLY 91 7.536 12.578 -0.320 734 HA2 GLY 91 HA2 GLY 91 6.453 13.106 1.637 735 HA3 GLY 91 HA3 GLY 91 7.907 13.874 2.270 736 H ASN 92 H ASN 92 7.283 14.909 -0.934 737 HA ASN 92 HA ASN 92 6.488 17.628 -0.072 738 HB2 ASN 92 HB2 ASN 92 6.895 16.352 -2.822 739 HB3 ASN 92 HB3 ASN 92 6.545 18.047 -2.535 740 HD21 ASN 92 HD21 ASN 92 9.010 15.901 -3.060 741 HD22 ASN 92 HD22 ASN 92 10.353 16.790 -2.360 742 H GLU 93 H GLU 93 4.608 18.687 -0.884 743 HA GLU 93 HA GLU 93 2.277 17.079 -0.614 744 HB2 GLU 93 HB2 GLU 93 2.990 19.980 -1.088 745 HB3 GLU 93 HB3 GLU 93 1.362 19.402 -1.349 746 HG2 GLU 93 HG2 GLU 93 1.571 18.284 0.992 747 HG3 GLU 93 HG3 GLU 93 2.907 19.422 1.238 748 H VAL 94 H VAL 94 0.744 16.646 -1.897 749 HA VAL 94 HA VAL 94 0.874 17.084 -4.787 750 HB VAL 94 HB VAL 94 0.236 14.817 -5.303 751 HG11 VAL 94 HG11 VAL 94 2.602 15.532 -5.414 752 HG12 VAL 94 HG12 VAL 94 2.854 14.992 -3.745 753 HG13 VAL 94 HG13 VAL 94 2.477 13.815 -5.004 754 HG21 VAL 94 HG21 VAL 94 1.038 13.918 -2.568 755 HG22 VAL 94 HG22 VAL 94 -0.655 14.367 -2.921 756 HG23 VAL 94 HG23 VAL 94 0.120 13.062 -3.811 757 H ASP 95 H ASP 95 -1.511 16.124 -5.612 758 HA ASP 95 HA ASP 95 -3.253 18.075 -4.349 759 HB2 ASP 95 HB2 ASP 95 -3.323 16.235 -6.734 760 HB3 ASP 95 HB3 ASP 95 -4.867 16.814 -6.149 761 H VAL 96 H VAL 96 -5.721 17.295 -4.228 762 HA VAL 96 HA VAL 96 -5.757 15.257 -2.073 763 HB VAL 96 HB VAL 96 -7.584 16.446 -1.198 764 HG11 VAL 96 HG11 VAL 96 -6.582 18.288 -0.404 765 HG12 VAL 96 HG12 VAL 96 -5.176 17.744 -1.346 766 HG13 VAL 96 HG13 VAL 96 -6.222 18.965 -2.005 767 HG21 VAL 96 HG21 VAL 96 -8.554 18.517 -2.275 768 HG22 VAL 96 HG22 VAL 96 -7.728 18.073 -3.772 769 HG23 VAL 96 HG23 VAL 96 -8.984 17.015 -3.086 770 H VAL 97 H VAL 97 -7.586 14.012 -1.819 771 HA VAL 97 HA VAL 97 -8.646 12.948 -4.402 772 HB VAL 97 HB VAL 97 -9.406 11.999 -1.601 773 HG11 VAL 97 HG11 VAL 97 -10.953 11.254 -3.384 774 HG12 VAL 97 HG12 VAL 97 -9.587 10.648 -4.343 775 HG13 VAL 97 HG13 VAL 97 -10.000 9.899 -2.785 776 HG21 VAL 97 HG21 VAL 97 -7.053 11.700 -1.801 777 HG22 VAL 97 HG22 VAL 97 -7.780 10.134 -2.130 778 HG23 VAL 97 HG23 VAL 97 -7.191 11.116 -3.486 779 H THR 98 H THR 98 -10.734 13.362 -5.215 780 HA THR 98 HA THR 98 -12.164 15.585 -3.997 781 HB THR 98 HB THR 98 -13.759 15.237 -5.868 782 HG1 THR 98 HG1 THR 98 -12.057 13.151 -6.723 783 HG21 THR 98 HG21 THR 98 -11.723 16.585 -6.258 784 HG22 THR 98 HG22 THR 98 -10.862 15.137 -6.818 785 HG23 THR 98 HG23 THR 98 -12.263 15.746 -7.722 786 HA PRO 99 HA PRO 99 -14.868 13.356 -1.343 787 HB2 PRO 99 HB2 PRO 99 -17.414 14.310 -1.883 788 HB3 PRO 99 HB3 PRO 99 -16.167 15.110 -0.881 789 HG2 PRO 99 HG2 PRO 99 -16.808 15.566 -3.804 790 HG3 PRO 99 HG3 PRO 99 -16.555 16.785 -2.515 791 HD2 PRO 99 HD2 PRO 99 -14.576 16.188 -4.210 792 HD3 PRO 99 HD3 PRO 99 -14.212 16.374 -2.471 793 H GLU 100 H GLU 100 -16.222 13.387 -4.634 794 HA GLU 100 HA GLU 100 -17.810 11.050 -4.411 795 HB2 GLU 100 HB2 GLU 100 -16.509 12.558 -6.675 796 HB3 GLU 100 HB3 GLU 100 -17.276 11.015 -7.010 797 HG2 GLU 100 HG2 GLU 100 -18.782 13.171 -5.495 798 HG3 GLU 100 HG3 GLU 100 -18.634 13.239 -7.250 799 H GLN 101 H GLN 101 -14.389 11.446 -5.501 800 HA GLN 101 HA GLN 101 -13.996 8.643 -6.019 801 HB2 GLN 101 HB2 GLN 101 -12.046 10.880 -5.431 802 HB3 GLN 101 HB3 GLN 101 -11.586 9.250 -5.991 803 HG2 GLN 101 HG2 GLN 101 -12.644 9.567 -8.112 804 HG3 GLN 101 HG3 GLN 101 -13.424 11.063 -7.600 805 HE21 GLN 101 HE21 GLN 101 -11.344 10.401 -9.782 806 HE22 GLN 101 HE22 GLN 101 -10.201 11.727 -9.594 807 H ALA 102 H ALA 102 -13.413 10.742 -3.137 808 HA ALA 102 HA ALA 102 -11.945 8.783 -1.670 809 HB1 ALA 102 HB1 ALA 102 -13.720 11.055 -0.640 810 HB2 ALA 102 HB2 ALA 102 -12.562 10.120 0.325 811 HB3 ALA 102 HB3 ALA 102 -11.977 11.138 -0.999 812 H LYS 103 H LYS 103 -15.465 9.606 -1.650 813 HA LYS 103 HA LYS 103 -16.100 7.517 0.122 814 HB2 LYS 103 HB2 LYS 103 -18.371 7.872 -0.264 815 HB3 LYS 103 HB3 LYS 103 -17.596 9.459 -0.301 816 HG2 LYS 103 HG2 LYS 103 -17.720 9.499 -2.719 817 HG3 LYS 103 HG3 LYS 103 -18.370 7.850 -2.768 818 HD2 LYS 103 HD2 LYS 103 -19.768 10.189 -1.442 819 HD3 LYS 103 HD3 LYS 103 -20.021 9.658 -3.118 820 HE2 LYS 103 HE2 LYS 103 -20.764 7.452 -2.369 821 HE3 LYS 103 HE3 LYS 103 -20.481 7.893 -0.674 822 HZ1 LYS 103 HZ1 LYS 103 -22.216 9.364 -0.705 823 HZ2 LYS 103 HZ2 LYS 103 -22.349 9.407 -2.375 824 HZ3 LYS 103 HZ3 LYS 103 -22.808 8.075 -1.502 825 H TYR 104 H TYR 104 -15.607 7.415 -3.296 826 HA TYR 104 HA TYR 104 -16.982 5.140 -4.050 827 HB2 TYR 104 HB2 TYR 104 -15.263 6.862 -5.284 828 HB3 TYR 104 HB3 TYR 104 -14.197 5.485 -5.135 829 HD1 TYR 104 HD1 TYR 104 -17.693 6.380 -6.161 830 HD2 TYR 104 HD2 TYR 104 -14.205 4.017 -7.013 831 HE1 TYR 104 HE1 TYR 104 -18.815 5.503 -8.169 832 HE2 TYR 104 HE2 TYR 104 -15.340 3.056 -9.005 833 HH TYR 104 HH TYR 104 -17.231 3.163 -10.382 834 H ALA 105 H ALA 105 -14.157 5.393 -2.009 835 HA ALA 105 HA ALA 105 -12.973 2.850 -2.199 836 HB1 ALA 105 HB1 ALA 105 -12.037 4.788 -0.962 837 HB2 ALA 105 HB2 ALA 105 -13.375 4.653 0.204 838 HB3 ALA 105 HB3 ALA 105 -12.180 3.366 0.092 839 H TYR 106 H TYR 106 -16.009 3.862 -0.582 840 HA TYR 106 HA TYR 106 -16.339 1.780 1.201 841 HB2 TYR 106 HB2 TYR 106 -18.404 2.575 1.522 842 HB3 TYR 106 HB3 TYR 106 -17.802 3.949 0.642 843 HD1 TYR 106 HD1 TYR 106 -18.312 3.937 -2.026 844 HD2 TYR 106 HD2 TYR 106 -20.231 1.295 0.796 845 HE1 TYR 106 HE1 TYR 106 -20.266 3.752 -3.533 846 HE2 TYR 106 HE2 TYR 106 -22.087 0.961 -0.770 847 HH TYR 106 HH TYR 106 -22.356 2.707 -3.909 848 H GLN 107 H GLN 107 -17.114 1.787 -2.275 849 HA GLN 107 HA GLN 107 -18.555 -0.634 -2.420 850 HB2 GLN 107 HB2 GLN 107 -16.614 0.629 -4.406 851 HB3 GLN 107 HB3 GLN 107 -17.617 -0.790 -4.770 852 HG2 GLN 107 HG2 GLN 107 -19.657 0.599 -4.241 853 HG3 GLN 107 HG3 GLN 107 -18.574 1.983 -4.053 854 HE21 GLN 107 HE21 GLN 107 -17.777 3.056 -5.860 855 HE22 GLN 107 HE22 GLN 107 -18.391 2.756 -7.444 856 H ARG 108 H ARG 108 -15.097 -0.008 -2.692 857 HA ARG 108 HA ARG 108 -14.224 -2.685 -2.992 858 HB2 ARG 108 HB2 ARG 108 -12.630 -0.475 -1.643 859 HB3 ARG 108 HB3 ARG 108 -12.009 -1.798 -2.610 860 HG2 ARG 108 HG2 ARG 108 -13.642 0.582 -3.666 861 HG3 ARG 108 HG3 ARG 108 -11.885 0.382 -3.763 862 HD2 ARG 108 HD2 ARG 108 -12.173 -1.711 -5.065 863 HD3 ARG 108 HD3 ARG 108 -13.934 -1.475 -5.031 864 HE ARG 108 HE ARG 108 -12.814 0.867 -6.105 865 HH11 ARG 108 HH11 ARG 108 -13.295 -2.545 -6.865 866 HH12 ARG 108 HH12 ARG 108 -13.504 -2.320 -8.571 867 HH21 ARG 108 HH21 ARG 108 -12.902 1.182 -8.457 868 HH22 ARG 108 HH22 ARG 108 -13.016 -0.188 -9.506 869 H TYR 109 H TYR 109 -14.874 -0.757 -0.020 870 HA TYR 109 HA TYR 109 -13.730 -2.709 1.731 871 HB2 TYR 109 HB2 TYR 109 -14.198 -0.346 2.295 872 HB3 TYR 109 HB3 TYR 109 -15.912 -0.657 2.340 873 HD1 TYR 109 HD1 TYR 109 -16.711 -2.673 3.942 874 HD2 TYR 109 HD2 TYR 109 -13.016 -0.468 4.388 875 HE1 TYR 109 HE1 TYR 109 -16.498 -3.475 6.235 876 HE2 TYR 109 HE2 TYR 109 -12.867 -1.222 6.735 877 HH TYR 109 HH TYR 109 -15.336 -3.278 8.266 878 H GLN 110 H GLN 110 -17.200 -2.052 0.802 879 HA GLN 110 HA GLN 110 -18.148 -4.294 2.221 880 HB2 GLN 110 HB2 GLN 110 -20.211 -4.154 0.981 881 HB3 GLN 110 HB3 GLN 110 -19.690 -2.566 1.540 882 HG2 GLN 110 HG2 GLN 110 -19.053 -1.892 -0.667 883 HG3 GLN 110 HG3 GLN 110 -19.182 -3.534 -1.306 884 HE21 GLN 110 HE21 GLN 110 -21.004 -3.889 -2.536 885 HE22 GLN 110 HE22 GLN 110 -22.541 -3.108 -2.243 886 H GLU 111 H GLU 111 -16.702 -4.118 -0.956 887 HA GLU 111 HA GLU 111 -17.626 -6.600 -2.014 888 HB2 GLU 111 HB2 GLU 111 -15.127 -4.932 -2.424 889 HB3 GLU 111 HB3 GLU 111 -15.273 -6.498 -3.212 890 HG2 GLU 111 HG2 GLU 111 -17.708 -4.953 -3.625 891 HG3 GLU 111 HG3 GLU 111 -16.287 -3.993 -4.057 892 H ARG 112 H ARG 112 -14.845 -5.920 0.052 893 HA ARG 112 HA ARG 112 -14.208 -8.836 0.237 894 HB2 ARG 112 HB2 ARG 112 -12.707 -6.237 0.466 895 HB3 ARG 112 HB3 ARG 112 -12.101 -7.609 1.367 896 HG2 ARG 112 HG2 ARG 112 -12.790 -7.939 -1.587 897 HG3 ARG 112 HG3 ARG 112 -11.244 -7.233 -1.121 898 HD2 ARG 112 HD2 ARG 112 -10.649 -9.176 0.197 899 HD3 ARG 112 HD3 ARG 112 -12.234 -9.905 -0.057 900 HE ARG 112 HE ARG 112 -11.601 -9.820 -2.556 901 HH11 ARG 112 HH11 ARG 112 -9.161 -10.361 -0.034 902 HH12 ARG 112 HH12 ARG 112 -8.448 -11.737 -0.823 903 HH21 ARG 112 HH21 ARG 112 -10.524 -11.460 -3.709 904 HH22 ARG 112 HH22 ARG 112 -9.148 -12.265 -3.035 905 H TYR 113 H TYR 113 -15.351 -6.192 2.231 906 HA TYR 113 HA TYR 113 -15.017 -7.919 4.627 907 HB2 TYR 113 HB2 TYR 113 -15.053 -4.922 4.524 908 HB3 TYR 113 HB3 TYR 113 -14.661 -5.930 5.913 909 HD1 TYR 113 HD1 TYR 113 -13.224 -3.876 3.493 910 HD2 TYR 113 HD2 TYR 113 -12.683 -7.740 5.278 911 HE1 TYR 113 HE1 TYR 113 -10.870 -3.915 2.673 912 HE2 TYR 113 HE2 TYR 113 -10.318 -7.769 4.522 913 HH TYR 113 HH TYR 113 -8.719 -6.733 3.292 914 H GLY 114 H GLY 114 -17.272 -6.860 2.485 915 HA2 GLY 114 HA2 GLY 114 -19.483 -6.804 4.527 916 HA3 GLY 114 HA3 GLY 114 -19.476 -5.852 3.061 917 H ASN 115 H ASN 115 -18.424 -9.261 3.010 918 HA ASN 115 HA ASN 115 -20.989 -10.020 1.679 919 HB2 ASN 115 HB2 ASN 115 -18.871 -9.424 0.184 920 HB3 ASN 115 HB3 ASN 115 -18.342 -11.037 0.645 921 HD21 ASN 115 HD21 ASN 115 -20.017 -9.340 -1.731 922 HD22 ASN 115 HD22 ASN 115 -20.985 -10.668 -2.330 923 H LYS 116 H LYS 116 -21.220 -12.519 1.561 924 HA LYS 116 HA LYS 116 -19.886 -13.847 3.894 925 HB2 LYS 116 HB2 LYS 116 -22.806 -14.148 3.106 926 HB3 LYS 116 HB3 LYS 116 -21.875 -15.202 4.170 927 HG2 LYS 116 HG2 LYS 116 -23.039 -13.908 5.642 928 HG3 LYS 116 HG3 LYS 116 -21.434 -13.186 5.655 929 HD2 LYS 116 HD2 LYS 116 -22.144 -11.254 4.503 930 HD3 LYS 116 HD3 LYS 116 -23.547 -12.051 3.792 931 HE2 LYS 116 HE2 LYS 116 -23.244 -11.335 6.746 932 HE3 LYS 116 HE3 LYS 116 -24.168 -10.427 5.537 933 HZ1 LYS 116 HZ1 LYS 116 -25.724 -11.751 6.584 934 HZ2 LYS 116 HZ2 LYS 116 -25.459 -12.505 5.178 935 HZ3 LYS 116 HZ3 LYS 116 -24.792 -13.111 6.575 936 H LYS 117 H LYS 117 -18.465 -14.965 2.785 937 HA LYS 117 HA LYS 117 -19.276 -16.442 0.378 938 HB2 LYS 117 HB2 LYS 117 -16.916 -15.285 0.947 939 HB3 LYS 117 HB3 LYS 117 -16.543 -16.926 1.502 940 HG2 LYS 117 HG2 LYS 117 -17.152 -17.825 -0.721 941 HG3 LYS 117 HG3 LYS 117 -17.788 -16.247 -1.204 942 HD2 LYS 117 HD2 LYS 117 -15.429 -15.312 -0.903 943 HD3 LYS 117 HD3 LYS 117 -14.880 -16.973 -0.701 944 HE2 LYS 117 HE2 LYS 117 -14.536 -16.179 -2.987 945 HE3 LYS 117 HE3 LYS 117 -15.649 -17.547 -2.971 946 HZ1 LYS 117 HZ1 LYS 117 -16.194 -15.464 -4.371 947 HZ2 LYS 117 HZ2 LYS 117 -17.404 -16.175 -3.548 948 HZ3 LYS 117 HZ3 LYS 117 -16.683 -14.788 -2.969 949 H SER 118 H SER 118 -18.581 -18.870 0.294 950 HA SER 118 HA SER 118 -20.124 -20.291 2.185 951 HB2 SER 118 HB2 SER 118 -18.651 -22.173 0.869 952 HB3 SER 118 HB3 SER 118 -20.120 -21.433 0.222 953 HG SER 118 HG SER 118 -18.103 -21.490 -1.115 954 H GLN 119 H GLN 119 -16.591 -20.403 1.535 955 HA GLN 119 HA GLN 119 -16.035 -21.925 3.862 956 HB2 GLN 119 HB2 GLN 119 -14.702 -21.669 1.676 957 HB3 GLN 119 HB3 GLN 119 -13.965 -20.244 2.427 958 HG2 GLN 119 HG2 GLN 119 -13.035 -21.595 4.212 959 HG3 GLN 119 HG3 GLN 119 -14.073 -22.966 3.810 960 HE21 GLN 119 HE21 GLN 119 -10.974 -21.620 3.332 961 HE22 GLN 119 HE22 GLN 119 -10.464 -22.783 2.110 962 H ASP 120 H ASP 120 -14.469 -21.175 5.642 963 HA ASP 120 HA ASP 120 -15.696 -19.163 7.153 964 HB2 ASP 120 HB2 ASP 120 -14.249 -19.777 8.821 965 HB3 ASP 120 HB3 ASP 120 -14.369 -21.259 7.881 966 H LEU 121 H LEU 121 -14.572 -17.435 8.260 967 HA LEU 121 HA LEU 121 -12.329 -16.155 7.031 968 HB2 LEU 121 HB2 LEU 121 -13.511 -14.101 6.348 969 HB3 LEU 121 HB3 LEU 121 -13.987 -15.466 5.385 970 HG LEU 121 HG LEU 121 -15.850 -15.335 7.602 971 HD11 LEU 121 HD11 LEU 121 -15.520 -12.668 6.191 972 HD12 LEU 121 HD12 LEU 121 -16.826 -13.112 7.297 973 HD13 LEU 121 HD13 LEU 121 -15.173 -12.991 7.911 974 HD21 LEU 121 HD21 LEU 121 -17.496 -14.985 5.806 975 HD22 LEU 121 HD22 LEU 121 -16.179 -14.643 4.658 976 HD23 LEU 121 HD23 LEU 121 -16.333 -16.256 5.393 977 H LYS 122 H LYS 122 -11.642 -14.257 8.131 978 HA LYS 122 HA LYS 122 -12.272 -14.322 10.990 979 HB2 LYS 122 HB2 LYS 122 -9.920 -13.910 9.510 980 HB3 LYS 122 HB3 LYS 122 -10.328 -12.280 9.999 981 HG2 LYS 122 HG2 LYS 122 -10.080 -14.680 11.849 982 HG3 LYS 122 HG3 LYS 122 -8.804 -13.513 11.568 983 HD2 LYS 122 HD2 LYS 122 -11.464 -12.524 12.627 984 HD3 LYS 122 HD3 LYS 122 -10.363 -13.393 13.688 985 HE2 LYS 122 HE2 LYS 122 -9.667 -11.285 14.092 986 HE3 LYS 122 HE3 LYS 122 -8.548 -11.720 12.797 987 HZ1 LYS 122 HZ1 LYS 122 -10.967 -10.017 12.630 988 HZ2 LYS 122 HZ2 LYS 122 -9.414 -9.583 12.370 989 HZ3 LYS 122 HZ3 LYS 122 -10.199 -10.530 11.283 Start of MODEL 9 1 H1 GLY 1 H GLY 1 0.692 -11.928 -11.310 2 HA2 GLY 1 HA2 GLY 1 1.982 -14.281 -12.576 3 HA3 GLY 1 HA3 GLY 1 2.221 -12.612 -13.148 4 H SER 2 H SER 2 3.855 -14.902 -11.511 5 HA SER 2 HA SER 2 5.497 -13.025 -10.091 6 HB2 SER 2 HB2 SER 2 5.365 -14.385 -7.961 7 HB3 SER 2 HB3 SER 2 3.967 -13.365 -8.293 8 HG SER 2 HG SER 2 3.640 -15.603 -7.558 9 H ASN 3 H ASN 3 7.375 -14.467 -9.120 10 HA ASN 3 HA ASN 3 8.018 -16.604 -11.117 11 HB2 ASN 3 HB2 ASN 3 9.856 -14.669 -9.669 12 HB3 ASN 3 HB3 ASN 3 10.384 -16.050 -10.644 13 HD21 ASN 3 HD21 ASN 3 11.043 -13.178 -11.085 14 HD22 ASN 3 HD22 ASN 3 10.277 -12.737 -12.587 15 H GLN 4 H GLN 4 9.685 -15.857 -8.012 16 HA GLN 4 HA GLN 4 8.562 -18.313 -6.767 17 HB2 GLN 4 HB2 GLN 4 11.424 -17.504 -7.357 18 HB3 GLN 4 HB3 GLN 4 11.086 -18.290 -5.850 19 HG2 GLN 4 HG2 GLN 4 11.537 -20.135 -7.054 20 HG3 GLN 4 HG3 GLN 4 9.802 -20.086 -7.311 21 HE21 GLN 4 HE21 GLN 4 12.893 -18.859 -8.745 22 HE22 GLN 4 HE22 GLN 4 12.481 -19.494 -10.337 23 H GLN 5 H GLN 5 9.499 -18.266 -4.332 24 HA GLN 5 HA GLN 5 8.939 -15.560 -3.240 25 HB2 GLN 5 HB2 GLN 5 7.032 -17.088 -2.795 26 HB3 GLN 5 HB3 GLN 5 8.148 -18.198 -1.971 27 HG2 GLN 5 HG2 GLN 5 8.746 -16.319 -0.383 28 HG3 GLN 5 HG3 GLN 5 7.564 -15.295 -1.192 29 HE21 GLN 5 HE21 GLN 5 6.191 -15.044 0.833 30 HE22 GLN 5 HE22 GLN 5 5.357 -16.460 1.421 31 H LEU 6 H LEU 6 10.468 -14.778 -1.935 32 HA LEU 6 HA LEU 6 12.897 -16.398 -1.496 33 HB2 LEU 6 HB2 LEU 6 12.257 -13.444 -1.139 34 HB3 LEU 6 HB3 LEU 6 13.777 -14.239 -0.714 35 HG LEU 6 HG LEU 6 13.851 -15.083 -3.134 36 HD11 LEU 6 HD11 LEU 6 11.674 -14.479 -4.003 37 HD12 LEU 6 HD12 LEU 6 11.882 -12.784 -3.479 38 HD13 LEU 6 HD13 LEU 6 12.865 -13.467 -4.793 39 HD21 LEU 6 HD21 LEU 6 14.182 -12.104 -2.514 40 HD22 LEU 6 HD22 LEU 6 15.368 -13.371 -2.149 41 HD23 LEU 6 HD23 LEU 6 14.987 -12.988 -3.832 42 H ASN 7 H ASN 7 10.894 -14.285 0.529 43 HA ASN 7 HA ASN 7 10.509 -14.113 2.704 44 HB2 ASN 7 HB2 ASN 7 9.029 -16.051 2.093 45 HB3 ASN 7 HB3 ASN 7 10.260 -17.128 2.769 46 HD21 ASN 7 HD21 ASN 7 8.534 -17.756 4.424 47 HD22 ASN 7 HD22 ASN 7 8.162 -16.608 5.704 48 H ALA 8 H ALA 8 12.750 -13.423 2.764 49 HA ALA 8 HA ALA 8 14.923 -14.660 3.837 50 HB1 ALA 8 HB1 ALA 8 13.889 -11.806 4.238 51 HB2 ALA 8 HB2 ALA 8 15.525 -12.339 4.649 52 HB3 ALA 8 HB3 ALA 8 15.001 -12.377 2.979 53 H THR 9 H THR 9 12.575 -12.768 5.802 54 HA THR 9 HA THR 9 13.288 -14.473 8.142 55 HB THR 9 HB THR 9 13.088 -11.445 8.153 56 HG1 THR 9 HG1 THR 9 15.508 -12.013 8.653 57 HG21 THR 9 HG21 THR 9 14.203 -13.330 10.274 58 HG22 THR 9 HG22 THR 9 14.110 -11.563 10.357 59 HG23 THR 9 HG23 THR 9 12.622 -12.514 10.358 60 H LYS 10 H LYS 10 11.382 -15.572 7.669 61 HA LYS 10 HA LYS 10 9.307 -16.236 7.841 62 HB2 LYS 10 HB2 LYS 10 10.102 -15.496 10.206 63 HB3 LYS 10 HB3 LYS 10 8.840 -14.271 10.080 64 HG2 LYS 10 HG2 LYS 10 7.146 -16.053 9.776 65 HG3 LYS 10 HG3 LYS 10 8.426 -17.272 9.705 66 HD2 LYS 10 HD2 LYS 10 9.114 -16.546 12.074 67 HD3 LYS 10 HD3 LYS 10 7.653 -15.556 12.099 68 HE2 LYS 10 HE2 LYS 10 7.038 -17.576 13.174 69 HE3 LYS 10 HE3 LYS 10 6.342 -17.701 11.557 70 HZ1 LYS 10 HZ1 LYS 10 7.345 -19.723 12.084 71 HZ2 LYS 10 HZ2 LYS 10 8.331 -19.059 10.972 72 HZ3 LYS 10 HZ3 LYS 10 8.796 -19.051 12.537 73 H LYS 11 H LYS 11 8.969 -12.651 7.959 74 HA LYS 11 HA LYS 11 6.350 -12.850 6.537 75 HB2 LYS 11 HB2 LYS 11 7.677 -10.636 8.160 76 HB3 LYS 11 HB3 LYS 11 6.178 -10.425 7.259 77 HG2 LYS 11 HG2 LYS 11 6.516 -12.544 9.401 78 HG3 LYS 11 HG3 LYS 11 5.976 -10.897 9.751 79 HD2 LYS 11 HD2 LYS 11 4.064 -11.299 8.102 80 HD3 LYS 11 HD3 LYS 11 4.602 -13.011 8.062 81 HE2 LYS 11 HE2 LYS 11 4.485 -13.032 10.560 82 HE3 LYS 11 HE3 LYS 11 3.820 -11.404 10.528 83 HZ1 LYS 11 HZ1 LYS 11 2.499 -13.818 9.396 84 HZ2 LYS 11 HZ2 LYS 11 2.105 -13.025 10.766 85 HZ3 LYS 11 HZ3 LYS 11 1.895 -12.283 9.320 86 H ASP 12 H ASP 12 7.190 -13.196 4.418 87 HA ASP 12 HA ASP 12 9.239 -11.602 3.263 88 HB2 ASP 12 HB2 ASP 12 8.885 -12.815 1.341 89 HB3 ASP 12 HB3 ASP 12 8.277 -13.917 2.577 90 H LYS 13 H LYS 13 5.778 -10.953 3.593 91 HA LYS 13 HA LYS 13 5.766 -9.057 1.342 92 HB2 LYS 13 HB2 LYS 13 3.708 -9.161 3.568 93 HB3 LYS 13 HB3 LYS 13 3.514 -8.515 1.948 94 HG2 LYS 13 HG2 LYS 13 3.795 -11.448 2.696 95 HG3 LYS 13 HG3 LYS 13 2.295 -10.642 2.296 96 HD2 LYS 13 HD2 LYS 13 4.597 -10.822 0.316 97 HD3 LYS 13 HD3 LYS 13 3.456 -12.139 0.523 98 HE2 LYS 13 HE2 LYS 13 2.611 -9.297 -0.151 99 HE3 LYS 13 HE3 LYS 13 2.936 -10.550 -1.365 100 HZ1 LYS 13 HZ1 LYS 13 1.188 -11.899 -0.263 101 HZ2 LYS 13 HZ2 LYS 13 0.792 -10.606 0.668 102 HZ3 LYS 13 HZ3 LYS 13 0.621 -10.544 -0.967 103 H LEU 14 H LEU 14 5.782 -8.936 4.904 104 HA LEU 14 HA LEU 14 5.902 -6.101 5.115 105 HB2 LEU 14 HB2 LEU 14 7.026 -8.189 7.031 106 HB3 LEU 14 HB3 LEU 14 6.723 -6.498 7.412 107 HG LEU 14 HG LEU 14 4.578 -8.525 6.627 108 HD11 LEU 14 HD11 LEU 14 4.971 -7.202 9.321 109 HD12 LEU 14 HD12 LEU 14 3.883 -8.543 8.905 110 HD13 LEU 14 HD13 LEU 14 5.651 -8.784 8.936 111 HD21 LEU 14 HD21 LEU 14 4.405 -5.604 7.480 112 HD22 LEU 14 HD22 LEU 14 3.852 -6.312 5.945 113 HD23 LEU 14 HD23 LEU 14 3.018 -6.707 7.459 114 H GLN 15 H GLN 15 8.467 -8.433 4.508 115 HA GLN 15 HA GLN 15 10.697 -6.888 5.194 116 HB2 GLN 15 HB2 GLN 15 10.520 -9.329 4.657 117 HB3 GLN 15 HB3 GLN 15 10.445 -8.930 2.960 118 HG2 GLN 15 HG2 GLN 15 12.715 -9.529 3.484 119 HG3 GLN 15 HG3 GLN 15 12.687 -7.776 3.233 120 HE21 GLN 15 HE21 GLN 15 12.079 -9.968 6.081 121 HE22 GLN 15 HE22 GLN 15 13.215 -9.145 7.143 122 H VAL 16 H VAL 16 9.013 -7.019 1.982 123 HA VAL 16 HA VAL 16 10.826 -5.019 0.905 124 HB VAL 16 HB VAL 16 9.353 -4.986 -1.018 125 HG11 VAL 16 HG11 VAL 16 9.804 -7.281 -1.763 126 HG12 VAL 16 HG12 VAL 16 11.162 -6.662 -0.811 127 HG13 VAL 16 HG13 VAL 16 10.016 -7.804 -0.075 128 HG21 VAL 16 HG21 VAL 16 7.674 -7.111 0.347 129 HG22 VAL 16 HG22 VAL 16 7.169 -5.431 0.019 130 HG23 VAL 16 HG23 VAL 16 7.526 -6.529 -1.320 131 H ILE 17 H ILE 17 7.610 -4.889 2.414 132 HA ILE 17 HA ILE 17 7.140 -2.161 1.715 133 HB ILE 17 HB ILE 17 5.951 -3.661 4.047 134 HG12 ILE 17 HG12 ILE 17 4.805 -3.405 1.224 135 HG13 ILE 17 HG13 ILE 17 5.681 -4.806 1.778 136 HG21 ILE 17 HG21 ILE 17 5.554 -1.207 4.074 137 HG22 ILE 17 HG22 ILE 17 4.889 -1.281 2.436 138 HG23 ILE 17 HG23 ILE 17 4.058 -2.077 3.798 139 HD11 ILE 17 HD11 ILE 17 3.515 -5.497 2.185 140 HD12 ILE 17 HD12 ILE 17 3.946 -4.846 3.771 141 HD13 ILE 17 HD13 ILE 17 2.968 -3.879 2.633 142 H ASP 18 H ASP 18 8.785 -3.669 4.515 143 HA ASP 18 HA ASP 18 9.057 -1.159 5.928 144 HB2 ASP 18 HB2 ASP 18 9.414 -3.393 7.036 145 HB3 ASP 18 HB3 ASP 18 10.954 -3.522 6.173 146 H TRP 19 H TRP 19 11.048 -2.838 3.514 147 HA TRP 19 HA TRP 19 13.345 -1.135 3.716 148 HB2 TRP 19 HB2 TRP 19 13.515 -3.211 2.518 149 HB3 TRP 19 HB3 TRP 19 12.210 -2.776 1.422 150 HD1 TRP 19 HD1 TRP 19 12.785 -1.339 -0.703 151 HE1 TRP 19 HE1 TRP 19 14.968 -0.644 -1.831 152 HE3 TRP 19 HE3 TRP 19 16.070 -2.431 3.098 153 HZ2 TRP 19 HZ2 TRP 19 17.793 -0.960 -1.332 154 HZ3 TRP 19 HZ3 TRP 19 18.510 -2.300 2.683 155 HH2 TRP 19 HH2 TRP 19 19.367 -1.622 0.457 156 H LEU 20 H LEU 20 10.545 -1.005 1.445 157 HA LEU 20 HA LEU 20 11.412 1.472 0.350 158 HB2 LEU 20 HB2 LEU 20 9.220 1.644 -0.718 159 HB3 LEU 20 HB3 LEU 20 10.048 0.122 -0.957 160 HG LEU 20 HG LEU 20 8.525 -0.569 1.152 161 HD11 LEU 20 HD11 LEU 20 7.395 1.616 1.350 162 HD12 LEU 20 HD12 LEU 20 6.801 1.454 -0.308 163 HD13 LEU 20 HD13 LEU 20 6.262 0.322 0.961 164 HD21 LEU 20 HD21 LEU 20 8.671 -1.741 -0.966 165 HD22 LEU 20 HD22 LEU 20 7.018 -1.650 -0.392 166 HD23 LEU 20 HD23 LEU 20 7.568 -0.572 -1.718 167 H ILE 21 H ILE 21 9.391 0.831 3.202 168 HA ILE 21 HA ILE 21 8.490 3.512 3.615 169 HB ILE 21 HB ILE 21 8.859 1.039 5.311 170 HG12 ILE 21 HG12 ILE 21 6.383 2.748 4.825 171 HG13 ILE 21 HG13 ILE 21 6.847 1.416 3.787 172 HG21 ILE 21 HG21 ILE 21 9.527 2.834 6.870 173 HG22 ILE 21 HG22 ILE 21 8.012 3.688 6.521 174 HG23 ILE 21 HG23 ILE 21 8.042 2.089 7.321 175 HD11 ILE 21 HD11 ILE 21 6.681 -0.094 5.837 176 HD12 ILE 21 HD12 ILE 21 5.991 1.302 6.693 177 HD13 ILE 21 HD13 ILE 21 5.154 0.654 5.298 178 H GLU 22 H GLU 22 11.326 1.710 4.840 179 HA GLU 22 HA GLU 22 12.446 3.801 6.381 180 HB2 GLU 22 HB2 GLU 22 12.953 1.465 6.745 181 HB3 GLU 22 HB3 GLU 22 13.602 1.276 5.110 182 HG2 GLU 22 HG2 GLU 22 15.540 2.558 5.584 183 HG3 GLU 22 HG3 GLU 22 14.805 3.288 7.017 184 H ASN 23 H ASN 23 12.994 2.785 3.015 185 HA ASN 23 HA ASN 23 15.238 4.449 2.559 186 HB2 ASN 23 HB2 ASN 23 15.243 3.528 0.639 187 HB3 ASN 23 HB3 ASN 23 13.863 2.550 1.036 188 HD21 ASN 23 HD21 ASN 23 11.639 3.614 0.262 189 HD22 ASN 23 HD22 ASN 23 11.843 4.608 -1.177 190 H PHE 24 H PHE 24 11.896 5.050 2.017 191 HA PHE 24 HA PHE 24 12.460 7.933 1.390 192 HB2 PHE 24 HB2 PHE 24 10.228 6.164 0.481 193 HB3 PHE 24 HB3 PHE 24 9.920 7.883 0.653 194 HD1 PHE 24 HD1 PHE 24 12.108 9.396 -0.242 195 HD2 PHE 24 HD2 PHE 24 10.601 5.687 -1.840 196 HE1 PHE 24 HE1 PHE 24 13.097 9.927 -2.409 197 HE2 PHE 24 HE2 PHE 24 11.662 6.212 -4.023 198 HZ PHE 24 HZ PHE 24 12.892 8.344 -4.308 199 HA PRO 25 HA PRO 25 10.687 8.207 5.599 200 HB2 PRO 25 HB2 PRO 25 12.466 9.946 6.717 201 HB3 PRO 25 HB3 PRO 25 12.857 8.222 6.472 202 HG2 PRO 25 HG2 PRO 25 13.499 10.544 4.600 203 HG3 PRO 25 HG3 PRO 25 14.650 9.360 5.304 204 HD2 PRO 25 HD2 PRO 25 13.624 8.974 2.858 205 HD3 PRO 25 HD3 PRO 25 13.785 7.606 4.010 206 H ASN 26 H ASN 26 10.432 10.057 2.850 207 HA ASN 26 HA ASN 26 9.918 12.657 4.065 208 HB2 ASN 26 HB2 ASN 26 9.400 11.503 1.304 209 HB3 ASN 26 HB3 ASN 26 8.878 13.106 1.783 210 HD21 ASN 26 HD21 ASN 26 11.918 11.150 1.399 211 HD22 ASN 26 HD22 ASN 26 12.905 12.552 1.130 212 H ALA 27 H ALA 27 8.107 9.668 3.492 213 HA ALA 27 HA ALA 27 5.824 10.483 4.994 214 HB1 ALA 27 HB1 ALA 27 4.255 10.353 2.970 215 HB2 ALA 27 HB2 ALA 27 5.248 11.826 3.025 216 HB3 ALA 27 HB3 ALA 27 5.709 10.509 1.934 217 H PHE 28 H PHE 28 5.437 8.458 5.848 218 HA PHE 28 HA PHE 28 4.418 6.311 4.448 219 HB2 PHE 28 HB2 PHE 28 7.369 6.219 4.754 220 HB3 PHE 28 HB3 PHE 28 6.534 4.815 5.366 221 HD1 PHE 28 HD1 PHE 28 4.508 3.963 3.656 222 HD2 PHE 28 HD2 PHE 28 8.125 6.030 2.541 223 HE1 PHE 28 HE1 PHE 28 4.317 3.065 1.366 224 HE2 PHE 28 HE2 PHE 28 7.924 5.161 0.253 225 HZ PHE 28 HZ PHE 28 6.022 3.709 -0.371 226 H PHE 29 H PHE 29 4.187 4.351 6.106 227 HA PHE 29 HA PHE 29 4.471 5.047 8.914 228 HB2 PHE 29 HB2 PHE 29 1.726 4.710 7.656 229 HB3 PHE 29 HB3 PHE 29 2.052 4.632 9.385 230 HD1 PHE 29 HD1 PHE 29 1.483 6.835 6.528 231 HD2 PHE 29 HD2 PHE 29 2.998 6.704 10.561 232 HE1 PHE 29 HE1 PHE 29 1.311 9.300 6.681 233 HE2 PHE 29 HE2 PHE 29 2.672 9.160 10.761 234 HZ PHE 29 HZ PHE 29 1.818 10.462 8.824 235 H LYS 30 H LYS 30 4.476 3.111 10.138 236 HA LYS 30 HA LYS 30 4.266 0.632 8.527 237 HB2 LYS 30 HB2 LYS 30 5.520 0.930 11.279 238 HB3 LYS 30 HB3 LYS 30 5.600 -0.441 10.191 239 HG2 LYS 30 HG2 LYS 30 7.399 0.417 9.152 240 HG3 LYS 30 HG3 LYS 30 6.478 1.836 8.711 241 HD2 LYS 30 HD2 LYS 30 8.318 2.706 9.760 242 HD3 LYS 30 HD3 LYS 30 7.048 2.853 10.976 243 HE2 LYS 30 HE2 LYS 30 8.018 1.183 12.331 244 HE3 LYS 30 HE3 LYS 30 8.653 0.322 10.906 245 HZ1 LYS 30 HZ1 LYS 30 10.410 1.325 12.238 246 HZ2 LYS 30 HZ2 LYS 30 10.379 1.862 10.686 247 HZ3 LYS 30 HZ3 LYS 30 9.855 2.826 11.907 248 H LYS 31 H LYS 31 3.135 1.889 11.769 249 HA LYS 31 HA LYS 31 1.453 -0.468 12.091 250 HB2 LYS 31 HB2 LYS 31 1.939 2.096 13.587 251 HB3 LYS 31 HB3 LYS 31 0.447 1.224 13.911 252 HG2 LYS 31 HG2 LYS 31 3.127 -0.183 14.001 253 HG3 LYS 31 HG3 LYS 31 2.510 0.752 15.371 254 HD2 LYS 31 HD2 LYS 31 0.488 -0.634 15.485 255 HD3 LYS 31 HD3 LYS 31 1.047 -1.601 14.104 256 HE2 LYS 31 HE2 LYS 31 3.066 -2.243 15.347 257 HE3 LYS 31 HE3 LYS 31 2.609 -1.186 16.688 258 HZ1 LYS 31 HZ1 LYS 31 1.252 -3.677 15.869 259 HZ2 LYS 31 HZ2 LYS 31 2.064 -3.372 17.245 260 HZ3 LYS 31 HZ3 LYS 31 0.628 -2.617 16.973 261 H GLY 32 H GLY 32 -0.649 -0.750 11.620 262 HA2 GLY 32 HA2 GLY 32 -1.989 0.812 9.702 263 HA3 GLY 32 HA3 GLY 32 -2.722 -0.407 10.752 264 H ASN 33 H ASN 33 -1.954 0.958 13.256 265 HA ASN 33 HA ASN 33 -4.211 2.656 13.604 266 HB2 ASN 33 HB2 ASN 33 -3.332 3.164 15.815 267 HB3 ASN 33 HB3 ASN 33 -3.254 1.449 15.469 268 HD21 ASN 33 HD21 ASN 33 -0.917 4.223 14.783 269 HD22 ASN 33 HD22 ASN 33 0.411 3.468 15.583 270 H GLN 34 H GLN 34 -1.075 3.512 12.293 271 HA GLN 34 HA GLN 34 -1.765 6.385 12.552 272 HB2 GLN 34 HB2 GLN 34 0.627 6.921 12.627 273 HB3 GLN 34 HB3 GLN 34 0.061 6.006 14.014 274 HG2 GLN 34 HG2 GLN 34 0.989 3.924 12.658 275 HG3 GLN 34 HG3 GLN 34 1.926 5.131 11.800 276 HE21 GLN 34 HE21 GLN 34 3.968 5.612 12.833 277 HE22 GLN 34 HE22 GLN 34 4.271 5.200 14.500 278 H VAL 35 H VAL 35 -1.799 3.909 10.430 279 HA VAL 35 HA VAL 35 -0.383 5.018 8.227 280 HB VAL 35 HB VAL 35 -1.189 2.608 8.668 281 HG11 VAL 35 HG11 VAL 35 -3.553 3.394 6.950 282 HG12 VAL 35 HG12 VAL 35 -3.237 1.855 7.799 283 HG13 VAL 35 HG13 VAL 35 -3.683 3.309 8.705 284 HG21 VAL 35 HG21 VAL 35 -1.141 1.987 6.311 285 HG22 VAL 35 HG22 VAL 35 -1.379 3.678 5.831 286 HG23 VAL 35 HG23 VAL 35 0.099 3.187 6.687 287 H LYS 36 H LYS 36 -1.117 5.985 6.304 288 HA LYS 36 HA LYS 36 -3.727 7.356 6.216 289 HB2 LYS 36 HB2 LYS 36 -0.928 8.554 6.247 290 HB3 LYS 36 HB3 LYS 36 -2.150 9.287 5.229 291 HG2 LYS 36 HG2 LYS 36 -3.606 9.715 7.124 292 HG3 LYS 36 HG3 LYS 36 -2.458 8.931 8.235 293 HD2 LYS 36 HD2 LYS 36 -0.751 10.572 7.751 294 HD3 LYS 36 HD3 LYS 36 -1.697 11.302 6.454 295 HE2 LYS 36 HE2 LYS 36 -2.705 11.238 9.325 296 HE3 LYS 36 HE3 LYS 36 -1.577 12.465 8.753 297 HZ1 LYS 36 HZ1 LYS 36 -4.301 12.005 7.723 298 HZ2 LYS 36 HZ2 LYS 36 -3.745 13.296 8.567 299 HZ3 LYS 36 HZ3 LYS 36 -3.221 13.049 7.025 300 HA PRO 37 HA PRO 37 -3.154 6.002 2.007 301 HB2 PRO 37 HB2 PRO 37 -4.561 7.801 0.514 302 HB3 PRO 37 HB3 PRO 37 -5.358 6.657 1.634 303 HG2 PRO 37 HG2 PRO 37 -4.620 9.556 2.135 304 HG3 PRO 37 HG3 PRO 37 -6.187 8.751 2.460 305 HD2 PRO 37 HD2 PRO 37 -4.289 9.125 4.394 306 HD3 PRO 37 HD3 PRO 37 -5.328 7.668 4.370 307 H LEU 38 H LEU 38 -1.938 6.452 0.131 308 HA LEU 38 HA LEU 38 -0.124 8.824 0.199 309 HB2 LEU 38 HB2 LEU 38 0.378 5.942 -0.599 310 HB3 LEU 38 HB3 LEU 38 1.483 7.236 -0.994 311 HG LEU 38 HG LEU 38 0.635 6.955 1.907 312 HD11 LEU 38 HD11 LEU 38 1.103 4.668 1.387 313 HD12 LEU 38 HD12 LEU 38 2.599 5.121 0.531 314 HD13 LEU 38 HD13 LEU 38 2.502 5.334 2.282 315 HD21 LEU 38 HD21 LEU 38 3.342 7.623 0.679 316 HD22 LEU 38 HD22 LEU 38 2.128 8.826 1.144 317 HD23 LEU 38 HD23 LEU 38 2.860 7.788 2.374 318 H LYS 39 H LYS 39 0.813 9.230 -2.088 319 HA LYS 39 HA LYS 39 -1.304 9.963 -3.804 320 HB2 LYS 39 HB2 LYS 39 0.907 11.011 -3.814 321 HB3 LYS 39 HB3 LYS 39 1.659 9.490 -4.303 322 HG2 LYS 39 HG2 LYS 39 0.544 9.582 -6.479 323 HG3 LYS 39 HG3 LYS 39 -0.327 11.061 -6.023 324 HD2 LYS 39 HD2 LYS 39 1.794 12.251 -5.858 325 HD3 LYS 39 HD3 LYS 39 2.663 10.730 -5.975 326 HE2 LYS 39 HE2 LYS 39 1.848 10.408 -8.284 327 HE3 LYS 39 HE3 LYS 39 1.119 12.027 -8.238 328 HZ1 LYS 39 HZ1 LYS 39 3.388 11.894 -9.222 329 HZ2 LYS 39 HZ2 LYS 39 3.287 12.972 -7.984 330 HZ3 LYS 39 HZ3 LYS 39 3.997 11.522 -7.747 331 H ILE 40 H ILE 40 -2.040 9.083 -5.819 332 HA ILE 40 HA ILE 40 -2.235 6.246 -5.939 333 HB ILE 40 HB ILE 40 -3.981 7.767 -6.559 334 HG12 ILE 40 HG12 ILE 40 -3.433 6.524 -9.229 335 HG13 ILE 40 HG13 ILE 40 -3.359 5.439 -7.840 336 HG21 ILE 40 HG21 ILE 40 -3.965 9.104 -8.629 337 HG22 ILE 40 HG22 ILE 40 -2.715 9.671 -7.504 338 HG23 ILE 40 HG23 ILE 40 -2.271 8.676 -8.897 339 HD11 ILE 40 HD11 ILE 40 -5.558 6.113 -7.082 340 HD12 ILE 40 HD12 ILE 40 -5.699 7.283 -8.418 341 HD13 ILE 40 HD13 ILE 40 -5.640 5.537 -8.763 342 H GLY 41 H GLY 41 -1.021 4.798 -7.167 343 HA2 GLY 41 HA2 GLY 41 0.612 4.018 -8.597 344 HA3 GLY 41 HA3 GLY 41 0.656 5.609 -9.350 345 H ILE 42 H ILE 42 1.251 5.730 -5.938 346 HA ILE 42 HA ILE 42 3.765 6.885 -6.056 347 HB ILE 42 HB ILE 42 2.332 7.088 -4.219 348 HG12 ILE 42 HG12 ILE 42 4.990 5.919 -3.354 349 HG13 ILE 42 HG13 ILE 42 4.762 7.495 -4.096 350 HG21 ILE 42 HG21 ILE 42 1.369 4.857 -4.040 351 HG22 ILE 42 HG22 ILE 42 2.940 4.175 -3.591 352 HG23 ILE 42 HG23 ILE 42 2.096 5.303 -2.504 353 HD11 ILE 42 HD11 ILE 42 4.966 7.769 -1.723 354 HD12 ILE 42 HD12 ILE 42 3.298 8.155 -2.189 355 HD13 ILE 42 HD13 ILE 42 3.685 6.588 -1.416 356 H PHE 43 H PHE 43 3.081 3.360 -6.352 357 HA PHE 43 HA PHE 43 5.797 2.546 -5.626 358 HB2 PHE 43 HB2 PHE 43 4.418 0.715 -5.397 359 HB3 PHE 43 HB3 PHE 43 3.382 1.184 -6.739 360 HD1 PHE 43 HD1 PHE 43 3.832 0.572 -9.008 361 HD2 PHE 43 HD2 PHE 43 6.641 -0.652 -5.918 362 HE1 PHE 43 HE1 PHE 43 4.980 -0.916 -10.606 363 HE2 PHE 43 HE2 PHE 43 7.756 -2.091 -7.553 364 HZ PHE 43 HZ PHE 43 6.947 -2.251 -9.879 365 H ASP 44 H ASP 44 4.069 3.454 -8.649 366 HA ASP 44 HA ASP 44 6.164 2.516 -10.380 367 HB2 ASP 44 HB2 ASP 44 3.886 4.498 -10.772 368 HB3 ASP 44 HB3 ASP 44 5.090 4.160 -12.031 369 H ASP 45 H ASP 45 5.771 5.420 -8.460 370 HA ASP 45 HA ASP 45 7.956 6.823 -9.838 371 HB2 ASP 45 HB2 ASP 45 6.299 7.432 -7.368 372 HB3 ASP 45 HB3 ASP 45 7.764 8.338 -7.762 373 H LEU 46 H LEU 46 7.433 5.075 -6.790 374 HA LEU 46 HA LEU 46 9.970 5.389 -5.621 375 HB2 LEU 46 HB2 LEU 46 7.815 4.797 -4.500 376 HB3 LEU 46 HB3 LEU 46 7.905 3.183 -5.182 377 HG LEU 46 HG LEU 46 10.309 4.155 -3.653 378 HD11 LEU 46 HD11 LEU 46 9.416 3.742 -1.490 379 HD12 LEU 46 HD12 LEU 46 8.303 4.868 -2.257 380 HD13 LEU 46 HD13 LEU 46 7.879 3.151 -2.116 381 HD21 LEU 46 HD21 LEU 46 10.106 1.812 -4.638 382 HD22 LEU 46 HD22 LEU 46 10.464 1.886 -2.918 383 HD23 LEU 46 HD23 LEU 46 8.815 1.496 -3.483 384 H ILE 47 H ILE 47 8.772 2.879 -7.877 385 HA ILE 47 HA ILE 47 10.815 0.996 -7.350 386 HB ILE 47 HB ILE 47 8.659 0.705 -8.643 387 HG12 ILE 47 HG12 ILE 47 10.731 -0.927 -8.533 388 HG13 ILE 47 HG13 ILE 47 9.298 -1.251 -9.489 389 HG21 ILE 47 HG21 ILE 47 8.719 1.063 -11.081 390 HG22 ILE 47 HG22 ILE 47 8.876 2.560 -10.151 391 HG23 ILE 47 HG23 ILE 47 10.306 1.892 -10.933 392 HD11 ILE 47 HD11 ILE 47 11.422 -1.768 -10.651 393 HD12 ILE 47 HD12 ILE 47 10.368 -0.664 -11.544 394 HD13 ILE 47 HD13 ILE 47 11.801 -0.042 -10.699 395 H ASP 48 H ASP 48 10.895 4.094 -9.001 396 HA ASP 48 HA ASP 48 13.054 3.650 -10.759 397 HB2 ASP 48 HB2 ASP 48 11.770 5.762 -10.655 398 HB3 ASP 48 HB3 ASP 48 12.420 6.120 -9.058 399 H PHE 49 H PHE 49 12.848 4.447 -7.426 400 HA PHE 49 HA PHE 49 15.590 4.710 -6.703 401 HB2 PHE 49 HB2 PHE 49 13.223 5.311 -5.507 402 HB3 PHE 49 HB3 PHE 49 13.607 3.893 -4.573 403 HD1 PHE 49 HD1 PHE 49 14.500 7.327 -5.549 404 HD2 PHE 49 HD2 PHE 49 15.776 3.973 -3.159 405 HE1 PHE 49 HE1 PHE 49 15.964 8.821 -4.239 406 HE2 PHE 49 HE2 PHE 49 17.262 5.469 -1.863 407 HZ PHE 49 HZ PHE 49 17.314 7.913 -2.356 408 H TYR 50 H TYR 50 13.535 1.906 -7.077 409 HA TYR 50 HA TYR 50 15.152 0.012 -5.555 410 HB2 TYR 50 HB2 TYR 50 12.948 -0.665 -5.681 411 HB3 TYR 50 HB3 TYR 50 12.726 -0.140 -7.319 412 HD1 TYR 50 HD1 TYR 50 13.596 -2.950 -5.201 413 HD2 TYR 50 HD2 TYR 50 13.789 -1.408 -9.224 414 HE1 TYR 50 HE1 TYR 50 14.021 -5.207 -6.063 415 HE2 TYR 50 HE2 TYR 50 14.402 -3.617 -10.058 416 HH TYR 50 HH TYR 50 14.720 -5.819 -9.568 417 H GLU 51 H GLU 51 14.855 1.218 -8.915 418 HA GLU 51 HA GLU 51 16.582 -0.727 -10.073 419 HB2 GLU 51 HB2 GLU 51 15.822 2.024 -11.057 420 HB3 GLU 51 HB3 GLU 51 16.778 0.873 -11.989 421 HG2 GLU 51 HG2 GLU 51 14.169 0.036 -10.784 422 HG3 GLU 51 HG3 GLU 51 14.158 0.968 -12.289 423 H ARG 52 H ARG 52 17.155 2.015 -8.079 424 HA ARG 52 HA ARG 52 19.854 2.654 -8.966 425 HB2 ARG 52 HB2 ARG 52 17.944 3.916 -7.340 426 HB3 ARG 52 HB3 ARG 52 19.079 3.303 -6.150 427 HG2 ARG 52 HG2 ARG 52 20.046 5.350 -6.600 428 HG3 ARG 52 HG3 ARG 52 20.899 4.375 -7.802 429 HD2 ARG 52 HD2 ARG 52 19.044 4.973 -9.445 430 HD3 ARG 52 HD3 ARG 52 18.399 6.096 -8.242 431 HE ARG 52 HE ARG 52 20.671 6.378 -9.985 432 HH11 ARG 52 HH11 ARG 52 19.438 7.582 -6.801 433 HH12 ARG 52 HH12 ARG 52 20.139 9.143 -7.022 434 HH21 ARG 52 HH21 ARG 52 21.709 8.369 -10.105 435 HH22 ARG 52 HH22 ARG 52 21.628 9.536 -8.831 436 H LEU 53 H LEU 53 18.425 0.294 -6.724 437 HA LEU 53 HA LEU 53 20.604 -0.110 -5.024 438 HB2 LEU 53 HB2 LEU 53 18.555 -2.168 -5.925 439 HB3 LEU 53 HB3 LEU 53 19.489 -2.171 -4.428 440 HG LEU 53 HG LEU 53 17.309 -0.188 -5.196 441 HD11 LEU 53 HD11 LEU 53 16.485 -2.396 -4.622 442 HD12 LEU 53 HD12 LEU 53 17.385 -2.364 -3.090 443 HD13 LEU 53 HD13 LEU 53 16.051 -1.215 -3.389 444 HD21 LEU 53 HD21 LEU 53 18.819 1.131 -4.038 445 HD22 LEU 53 HD22 LEU 53 17.578 0.690 -2.879 446 HD23 LEU 53 HD23 LEU 53 19.164 -0.138 -2.839 447 H ASP 54 H ASP 54 22.444 -1.093 -5.209 448 HA ASP 54 HA ASP 54 23.408 -2.210 -7.693 449 HB2 ASP 54 HB2 ASP 54 24.849 -0.987 -6.144 450 HB3 ASP 54 HB3 ASP 54 24.492 -2.126 -4.843 451 H THR 55 H THR 55 21.912 -3.521 -4.804 452 HA THR 55 HA THR 55 21.885 -6.251 -5.933 453 HB THR 55 HB THR 55 22.423 -6.977 -3.436 454 HG1 THR 55 HG1 THR 55 24.248 -4.886 -3.625 455 HG21 THR 55 HG21 THR 55 24.753 -7.320 -4.006 456 HG22 THR 55 HG22 THR 55 23.737 -7.658 -5.418 457 HG23 THR 55 HG23 THR 55 24.654 -6.142 -5.328 458 HA PRO 56 HA PRO 56 17.809 -4.993 -4.247 459 HB2 PRO 56 HB2 PRO 56 16.327 -6.070 -6.274 460 HB3 PRO 56 HB3 PRO 56 17.035 -4.422 -6.347 461 HG2 PRO 56 HG2 PRO 56 18.048 -7.005 -7.560 462 HG3 PRO 56 HG3 PRO 56 17.968 -5.380 -8.310 463 HD2 PRO 56 HD2 PRO 56 20.242 -6.420 -7.203 464 HD3 PRO 56 HD3 PRO 56 19.877 -4.667 -7.148 465 HA PRO 57 HA PRO 57 17.863 -9.295 -2.740 466 HB2 PRO 57 HB2 PRO 57 15.932 -9.139 -0.776 467 HB3 PRO 57 HB3 PRO 57 17.606 -8.537 -0.598 468 HG2 PRO 57 HG2 PRO 57 15.121 -6.952 -1.243 469 HG3 PRO 57 HG3 PRO 57 16.466 -6.541 -0.144 470 HD2 PRO 57 HD2 PRO 57 16.223 -5.573 -2.719 471 HD3 PRO 57 HD3 PRO 57 17.799 -5.811 -1.908 472 H PHE 58 H PHE 58 14.572 -7.815 -3.025 473 HA PHE 58 HA PHE 58 13.482 -10.300 -4.273 474 HB2 PHE 58 HB2 PHE 58 12.171 -7.758 -3.186 475 HB3 PHE 58 HB3 PHE 58 11.300 -9.056 -3.958 476 HD1 PHE 58 HD1 PHE 58 10.333 -10.772 -2.693 477 HD2 PHE 58 HD2 PHE 58 13.420 -8.305 -0.955 478 HE1 PHE 58 HE1 PHE 58 9.730 -11.579 -0.440 479 HE2 PHE 58 HE2 PHE 58 12.860 -9.139 1.258 480 HZ PHE 58 HZ PHE 58 10.953 -10.743 1.558 481 H SER 59 H SER 59 11.987 -9.876 -6.170 482 HA SER 59 HA SER 59 13.131 -7.905 -8.026 483 HB2 SER 59 HB2 SER 59 10.886 -9.835 -8.526 484 HB3 SER 59 HB3 SER 59 12.023 -9.132 -9.701 485 HG SER 59 HG SER 59 12.759 -11.183 -9.333 486 H LYS 60 H LYS 60 11.929 -6.354 -9.059 487 HA LYS 60 HA LYS 60 10.283 -4.598 -7.735 488 HB2 LYS 60 HB2 LYS 60 9.762 -3.691 -10.006 489 HB3 LYS 60 HB3 LYS 60 11.462 -3.960 -9.645 490 HG2 LYS 60 HG2 LYS 60 11.261 -6.188 -10.950 491 HG3 LYS 60 HG3 LYS 60 9.666 -5.638 -11.439 492 HD2 LYS 60 HD2 LYS 60 11.403 -5.322 -13.131 493 HD3 LYS 60 HD3 LYS 60 10.672 -3.766 -12.670 494 HE2 LYS 60 HE2 LYS 60 12.597 -3.109 -11.440 495 HE3 LYS 60 HE3 LYS 60 13.183 -4.762 -11.326 496 HZ1 LYS 60 HZ1 LYS 60 13.956 -4.669 -13.519 497 HZ2 LYS 60 HZ2 LYS 60 13.127 -3.272 -13.876 498 HZ3 LYS 60 HZ3 LYS 60 14.378 -3.236 -12.842 499 H LYS 61 H LYS 61 8.892 -7.391 -9.687 500 HA LYS 61 HA LYS 61 6.266 -6.290 -9.445 501 HB2 LYS 61 HB2 LYS 61 7.197 -8.251 -10.936 502 HB3 LYS 61 HB3 LYS 61 6.731 -9.281 -9.587 503 HG2 LYS 61 HG2 LYS 61 4.968 -7.473 -11.303 504 HG3 LYS 61 HG3 LYS 61 5.030 -9.239 -11.303 505 HD2 LYS 61 HD2 LYS 61 4.245 -9.144 -8.870 506 HD3 LYS 61 HD3 LYS 61 3.919 -7.408 -9.154 507 HE2 LYS 61 HE2 LYS 61 2.413 -7.969 -11.002 508 HE3 LYS 61 HE3 LYS 61 2.745 -9.696 -10.757 509 HZ1 LYS 61 HZ1 LYS 61 0.743 -9.109 -9.638 510 HZ2 LYS 61 HZ2 LYS 61 1.867 -9.452 -8.499 511 HZ3 LYS 61 HZ3 LYS 61 1.466 -7.871 -8.818 512 H SER 62 H SER 62 8.100 -8.590 -7.309 513 HA SER 62 HA SER 62 5.986 -9.097 -5.511 514 HB2 SER 62 HB2 SER 62 8.975 -8.991 -4.927 515 HB3 SER 62 HB3 SER 62 7.733 -9.821 -3.967 516 HG SER 62 HG SER 62 8.665 -11.328 -5.343 517 H LEU 63 H LEU 63 8.271 -6.388 -5.729 518 HA LEU 63 HA LEU 63 7.883 -5.129 -3.270 519 HB2 LEU 63 HB2 LEU 63 9.428 -4.568 -5.371 520 HB3 LEU 63 HB3 LEU 63 8.071 -3.571 -5.865 521 HG LEU 63 HG LEU 63 8.278 -2.587 -3.399 522 HD11 LEU 63 HD11 LEU 63 11.155 -3.378 -3.951 523 HD12 LEU 63 HD12 LEU 63 10.469 -2.633 -2.498 524 HD13 LEU 63 HD13 LEU 63 10.106 -4.329 -2.896 525 HD21 LEU 63 HD21 LEU 63 9.862 -0.866 -4.252 526 HD22 LEU 63 HD22 LEU 63 10.287 -1.901 -5.623 527 HD23 LEU 63 HD23 LEU 63 8.655 -1.239 -5.480 528 H ARG 64 H ARG 64 6.080 -4.582 -6.342 529 HA ARG 64 HA ARG 64 4.156 -2.845 -5.156 530 HB2 ARG 64 HB2 ARG 64 4.660 -2.892 -7.582 531 HB3 ARG 64 HB3 ARG 64 3.993 -4.506 -7.727 532 HG2 ARG 64 HG2 ARG 64 2.542 -2.638 -8.545 533 HG3 ARG 64 HG3 ARG 64 1.754 -3.711 -7.384 534 HD2 ARG 64 HD2 ARG 64 1.825 -2.092 -5.648 535 HD3 ARG 64 HD3 ARG 64 3.072 -1.161 -6.451 536 HE ARG 64 HE ARG 64 1.477 -0.400 -8.097 537 HH11 ARG 64 HH11 ARG 64 0.017 -1.639 -5.073 538 HH12 ARG 64 HH12 ARG 64 -1.444 -0.728 -5.348 539 HH21 ARG 64 HH21 ARG 64 -0.366 0.698 -8.352 540 HH22 ARG 64 HH22 ARG 64 -1.712 0.567 -7.228 541 H GLU 65 H GLU 65 4.046 -6.361 -5.843 542 HA GLU 65 HA GLU 65 1.320 -6.736 -5.258 543 HB2 GLU 65 HB2 GLU 65 2.812 -8.408 -6.324 544 HB3 GLU 65 HB3 GLU 65 3.657 -8.644 -4.793 545 HG2 GLU 65 HG2 GLU 65 2.008 -10.428 -5.175 546 HG3 GLU 65 HG3 GLU 65 1.615 -9.495 -3.749 547 H ALA 66 H ALA 66 4.165 -6.869 -3.036 548 HA ALA 66 HA ALA 66 2.609 -7.358 -0.682 549 HB1 ALA 66 HB1 ALA 66 5.289 -6.005 -1.044 550 HB2 ALA 66 HB2 ALA 66 4.678 -6.678 0.483 551 HB3 ALA 66 HB3 ALA 66 5.057 -7.765 -0.873 552 H LEU 67 H LEU 67 3.689 -4.315 -2.274 553 HA LEU 67 HA LEU 67 2.847 -2.564 -0.219 554 HB2 LEU 67 HB2 LEU 67 3.807 -2.372 -2.889 555 HB3 LEU 67 HB3 LEU 67 2.451 -1.278 -2.751 556 HG LEU 67 HG LEU 67 4.879 -1.364 -0.902 557 HD11 LEU 67 HD11 LEU 67 5.524 0.739 -2.075 558 HD12 LEU 67 HD12 LEU 67 5.411 -0.604 -3.220 559 HD13 LEU 67 HD13 LEU 67 4.107 0.606 -3.119 560 HD21 LEU 67 HD21 LEU 67 2.590 0.634 -1.073 561 HD22 LEU 67 HD22 LEU 67 2.948 -0.464 0.286 562 HD23 LEU 67 HD23 LEU 67 4.061 0.842 -0.104 563 H SER 68 H SER 68 0.959 -4.294 -2.602 564 HA SER 68 HA SER 68 -1.440 -2.692 -2.418 565 HB2 SER 68 HB2 SER 68 -0.575 -4.394 -4.242 566 HB3 SER 68 HB3 SER 68 -1.279 -5.634 -3.192 567 HG SER 68 HG SER 68 -3.277 -4.672 -3.450 568 H TYR 69 H TYR 69 -0.014 -5.450 -0.756 569 HA TYR 69 HA TYR 69 -2.215 -6.427 0.717 570 HB2 TYR 69 HB2 TYR 69 0.337 -7.214 0.278 571 HB3 TYR 69 HB3 TYR 69 0.565 -6.494 1.866 572 HD1 TYR 69 HD1 TYR 69 -0.166 -7.695 3.840 573 HD2 TYR 69 HD2 TYR 69 -1.383 -8.930 -0.092 574 HE1 TYR 69 HE1 TYR 69 -0.999 -9.811 4.788 575 HE2 TYR 69 HE2 TYR 69 -2.219 -11.098 0.837 576 HH TYR 69 HH TYR 69 -2.387 -12.446 2.762 577 H TYR 70 H TYR 70 0.178 -3.862 1.394 578 HA TYR 70 HA TYR 70 -0.695 -3.410 4.084 579 HB2 TYR 70 HB2 TYR 70 1.341 -2.302 2.387 580 HB3 TYR 70 HB3 TYR 70 0.368 -0.964 2.977 581 HD1 TYR 70 HD1 TYR 70 1.468 -4.260 4.455 582 HD2 TYR 70 HD2 TYR 70 1.333 0.040 4.906 583 HE1 TYR 70 HE1 TYR 70 2.484 -4.450 6.684 584 HE2 TYR 70 HE2 TYR 70 2.387 -0.158 7.115 585 HH TYR 70 HH TYR 70 2.988 -1.676 8.818 586 H SER 71 H SER 71 -1.541 -1.748 1.036 587 HA SER 71 HA SER 71 -3.460 -0.025 2.319 588 HB2 SER 71 HB2 SER 71 -4.347 0.203 -0.107 589 HB3 SER 71 HB3 SER 71 -2.775 0.851 0.363 590 HG SER 71 HG SER 71 -3.374 -1.357 -1.260 591 H ALA 72 H ALA 72 -3.637 -3.385 1.932 592 HA ALA 72 HA ALA 72 -6.605 -3.381 1.770 593 HB1 ALA 72 HB1 ALA 72 -4.637 -5.711 1.752 594 HB2 ALA 72 HB2 ALA 72 -6.379 -5.769 1.441 595 HB3 ALA 72 HB3 ALA 72 -5.311 -4.934 0.302 596 H SER 73 H SER 73 -4.260 -2.905 4.076 597 HA SER 73 HA SER 73 -4.944 -4.711 6.178 598 HB2 SER 73 HB2 SER 73 -3.969 -1.826 6.389 599 HB3 SER 73 HB3 SER 73 -3.969 -3.002 7.708 600 HG SER 73 HG SER 73 -2.508 -2.999 5.312 601 HA PRO 74 HA PRO 74 -8.951 -3.326 7.419 602 HB2 PRO 74 HB2 PRO 74 -8.931 -3.594 10.173 603 HB3 PRO 74 HB3 PRO 74 -9.103 -4.959 9.031 604 HG2 PRO 74 HG2 PRO 74 -6.653 -3.965 10.459 605 HG3 PRO 74 HG3 PRO 74 -7.179 -5.663 10.197 606 HD2 PRO 74 HD2 PRO 74 -5.253 -4.474 8.674 607 HD3 PRO 74 HD3 PRO 74 -6.404 -5.651 7.967 608 H ALA 75 H ALA 75 -6.489 -2.072 9.725 609 HA ALA 75 HA ALA 75 -7.818 0.255 10.418 610 HB1 ALA 75 HB1 ALA 75 -5.682 1.027 11.228 611 HB2 ALA 75 HB2 ALA 75 -5.831 -0.711 11.539 612 HB3 ALA 75 HB3 ALA 75 -4.822 -0.139 10.186 613 H TYR 76 H TYR 76 -5.696 -0.272 7.553 614 HA TYR 76 HA TYR 76 -5.578 2.509 6.828 615 HB2 TYR 76 HB2 TYR 76 -3.985 0.988 5.796 616 HB3 TYR 76 HB3 TYR 76 -5.267 -0.067 5.235 617 HD1 TYR 76 HD1 TYR 76 -3.220 2.869 4.324 618 HD2 TYR 76 HD2 TYR 76 -6.821 0.648 3.409 619 HE1 TYR 76 HE1 TYR 76 -3.253 3.825 2.066 620 HE2 TYR 76 HE2 TYR 76 -6.913 1.677 1.210 621 HH TYR 76 HH TYR 76 -5.912 3.035 -0.278 622 H LEU 77 H LEU 77 -7.883 -0.098 5.941 623 HA LEU 77 HA LEU 77 -9.378 1.623 4.175 624 HB2 LEU 77 HB2 LEU 77 -10.285 -0.912 5.626 625 HB3 LEU 77 HB3 LEU 77 -11.101 -0.140 4.290 626 HG LEU 77 HG LEU 77 -8.224 -1.093 4.007 627 HD11 LEU 77 HD11 LEU 77 -10.717 -2.667 3.403 628 HD12 LEU 77 HD12 LEU 77 -9.015 -3.161 3.126 629 HD13 LEU 77 HD13 LEU 77 -9.625 -2.927 4.783 630 HD21 LEU 77 HD21 LEU 77 -8.944 0.484 2.308 631 HD22 LEU 77 HD22 LEU 77 -8.803 -1.146 1.616 632 HD23 LEU 77 HD23 LEU 77 -10.409 -0.452 2.009 633 H SER 78 H SER 78 -9.800 0.546 7.502 634 HA SER 78 HA SER 78 -12.098 2.016 8.174 635 HB2 SER 78 HB2 SER 78 -10.737 0.156 9.407 636 HB3 SER 78 HB3 SER 78 -9.792 1.480 10.076 637 HG SER 78 HG SER 78 -12.165 2.233 10.671 638 H CYS 79 H CYS 79 -8.750 3.169 7.771 639 HA CYS 79 HA CYS 79 -9.099 5.655 9.175 640 HB2 CYS 79 HB2 CYS 79 -6.917 4.407 8.754 641 HB3 CYS 79 HB3 CYS 79 -6.995 5.002 7.078 642 HG CYS 79 HG CYS 79 -5.245 6.383 8.481 643 H GLN 80 H GLN 80 -10.673 4.695 6.442 644 HA GLN 80 HA GLN 80 -10.465 6.450 4.397 645 HB2 GLN 80 HB2 GLN 80 -12.973 6.327 4.241 646 HB3 GLN 80 HB3 GLN 80 -12.121 4.804 4.244 647 HG2 GLN 80 HG2 GLN 80 -12.987 4.131 6.303 648 HG3 GLN 80 HG3 GLN 80 -13.159 5.763 6.914 649 HE21 GLN 80 HE21 GLN 80 -14.982 3.181 5.944 650 HE22 GLN 80 HE22 GLN 80 -16.384 4.051 5.329 651 H LYS 81 H LYS 81 -9.890 8.582 4.695 652 HA LYS 81 HA LYS 81 -11.938 10.336 5.943 653 HB2 LYS 81 HB2 LYS 81 -8.973 10.354 6.559 654 HB3 LYS 81 HB3 LYS 81 -10.029 11.765 6.783 655 HG2 LYS 81 HG2 LYS 81 -11.497 10.520 8.261 656 HG3 LYS 81 HG3 LYS 81 -10.550 9.050 8.048 657 HD2 LYS 81 HD2 LYS 81 -8.565 10.302 9.039 658 HD3 LYS 81 HD3 LYS 81 -9.707 11.578 9.504 659 HE2 LYS 81 HE2 LYS 81 -9.861 8.617 10.260 660 HE3 LYS 81 HE3 LYS 81 -9.327 9.909 11.346 661 HZ1 LYS 81 HZ1 LYS 81 -12.026 9.857 10.139 662 HZ2 LYS 81 HZ2 LYS 81 -11.688 9.155 11.568 663 HZ3 LYS 81 HZ3 LYS 81 -11.513 10.794 11.378 664 HA PRO 82 HA PRO 82 -10.986 11.725 1.717 665 HB2 PRO 82 HB2 PRO 82 -13.234 13.274 1.336 666 HB3 PRO 82 HB3 PRO 82 -13.166 11.509 1.064 667 HG2 PRO 82 HG2 PRO 82 -14.183 12.992 3.480 668 HG3 PRO 82 HG3 PRO 82 -14.919 11.581 2.651 669 HD2 PRO 82 HD2 PRO 82 -13.452 11.379 4.945 670 HD3 PRO 82 HD3 PRO 82 -13.439 10.099 3.706 671 H ASP 83 H ASP 83 -10.668 14.026 0.964 672 HA ASP 83 HA ASP 83 -9.598 16.054 1.271 673 HB2 ASP 83 HB2 ASP 83 -11.744 16.860 1.843 674 HB3 ASP 83 HB3 ASP 83 -11.606 16.302 3.512 675 H THR 84 H THR 84 -7.730 14.596 1.739 676 HA THR 84 HA THR 84 -6.582 15.328 4.377 677 HB THR 84 HB THR 84 -7.498 12.887 4.082 678 HG1 THR 84 HG1 THR 84 -4.910 13.307 5.148 679 HG21 THR 84 HG21 THR 84 -6.025 11.248 3.250 680 HG22 THR 84 HG22 THR 84 -6.074 12.486 1.969 681 HG23 THR 84 HG23 THR 84 -4.681 12.394 3.052 682 H ALA 85 H ALA 85 -6.108 15.297 1.008 683 HA ALA 85 HA ALA 85 -4.369 15.813 -0.360 684 HB1 ALA 85 HB1 ALA 85 -2.877 17.600 0.339 685 HB2 ALA 85 HB2 ALA 85 -4.552 17.935 0.845 686 HB3 ALA 85 HB3 ALA 85 -3.356 17.368 2.029 687 H ARG 86 H ARG 86 -3.617 13.821 -0.698 688 HA ARG 86 HA ARG 86 -1.692 12.548 1.097 689 HB2 ARG 86 HB2 ARG 86 -2.265 11.855 -1.823 690 HB3 ARG 86 HB3 ARG 86 -1.412 10.852 -0.650 691 HG2 ARG 86 HG2 ARG 86 -3.397 9.851 -0.304 692 HG3 ARG 86 HG3 ARG 86 -3.766 11.260 0.691 693 HD2 ARG 86 HD2 ARG 86 -5.599 11.142 -0.742 694 HD3 ARG 86 HD3 ARG 86 -4.614 12.348 -1.522 695 HE ARG 86 HE ARG 86 -4.830 9.459 -2.302 696 HH11 ARG 86 HH11 ARG 86 -4.228 12.859 -3.415 697 HH12 ARG 86 HH12 ARG 86 -4.061 12.364 -5.058 698 HH21 ARG 86 HH21 ARG 86 -4.913 8.978 -4.479 699 HH22 ARG 86 HH22 ARG 86 -4.746 10.202 -5.665 700 H VAL 87 H VAL 87 0.468 11.712 0.036 701 HA VAL 87 HA VAL 87 1.830 13.852 -1.425 702 HB VAL 87 HB VAL 87 3.767 13.464 0.226 703 HG11 VAL 87 HG11 VAL 87 2.931 15.099 1.868 704 HG12 VAL 87 HG12 VAL 87 2.586 15.563 0.215 705 HG13 VAL 87 HG13 VAL 87 1.280 14.914 1.230 706 HG21 VAL 87 HG21 VAL 87 1.542 12.475 2.076 707 HG22 VAL 87 HG22 VAL 87 2.813 11.449 1.356 708 HG23 VAL 87 HG23 VAL 87 3.236 12.754 2.479 709 H ASP 88 H ASP 88 3.835 13.149 -2.300 710 HA ASP 88 HA ASP 88 3.792 10.340 -3.252 711 HB2 ASP 88 HB2 ASP 88 3.758 12.336 -4.797 712 HB3 ASP 88 HB3 ASP 88 5.413 12.694 -4.289 713 H ILE 89 H ILE 89 6.313 9.711 -3.809 714 HA ILE 89 HA ILE 89 7.619 9.140 -1.397 715 HB ILE 89 HB ILE 89 9.609 8.688 -2.955 716 HG12 ILE 89 HG12 ILE 89 7.655 9.262 -5.230 717 HG13 ILE 89 HG13 ILE 89 8.910 10.389 -4.746 718 HG21 ILE 89 HG21 ILE 89 7.033 7.388 -3.884 719 HG22 ILE 89 HG22 ILE 89 8.662 6.699 -3.760 720 HG23 ILE 89 HG23 ILE 89 7.758 7.077 -2.283 721 HD11 ILE 89 HD11 ILE 89 9.682 9.107 -6.631 722 HD12 ILE 89 HD12 ILE 89 10.625 8.638 -5.211 723 HD13 ILE 89 HD13 ILE 89 9.332 7.581 -5.805 724 H TYR 90 H TYR 90 7.961 11.992 -3.405 725 HA TYR 90 HA TYR 90 10.379 12.882 -1.967 726 HB2 TYR 90 HB2 TYR 90 8.681 14.182 -4.105 727 HB3 TYR 90 HB3 TYR 90 10.244 14.783 -3.555 728 HD1 TYR 90 HD1 TYR 90 11.196 11.544 -3.509 729 HD2 TYR 90 HD2 TYR 90 9.620 14.353 -6.404 730 HE1 TYR 90 HE1 TYR 90 12.268 10.310 -5.291 731 HE2 TYR 90 HE2 TYR 90 10.711 13.081 -8.216 732 HH TYR 90 HH TYR 90 11.650 10.923 -8.680 733 H GLY 91 H GLY 91 7.234 12.775 -0.972 734 HA2 GLY 91 HA2 GLY 91 6.217 13.883 0.743 735 HA3 GLY 91 HA3 GLY 91 7.588 14.994 0.859 736 H ASN 92 H ASN 92 6.566 14.993 -2.408 737 HA ASN 92 HA ASN 92 5.509 17.653 -2.228 738 HB2 ASN 92 HB2 ASN 92 5.353 15.597 -4.475 739 HB3 ASN 92 HB3 ASN 92 4.943 17.298 -4.618 740 HD21 ASN 92 HD21 ASN 92 7.314 15.487 -5.807 741 HD22 ASN 92 HD22 ASN 92 8.690 16.479 -5.297 742 H GLU 93 H GLU 93 3.518 18.355 -2.025 743 HA GLU 93 HA GLU 93 1.465 16.462 -1.292 744 HB2 GLU 93 HB2 GLU 93 1.985 18.840 -0.324 745 HB3 GLU 93 HB3 GLU 93 0.939 19.424 -1.636 746 HG2 GLU 93 HG2 GLU 93 -0.945 18.326 -0.796 747 HG3 GLU 93 HG3 GLU 93 0.020 17.146 0.109 748 H VAL 94 H VAL 94 -0.311 15.942 -2.229 749 HA VAL 94 HA VAL 94 -0.925 16.733 -4.959 750 HB VAL 94 HB VAL 94 -1.561 14.446 -5.531 751 HG11 VAL 94 HG11 VAL 94 0.556 13.899 -6.324 752 HG12 VAL 94 HG12 VAL 94 0.595 15.636 -6.160 753 HG13 VAL 94 HG13 VAL 94 1.402 14.643 -4.931 754 HG21 VAL 94 HG21 VAL 94 -0.833 12.538 -4.363 755 HG22 VAL 94 HG22 VAL 94 0.156 13.485 -3.235 756 HG23 VAL 94 HG23 VAL 94 -1.626 13.565 -3.157 757 H ASP 95 H ASP 95 -3.213 15.477 -5.409 758 HA ASP 95 HA ASP 95 -4.999 17.224 -3.976 759 HB2 ASP 95 HB2 ASP 95 -5.985 14.939 -5.684 760 HB3 ASP 95 HB3 ASP 95 -6.555 16.605 -5.605 761 H VAL 96 H VAL 96 -7.282 15.855 -3.490 762 HA VAL 96 HA VAL 96 -6.471 14.011 -1.293 763 HB VAL 96 HB VAL 96 -8.265 14.917 -0.100 764 HG11 VAL 96 HG11 VAL 96 -7.947 17.322 -0.070 765 HG12 VAL 96 HG12 VAL 96 -6.373 16.593 -0.428 766 HG13 VAL 96 HG13 VAL 96 -7.305 17.344 -1.704 767 HG21 VAL 96 HG21 VAL 96 -9.266 16.258 -2.669 768 HG22 VAL 96 HG22 VAL 96 -10.056 14.924 -1.825 769 HG23 VAL 96 HG23 VAL 96 -9.952 16.508 -1.053 770 H VAL 97 H VAL 97 -8.177 12.596 -0.489 771 HA VAL 97 HA VAL 97 -9.129 10.914 -2.758 772 HB VAL 97 HB VAL 97 -9.737 10.402 0.174 773 HG11 VAL 97 HG11 VAL 97 -11.094 9.135 -1.491 774 HG12 VAL 97 HG12 VAL 97 -9.599 8.506 -2.209 775 HG13 VAL 97 HG13 VAL 97 -10.042 8.104 -0.520 776 HG21 VAL 97 HG21 VAL 97 -7.326 9.489 -1.451 777 HG22 VAL 97 HG22 VAL 97 -7.334 10.395 0.087 778 HG23 VAL 97 HG23 VAL 97 -7.844 8.718 0.064 779 H THR 98 H THR 98 -11.253 10.904 -3.507 780 HA THR 98 HA THR 98 -12.961 13.104 -2.748 781 HB THR 98 HB THR 98 -14.496 11.732 -4.454 782 HG1 THR 98 HG1 THR 98 -13.242 10.626 -5.931 783 HG21 THR 98 HG21 THR 98 -13.318 12.943 -6.288 784 HG22 THR 98 HG22 THR 98 -13.545 13.950 -4.856 785 HG23 THR 98 HG23 THR 98 -11.951 13.245 -5.194 786 HA PRO 99 HA PRO 99 -15.354 11.359 0.400 787 HB2 PRO 99 HB2 PRO 99 -18.017 11.807 -0.313 788 HB3 PRO 99 HB3 PRO 99 -16.897 12.976 0.431 789 HG2 PRO 99 HG2 PRO 99 -17.559 12.621 -2.504 790 HG3 PRO 99 HG3 PRO 99 -17.416 14.149 -1.578 791 HD2 PRO 99 HD2 PRO 99 -15.410 13.280 -3.141 792 HD3 PRO 99 HD3 PRO 99 -15.042 13.999 -1.551 793 H GLU 100 H GLU 100 -17.061 10.382 -2.643 794 HA GLU 100 HA GLU 100 -18.096 8.005 -1.478 795 HB2 GLU 100 HB2 GLU 100 -17.740 8.836 -4.349 796 HB3 GLU 100 HB3 GLU 100 -18.524 7.329 -3.853 797 HG2 GLU 100 HG2 GLU 100 -20.132 8.646 -2.478 798 HG3 GLU 100 HG3 GLU 100 -19.378 10.146 -3.037 799 H GLN 101 H GLN 101 -15.123 8.588 -3.403 800 HA GLN 101 HA GLN 101 -14.365 5.829 -3.444 801 HB2 GLN 101 HB2 GLN 101 -12.703 8.363 -3.782 802 HB3 GLN 101 HB3 GLN 101 -12.078 6.716 -4.030 803 HG2 GLN 101 HG2 GLN 101 -14.011 6.342 -5.649 804 HG3 GLN 101 HG3 GLN 101 -14.339 8.062 -5.534 805 HE21 GLN 101 HE21 GLN 101 -14.034 6.970 -7.916 806 HE22 GLN 101 HE22 GLN 101 -12.516 7.342 -8.696 807 H ALA 102 H ALA 102 -13.899 8.352 -0.954 808 HA ALA 102 HA ALA 102 -11.936 6.787 0.518 809 HB1 ALA 102 HB1 ALA 102 -12.373 8.413 2.324 810 HB2 ALA 102 HB2 ALA 102 -12.102 9.244 0.781 811 HB3 ALA 102 HB3 ALA 102 -13.748 9.075 1.412 812 H LYS 103 H LYS 103 -15.473 7.444 0.994 813 HA LYS 103 HA LYS 103 -15.687 5.610 3.142 814 HB2 LYS 103 HB2 LYS 103 -18.066 5.768 3.011 815 HB3 LYS 103 HB3 LYS 103 -17.331 7.361 2.776 816 HG2 LYS 103 HG2 LYS 103 -17.666 7.124 0.333 817 HG3 LYS 103 HG3 LYS 103 -18.417 5.552 0.563 818 HD2 LYS 103 HD2 LYS 103 -20.099 7.275 0.208 819 HD3 LYS 103 HD3 LYS 103 -20.247 6.575 1.829 820 HE2 LYS 103 HE2 LYS 103 -19.088 8.517 2.813 821 HE3 LYS 103 HE3 LYS 103 -18.812 9.208 1.211 822 HZ1 LYS 103 HZ1 LYS 103 -21.116 9.581 0.970 823 HZ2 LYS 103 HZ2 LYS 103 -21.509 8.710 2.333 824 HZ3 LYS 103 HZ3 LYS 103 -20.711 10.147 2.427 825 H TYR 104 H TYR 104 -15.768 4.936 -0.250 826 HA TYR 104 HA TYR 104 -16.934 2.366 -0.359 827 HB2 TYR 104 HB2 TYR 104 -16.410 3.029 -2.451 828 HB3 TYR 104 HB3 TYR 104 -15.076 4.026 -1.942 829 HD1 TYR 104 HD1 TYR 104 -15.851 1.245 -3.884 830 HD2 TYR 104 HD2 TYR 104 -12.824 2.854 -1.270 831 HE1 TYR 104 HE1 TYR 104 -14.152 -0.213 -4.953 832 HE2 TYR 104 HE2 TYR 104 -11.133 1.402 -2.317 833 HH TYR 104 HH TYR 104 -11.781 -0.572 -5.158 834 H ALA 105 H ALA 105 -13.853 3.341 1.090 835 HA ALA 105 HA ALA 105 -12.532 0.888 1.142 836 HB1 ALA 105 HB1 ALA 105 -11.293 1.824 3.006 837 HB2 ALA 105 HB2 ALA 105 -11.640 3.135 1.866 838 HB3 ALA 105 HB3 ALA 105 -12.611 2.948 3.355 839 H TYR 106 H TYR 106 -15.310 1.939 3.128 840 HA TYR 106 HA TYR 106 -15.106 0.022 5.188 841 HB2 TYR 106 HB2 TYR 106 -17.132 0.789 5.857 842 HB3 TYR 106 HB3 TYR 106 -16.837 2.060 4.688 843 HD1 TYR 106 HD1 TYR 106 -17.784 1.654 2.225 844 HD2 TYR 106 HD2 TYR 106 -19.040 -0.675 5.642 845 HE1 TYR 106 HE1 TYR 106 -19.786 1.037 1.043 846 HE2 TYR 106 HE2 TYR 106 -21.035 -1.405 4.387 847 HH TYR 106 HH TYR 106 -21.613 -0.280 0.999 848 H GLN 107 H GLN 107 -16.537 -0.196 1.953 849 HA GLN 107 HA GLN 107 -17.748 -2.736 2.237 850 HB2 GLN 107 HB2 GLN 107 -18.495 -2.424 0.205 851 HB3 GLN 107 HB3 GLN 107 -17.919 -0.777 0.475 852 HG2 GLN 107 HG2 GLN 107 -15.960 -1.212 -0.826 853 HG3 GLN 107 HG3 GLN 107 -16.440 -2.857 -1.093 854 HE21 GLN 107 HE21 GLN 107 -15.951 -1.042 -3.272 855 HE22 GLN 107 HE22 GLN 107 -17.481 -0.972 -4.127 856 H ARG 108 H ARG 108 -14.703 -1.660 1.050 857 HA ARG 108 HA ARG 108 -13.552 -4.268 0.496 858 HB2 ARG 108 HB2 ARG 108 -11.888 -1.897 1.383 859 HB3 ARG 108 HB3 ARG 108 -11.417 -3.213 0.318 860 HG2 ARG 108 HG2 ARG 108 -13.373 -0.958 -0.288 861 HG3 ARG 108 HG3 ARG 108 -11.749 -1.091 -0.917 862 HD2 ARG 108 HD2 ARG 108 -13.831 -3.244 -1.487 863 HD3 ARG 108 HD3 ARG 108 -13.742 -1.753 -2.424 864 HE ARG 108 HE ARG 108 -11.145 -2.891 -2.299 865 HH11 ARG 108 HH11 ARG 108 -14.292 -3.461 -3.871 866 HH12 ARG 108 HH12 ARG 108 -13.610 -3.776 -5.430 867 HH21 ARG 108 HH21 ARG 108 -10.236 -3.641 -4.327 868 HH22 ARG 108 HH22 ARG 108 -11.316 -4.176 -5.578 869 H TYR 109 H TYR 109 -13.759 -2.438 3.590 870 HA TYR 109 HA TYR 109 -11.942 -4.156 4.987 871 HB2 TYR 109 HB2 TYR 109 -12.576 -1.979 5.764 872 HB3 TYR 109 HB3 TYR 109 -14.245 -2.381 5.922 873 HD1 TYR 109 HD1 TYR 109 -14.983 -4.298 7.542 874 HD2 TYR 109 HD2 TYR 109 -11.234 -2.156 7.797 875 HE1 TYR 109 HE1 TYR 109 -14.746 -5.008 9.874 876 HE2 TYR 109 HE2 TYR 109 -11.052 -2.803 10.175 877 HH TYR 109 HH TYR 109 -12.217 -3.772 12.033 878 H GLN 110 H GLN 110 -15.568 -4.097 4.817 879 HA GLN 110 HA GLN 110 -15.844 -6.526 6.187 880 HB2 GLN 110 HB2 GLN 110 -18.136 -6.643 5.490 881 HB3 GLN 110 HB3 GLN 110 -17.710 -5.034 6.069 882 HG2 GLN 110 HG2 GLN 110 -17.787 -4.095 3.915 883 HG3 GLN 110 HG3 GLN 110 -17.706 -5.664 3.113 884 HE21 GLN 110 HE21 GLN 110 -19.695 -7.216 3.588 885 HE22 GLN 110 HE22 GLN 110 -21.224 -6.378 3.558 886 H GLU 111 H GLU 111 -15.070 -6.010 2.830 887 HA GLU 111 HA GLU 111 -15.883 -8.498 1.722 888 HB2 GLU 111 HB2 GLU 111 -13.523 -6.676 1.125 889 HB3 GLU 111 HB3 GLU 111 -13.671 -8.210 0.298 890 HG2 GLU 111 HG2 GLU 111 -15.862 -6.121 0.207 891 HG3 GLU 111 HG3 GLU 111 -14.501 -6.139 -0.899 892 H ARG 112 H ARG 112 -13.009 -7.742 3.667 893 HA ARG 112 HA ARG 112 -12.346 -10.661 3.727 894 HB2 ARG 112 HB2 ARG 112 -10.541 -8.240 3.937 895 HB3 ARG 112 HB3 ARG 112 -10.015 -9.849 4.431 896 HG2 ARG 112 HG2 ARG 112 -11.151 -9.282 1.659 897 HG3 ARG 112 HG3 ARG 112 -9.437 -9.167 2.006 898 HD2 ARG 112 HD2 ARG 112 -9.149 -11.445 2.348 899 HD3 ARG 112 HD3 ARG 112 -10.840 -11.723 2.734 900 HE ARG 112 HE ARG 112 -11.479 -11.506 0.476 901 HH11 ARG 112 HH11 ARG 112 -7.874 -11.552 0.724 902 HH12 ARG 112 HH12 ARG 112 -7.688 -12.244 -0.825 903 HH21 ARG 112 HH21 ARG 112 -11.183 -12.142 -1.590 904 HH22 ARG 112 HH22 ARG 112 -9.596 -12.333 -2.283 905 H TYR 113 H TYR 113 -12.580 -7.811 5.841 906 HA TYR 113 HA TYR 113 -12.157 -9.448 8.228 907 HB2 TYR 113 HB2 TYR 113 -12.585 -6.474 7.958 908 HB3 TYR 113 HB3 TYR 113 -11.903 -7.330 9.321 909 HD1 TYR 113 HD1 TYR 113 -11.011 -5.257 6.762 910 HD2 TYR 113 HD2 TYR 113 -9.831 -9.044 8.432 911 HE1 TYR 113 HE1 TYR 113 -8.840 -5.100 5.561 912 HE2 TYR 113 HE2 TYR 113 -7.663 -8.911 7.254 913 HH TYR 113 HH TYR 113 -6.799 -6.136 5.124 914 H GLY 114 H GLY 114 -14.856 -8.966 6.391 915 HA2 GLY 114 HA2 GLY 114 -16.675 -9.153 8.738 916 HA3 GLY 114 HA3 GLY 114 -16.973 -7.986 7.445 917 H ASN 115 H ASN 115 -19.001 -9.253 7.248 918 HA ASN 115 HA ASN 115 -18.624 -11.621 5.480 919 HB2 ASN 115 HB2 ASN 115 -19.612 -12.081 7.809 920 HB3 ASN 115 HB3 ASN 115 -21.027 -11.176 7.245 921 HD21 ASN 115 HD21 ASN 115 -18.913 -13.997 6.435 922 HD22 ASN 115 HD22 ASN 115 -20.157 -14.799 5.482 923 H LYS 116 H LYS 116 -20.448 -11.911 3.981 924 HA LYS 116 HA LYS 116 -21.458 -11.382 2.139 925 HB2 LYS 116 HB2 LYS 116 -23.531 -10.371 2.284 926 HB3 LYS 116 HB3 LYS 116 -23.232 -11.102 3.855 927 HG2 LYS 116 HG2 LYS 116 -22.743 -8.961 4.856 928 HG3 LYS 116 HG3 LYS 116 -22.852 -8.121 3.296 929 HD2 LYS 116 HD2 LYS 116 -25.106 -9.644 4.645 930 HD3 LYS 116 HD3 LYS 116 -24.846 -7.899 4.792 931 HE2 LYS 116 HE2 LYS 116 -25.167 -7.577 2.390 932 HE3 LYS 116 HE3 LYS 116 -25.341 -9.325 2.147 933 HZ1 LYS 116 HZ1 LYS 116 -27.167 -7.637 3.725 934 HZ2 LYS 116 HZ2 LYS 116 -27.431 -8.270 2.208 935 HZ3 LYS 116 HZ3 LYS 116 -27.308 -9.279 3.494 936 H LYS 117 H LYS 117 -22.396 -9.459 0.614 937 HA LYS 117 HA LYS 117 -20.700 -7.136 0.600 938 HB2 LYS 117 HB2 LYS 117 -19.486 -7.600 -1.395 939 HB3 LYS 117 HB3 LYS 117 -19.262 -9.007 -0.350 940 HG2 LYS 117 HG2 LYS 117 -20.889 -10.283 -1.659 941 HG3 LYS 117 HG3 LYS 117 -21.194 -8.884 -2.696 942 HD2 LYS 117 HD2 LYS 117 -19.265 -9.035 -3.822 943 HD3 LYS 117 HD3 LYS 117 -18.309 -9.561 -2.452 944 HE2 LYS 117 HE2 LYS 117 -20.249 -11.387 -3.926 945 HE3 LYS 117 HE3 LYS 117 -18.517 -11.249 -4.276 946 HZ1 LYS 117 HZ1 LYS 117 -18.925 -13.091 -2.830 947 HZ2 LYS 117 HZ2 LYS 117 -18.069 -11.934 -2.010 948 HZ3 LYS 117 HZ3 LYS 117 -19.664 -12.147 -1.713 949 H SER 118 H SER 118 -21.062 -5.850 -1.363 950 HA SER 118 HA SER 118 -23.868 -5.467 -1.857 951 HB2 SER 118 HB2 SER 118 -21.920 -3.766 -1.713 952 HB3 SER 118 HB3 SER 118 -21.492 -4.255 -3.355 953 HG SER 118 HG SER 118 -23.387 -2.609 -2.446 954 H GLN 119 H GLN 119 -24.816 -7.150 -3.023 955 HA GLN 119 HA GLN 119 -23.957 -7.512 -5.759 956 HB2 GLN 119 HB2 GLN 119 -23.083 -9.454 -3.786 957 HB3 GLN 119 HB3 GLN 119 -24.270 -10.227 -4.828 958 HG2 GLN 119 HG2 GLN 119 -21.892 -8.661 -5.923 959 HG3 GLN 119 HG3 GLN 119 -21.830 -10.381 -5.543 960 HE21 GLN 119 HE21 GLN 119 -23.517 -7.969 -7.717 961 HE22 GLN 119 HE22 GLN 119 -24.136 -9.200 -8.777 962 H ASP 120 H ASP 120 -25.714 -7.431 -6.878 963 HA ASP 120 HA ASP 120 -28.371 -7.978 -5.693 964 HB2 ASP 120 HB2 ASP 120 -27.495 -6.429 -8.170 965 HB3 ASP 120 HB3 ASP 120 -29.152 -6.571 -7.562 966 H LEU 121 H LEU 121 -29.899 -8.690 -7.772 967 HA LEU 121 HA LEU 121 -28.647 -11.206 -8.783 968 HB2 LEU 121 HB2 LEU 121 -31.527 -10.236 -8.562 969 HB3 LEU 121 HB3 LEU 121 -31.059 -11.531 -9.653 970 HG LEU 121 HG LEU 121 -30.057 -12.790 -7.713 971 HD11 LEU 121 HD11 LEU 121 -30.956 -12.216 -5.437 972 HD12 LEU 121 HD12 LEU 121 -29.794 -11.041 -6.038 973 HD13 LEU 121 HD13 LEU 121 -31.535 -10.668 -6.088 974 HD21 LEU 121 HD21 LEU 121 -33.041 -12.174 -7.634 975 HD22 LEU 121 HD22 LEU 121 -32.233 -13.360 -8.685 976 HD23 LEU 121 HD23 LEU 121 -32.258 -13.610 -6.937 977 H LYS 122 H LYS 122 -28.615 -11.654 -10.979 978 HA LYS 122 HA LYS 122 -28.133 -11.274 -13.124 979 HB2 LYS 122 HB2 LYS 122 -30.802 -9.901 -12.758 980 HB3 LYS 122 HB3 LYS 122 -29.971 -9.691 -14.286 981 HG2 LYS 122 HG2 LYS 122 -29.658 -12.191 -14.415 982 HG3 LYS 122 HG3 LYS 122 -30.724 -12.351 -13.011 983 HD2 LYS 122 HD2 LYS 122 -32.561 -11.300 -14.264 984 HD3 LYS 122 HD3 LYS 122 -31.497 -10.986 -15.637 985 HE2 LYS 122 HE2 LYS 122 -32.294 -13.740 -14.588 986 HE3 LYS 122 HE3 LYS 122 -32.933 -12.943 -16.040 987 HZ1 LYS 122 HZ1 LYS 122 -31.268 -14.497 -16.658 988 HZ2 LYS 122 HZ2 LYS 122 -30.678 -12.992 -16.956 989 HZ3 LYS 122 HZ3 LYS 122 -30.157 -13.859 -15.639 Start of MODEL 10 1 H1 GLY 1 H GLY 1 24.718 3.924 17.817 2 HA2 GLY 1 HA2 GLY 1 24.530 1.762 15.805 3 HA3 GLY 1 HA3 GLY 1 24.607 1.513 17.560 4 H SER 2 H SER 2 22.544 1.246 15.109 5 HA SER 2 HA SER 2 20.155 1.823 16.701 6 HB2 SER 2 HB2 SER 2 20.538 2.648 13.787 7 HB3 SER 2 HB3 SER 2 19.076 2.876 14.762 8 HG SER 2 HG SER 2 20.322 4.781 14.699 9 H ASN 3 H ASN 3 18.236 0.686 15.438 10 HA ASN 3 HA ASN 3 18.860 -2.100 15.287 11 HB2 ASN 3 HB2 ASN 3 16.439 -0.674 14.106 12 HB3 ASN 3 HB3 ASN 3 16.593 -2.404 14.385 13 HD21 ASN 3 HD21 ASN 3 15.472 0.479 15.721 14 HD22 ASN 3 HD22 ASN 3 15.259 -0.078 17.373 15 H GLN 4 H GLN 4 19.456 -3.421 13.557 16 HA GLN 4 HA GLN 4 19.401 -2.319 10.787 17 HB2 GLN 4 HB2 GLN 4 21.732 -3.598 12.258 18 HB3 GLN 4 HB3 GLN 4 21.670 -3.453 10.505 19 HG2 GLN 4 HG2 GLN 4 21.929 -1.135 10.519 20 HG3 GLN 4 HG3 GLN 4 21.340 -0.953 12.169 21 HE21 GLN 4 HE21 GLN 4 24.130 -2.365 10.324 22 HE22 GLN 4 HE22 GLN 4 25.283 -2.075 11.602 23 H GLN 5 H GLN 5 18.638 -3.768 9.375 24 HA GLN 5 HA GLN 5 18.909 -6.627 9.571 25 HB2 GLN 5 HB2 GLN 5 16.515 -7.094 9.706 26 HB3 GLN 5 HB3 GLN 5 16.943 -6.105 11.104 27 HG2 GLN 5 HG2 GLN 5 16.203 -4.086 9.549 28 HG3 GLN 5 HG3 GLN 5 15.366 -5.339 8.640 29 HE21 GLN 5 HE21 GLN 5 15.054 -3.111 11.097 30 HE22 GLN 5 HE22 GLN 5 13.763 -3.819 12.035 31 H LEU 6 H LEU 6 17.690 -7.540 7.503 32 HA LEU 6 HA LEU 6 16.933 -5.771 5.452 33 HB2 LEU 6 HB2 LEU 6 18.621 -6.437 3.835 34 HB3 LEU 6 HB3 LEU 6 19.237 -5.361 5.056 35 HG LEU 6 HG LEU 6 19.559 -8.271 5.692 36 HD11 LEU 6 HD11 LEU 6 19.925 -8.324 3.273 37 HD12 LEU 6 HD12 LEU 6 21.075 -6.970 3.385 38 HD13 LEU 6 HD13 LEU 6 21.456 -8.547 4.126 39 HD21 LEU 6 HD21 LEU 6 21.788 -7.474 6.388 40 HD22 LEU 6 HD22 LEU 6 21.425 -5.863 5.718 41 HD23 LEU 6 HD23 LEU 6 20.497 -6.490 7.088 42 H ASN 7 H ASN 7 16.468 -7.135 3.579 43 HA ASN 7 HA ASN 7 14.911 -8.687 2.842 44 HB2 ASN 7 HB2 ASN 7 17.356 -9.178 2.111 45 HB3 ASN 7 HB3 ASN 7 17.252 -10.584 3.135 46 HD21 ASN 7 HD21 ASN 7 16.459 -9.245 0.065 47 HD22 ASN 7 HD22 ASN 7 15.545 -10.627 -0.535 48 H ALA 8 H ALA 8 13.530 -8.640 4.781 49 HA ALA 8 HA ALA 8 13.627 -10.290 7.000 50 HB1 ALA 8 HB1 ALA 8 11.164 -9.390 5.436 51 HB2 ALA 8 HB2 ALA 8 11.145 -10.097 7.063 52 HB3 ALA 8 HB3 ALA 8 11.922 -8.538 6.786 53 H THR 9 H THR 9 14.280 -12.356 6.767 54 HA THR 9 HA THR 9 13.114 -14.173 4.803 55 HB THR 9 HB THR 9 15.237 -14.465 6.970 56 HG1 THR 9 HG1 THR 9 15.554 -13.007 5.093 57 HG21 THR 9 HG21 THR 9 15.933 -16.459 5.609 58 HG22 THR 9 HG22 THR 9 14.406 -16.702 6.431 59 HG23 THR 9 HG23 THR 9 14.402 -16.323 4.703 60 H LYS 10 H LYS 10 11.003 -13.535 5.806 61 HA LYS 10 HA LYS 10 10.158 -15.636 7.712 62 HB2 LYS 10 HB2 LYS 10 10.708 -13.494 9.001 63 HB3 LYS 10 HB3 LYS 10 9.324 -12.745 8.193 64 HG2 LYS 10 HG2 LYS 10 7.875 -14.613 9.117 65 HG3 LYS 10 HG3 LYS 10 9.312 -15.246 9.946 66 HD2 LYS 10 HD2 LYS 10 9.534 -13.001 11.109 67 HD3 LYS 10 HD3 LYS 10 8.038 -12.509 10.320 68 HE2 LYS 10 HE2 LYS 10 7.590 -13.177 12.601 69 HE3 LYS 10 HE3 LYS 10 6.809 -14.313 11.498 70 HZ1 LYS 10 HZ1 LYS 10 9.430 -14.853 12.781 71 HZ2 LYS 10 HZ2 LYS 10 7.968 -15.340 13.387 72 HZ3 LYS 10 HZ3 LYS 10 8.504 -15.910 11.955 73 H LYS 11 H LYS 11 8.888 -12.712 6.020 74 HA LYS 11 HA LYS 11 7.088 -14.461 4.458 75 HB2 LYS 11 HB2 LYS 11 6.217 -11.878 5.811 76 HB3 LYS 11 HB3 LYS 11 5.233 -12.918 4.772 77 HG2 LYS 11 HG2 LYS 11 5.588 -14.774 6.511 78 HG3 LYS 11 HG3 LYS 11 6.341 -13.537 7.539 79 HD2 LYS 11 HD2 LYS 11 4.201 -12.169 7.168 80 HD3 LYS 11 HD3 LYS 11 3.470 -13.651 6.542 81 HE2 LYS 11 HE2 LYS 11 3.768 -14.775 8.628 82 HE3 LYS 11 HE3 LYS 11 4.938 -13.556 9.192 83 HZ1 LYS 11 HZ1 LYS 11 2.276 -12.571 8.563 84 HZ2 LYS 11 HZ2 LYS 11 2.385 -13.504 9.898 85 HZ3 LYS 11 HZ3 LYS 11 3.325 -12.141 9.759 86 H ASP 12 H ASP 12 7.854 -14.185 2.506 87 HA ASP 12 HA ASP 12 9.396 -12.092 1.399 88 HB2 ASP 12 HB2 ASP 12 7.393 -14.121 0.283 89 HB3 ASP 12 HB3 ASP 12 8.232 -13.029 -0.786 90 H LYS 13 H LYS 13 5.868 -12.617 1.521 91 HA LYS 13 HA LYS 13 5.137 -10.470 -0.149 92 HB2 LYS 13 HB2 LYS 13 3.594 -11.616 2.211 93 HB3 LYS 13 HB3 LYS 13 2.892 -10.685 0.888 94 HG2 LYS 13 HG2 LYS 13 4.200 -13.420 0.555 95 HG3 LYS 13 HG3 LYS 13 2.474 -13.155 0.759 96 HD2 LYS 13 HD2 LYS 13 4.048 -11.954 -1.531 97 HD3 LYS 13 HD3 LYS 13 3.300 -13.539 -1.614 98 HE2 LYS 13 HE2 LYS 13 1.746 -11.013 -0.957 99 HE3 LYS 13 HE3 LYS 13 1.953 -11.640 -2.607 100 HZ1 LYS 13 HZ1 LYS 13 0.960 -13.771 -1.551 101 HZ2 LYS 13 HZ2 LYS 13 0.346 -12.731 -0.427 102 HZ3 LYS 13 HZ3 LYS 13 0.020 -12.541 -2.056 103 H LEU 14 H LEU 14 5.873 -10.430 3.417 104 HA LEU 14 HA LEU 14 5.102 -7.599 3.508 105 HB2 LEU 14 HB2 LEU 14 6.653 -9.298 5.500 106 HB3 LEU 14 HB3 LEU 14 5.963 -7.693 5.781 107 HG LEU 14 HG LEU 14 4.375 -10.240 5.222 108 HD11 LEU 14 HD11 LEU 14 4.838 -8.633 7.756 109 HD12 LEU 14 HD12 LEU 14 3.729 -10.004 7.602 110 HD13 LEU 14 HD13 LEU 14 5.482 -10.233 7.371 111 HD21 LEU 14 HD21 LEU 14 3.142 -8.245 4.398 112 HD22 LEU 14 HD22 LEU 14 2.378 -8.958 5.820 113 HD23 LEU 14 HD23 LEU 14 3.351 -7.489 5.998 114 H GLN 15 H GLN 15 7.976 -9.597 3.104 115 HA GLN 15 HA GLN 15 9.986 -7.748 3.655 116 HB2 GLN 15 HB2 GLN 15 10.252 -10.173 3.456 117 HB3 GLN 15 HB3 GLN 15 10.023 -10.080 1.729 118 HG2 GLN 15 HG2 GLN 15 12.260 -8.564 3.100 119 HG3 GLN 15 HG3 GLN 15 12.423 -10.287 2.653 120 HE21 GLN 15 HE21 GLN 15 13.248 -7.256 1.497 121 HE22 GLN 15 HE22 GLN 15 13.064 -7.590 -0.216 122 H VAL 16 H VAL 16 8.528 -8.359 0.363 123 HA VAL 16 HA VAL 16 10.304 -6.496 -0.854 124 HB VAL 16 HB VAL 16 8.785 -6.412 -2.755 125 HG11 VAL 16 HG11 VAL 16 8.907 -8.702 -3.391 126 HG12 VAL 16 HG12 VAL 16 10.276 -8.430 -2.304 127 HG13 VAL 16 HG13 VAL 16 8.815 -9.251 -1.714 128 HG21 VAL 16 HG21 VAL 16 6.695 -7.810 -2.715 129 HG22 VAL 16 HG22 VAL 16 6.813 -7.876 -0.951 130 HG23 VAL 16 HG23 VAL 16 6.596 -6.309 -1.779 131 H ILE 17 H ILE 17 7.351 -5.970 0.967 132 HA ILE 17 HA ILE 17 7.028 -3.210 0.199 133 HB ILE 17 HB ILE 17 5.874 -4.410 2.723 134 HG12 ILE 17 HG12 ILE 17 4.698 -4.730 -0.087 135 HG13 ILE 17 HG13 ILE 17 5.411 -6.021 0.879 136 HG21 ILE 17 HG21 ILE 17 4.763 -2.387 0.715 137 HG22 ILE 17 HG22 ILE 17 4.127 -2.765 2.326 138 HG23 ILE 17 HG23 ILE 17 5.691 -1.958 2.161 139 HD11 ILE 17 HD11 ILE 17 2.889 -4.488 1.550 140 HD12 ILE 17 HD12 ILE 17 3.104 -6.192 1.161 141 HD13 ILE 17 HD13 ILE 17 3.749 -5.595 2.675 142 H ASP 18 H ASP 18 8.430 -5.019 2.873 143 HA ASP 18 HA ASP 18 9.175 -2.881 4.566 144 HB2 ASP 18 HB2 ASP 18 9.304 -5.480 4.929 145 HB3 ASP 18 HB3 ASP 18 10.930 -5.332 4.254 146 H TRP 19 H TRP 19 10.731 -4.232 1.709 147 HA TRP 19 HA TRP 19 13.159 -2.687 1.810 148 HB2 TRP 19 HB2 TRP 19 13.136 -4.670 0.517 149 HB3 TRP 19 HB3 TRP 19 11.669 -4.250 -0.310 150 HD1 TRP 19 HD1 TRP 19 11.985 -2.034 -2.170 151 HE1 TRP 19 HE1 TRP 19 13.939 -1.573 -3.746 152 HE3 TRP 19 HE3 TRP 19 15.532 -5.097 -0.062 153 HZ2 TRP 19 HZ2 TRP 19 16.736 -2.097 -3.838 154 HZ3 TRP 19 HZ3 TRP 19 17.868 -5.028 -0.920 155 HH2 TRP 19 HH2 TRP 19 18.489 -3.491 -2.756 156 H LEU 20 H LEU 20 10.105 -2.232 -0.219 157 HA LEU 20 HA LEU 20 11.073 0.220 -1.252 158 HB2 LEU 20 HB2 LEU 20 8.889 0.652 -2.102 159 HB3 LEU 20 HB3 LEU 20 9.416 -0.999 -2.390 160 HG LEU 20 HG LEU 20 7.961 -1.361 -0.153 161 HD11 LEU 20 HD11 LEU 20 5.862 -0.112 -0.249 162 HD12 LEU 20 HD12 LEU 20 7.225 0.979 0.039 163 HD13 LEU 20 HD13 LEU 20 6.509 0.876 -1.581 164 HD21 LEU 20 HD21 LEU 20 6.813 -1.280 -2.940 165 HD22 LEU 20 HD22 LEU 20 7.719 -2.629 -2.191 166 HD23 LEU 20 HD23 LEU 20 6.148 -2.175 -1.551 167 H ILE 21 H ILE 21 9.377 -0.403 1.772 168 HA ILE 21 HA ILE 21 8.704 2.289 2.420 169 HB ILE 21 HB ILE 21 9.230 -0.262 3.979 170 HG12 ILE 21 HG12 ILE 21 6.637 1.305 3.646 171 HG13 ILE 21 HG13 ILE 21 7.138 0.064 2.540 172 HG21 ILE 21 HG21 ILE 21 8.544 2.430 5.199 173 HG22 ILE 21 HG22 ILE 21 8.295 0.880 6.026 174 HG23 ILE 21 HG23 ILE 21 9.915 1.369 5.548 175 HD11 ILE 21 HD11 ILE 21 6.520 -0.284 5.495 176 HD12 ILE 21 HD12 ILE 21 5.597 -0.864 4.114 177 HD13 ILE 21 HD13 ILE 21 7.186 -1.571 4.461 178 H GLU 22 H GLU 22 11.703 0.401 2.822 179 HA GLU 22 HA GLU 22 13.072 2.463 4.352 180 HB2 GLU 22 HB2 GLU 22 13.398 -0.048 4.503 181 HB3 GLU 22 HB3 GLU 22 14.102 0.019 2.883 182 HG2 GLU 22 HG2 GLU 22 15.738 1.803 4.049 183 HG3 GLU 22 HG3 GLU 22 15.185 1.031 5.528 184 H ASN 23 H ASN 23 12.759 1.520 0.991 185 HA ASN 23 HA ASN 23 15.110 2.883 -0.020 186 HB2 ASN 23 HB2 ASN 23 12.648 1.736 -1.358 187 HB3 ASN 23 HB3 ASN 23 13.737 2.795 -2.241 188 HD21 ASN 23 HD21 ASN 23 14.125 -0.050 0.011 189 HD22 ASN 23 HD22 ASN 23 15.363 -0.789 -0.985 190 H PHE 24 H PHE 24 11.656 3.836 0.253 191 HA PHE 24 HA PHE 24 12.542 6.650 -0.240 192 HB2 PHE 24 HB2 PHE 24 10.156 5.159 -1.261 193 HB3 PHE 24 HB3 PHE 24 10.018 6.869 -0.898 194 HD1 PHE 24 HD1 PHE 24 11.836 8.497 -1.841 195 HD2 PHE 24 HD2 PHE 24 11.034 4.563 -3.411 196 HE1 PHE 24 HE1 PHE 24 12.507 9.262 -4.087 197 HE2 PHE 24 HE2 PHE 24 11.644 5.364 -5.671 198 HZ PHE 24 HZ PHE 24 12.390 7.697 -6.024 199 HA PRO 25 HA PRO 25 10.891 6.304 4.018 200 HB2 PRO 25 HB2 PRO 25 12.903 7.551 5.359 201 HB3 PRO 25 HB3 PRO 25 13.024 5.865 4.798 202 HG2 PRO 25 HG2 PRO 25 14.096 8.369 3.448 203 HG3 PRO 25 HG3 PRO 25 14.959 6.823 3.795 204 HD2 PRO 25 HD2 PRO 25 13.812 7.364 1.371 205 HD3 PRO 25 HD3 PRO 25 13.888 5.716 2.060 206 H ASN 26 H ASN 26 10.469 8.477 1.749 207 HA ASN 26 HA ASN 26 10.444 10.921 3.404 208 HB2 ASN 26 HB2 ASN 26 9.494 10.578 0.567 209 HB3 ASN 26 HB3 ASN 26 9.508 12.071 1.512 210 HD21 ASN 26 HD21 ASN 26 11.572 9.623 0.157 211 HD22 ASN 26 HD22 ASN 26 13.116 10.465 0.240 212 H ALA 27 H ALA 27 8.315 8.255 2.501 213 HA ALA 27 HA ALA 27 6.333 9.003 4.431 214 HB1 ALA 27 HB1 ALA 27 5.664 9.177 1.435 215 HB2 ALA 27 HB2 ALA 27 4.483 9.178 2.764 216 HB3 ALA 27 HB3 ALA 27 5.618 10.531 2.563 217 H PHE 28 H PHE 28 5.981 6.955 5.169 218 HA PHE 28 HA PHE 28 4.688 4.987 3.774 219 HB2 PHE 28 HB2 PHE 28 7.636 4.719 3.533 220 HB3 PHE 28 HB3 PHE 28 6.833 3.307 4.161 221 HD1 PHE 28 HD1 PHE 28 4.302 3.022 2.763 222 HD2 PHE 28 HD2 PHE 28 8.064 4.490 1.211 223 HE1 PHE 28 HE1 PHE 28 3.537 2.568 0.457 224 HE2 PHE 28 HE2 PHE 28 7.314 3.975 -1.075 225 HZ PHE 28 HZ PHE 28 5.032 3.028 -1.470 226 H PHE 29 H PHE 29 4.579 2.843 5.193 227 HA PHE 29 HA PHE 29 5.290 3.262 7.998 228 HB2 PHE 29 HB2 PHE 29 2.409 3.005 7.050 229 HB3 PHE 29 HB3 PHE 29 2.937 2.870 8.720 230 HD1 PHE 29 HD1 PHE 29 2.079 5.187 5.998 231 HD2 PHE 29 HD2 PHE 29 4.020 4.930 9.828 232 HE1 PHE 29 HE1 PHE 29 1.940 7.651 6.267 233 HE2 PHE 29 HE2 PHE 29 3.702 7.337 10.171 234 HZ PHE 29 HZ PHE 29 2.657 8.723 8.369 235 H LYS 30 H LYS 30 5.570 1.229 8.971 236 HA LYS 30 HA LYS 30 5.309 -1.150 7.235 237 HB2 LYS 30 HB2 LYS 30 6.427 -0.819 10.050 238 HB3 LYS 30 HB3 LYS 30 6.328 -2.334 9.183 239 HG2 LYS 30 HG2 LYS 30 8.465 -1.886 8.748 240 HG3 LYS 30 HG3 LYS 30 7.779 -1.070 7.344 241 HD2 LYS 30 HD2 LYS 30 8.020 1.101 8.497 242 HD3 LYS 30 HD3 LYS 30 8.468 0.267 9.998 243 HE2 LYS 30 HE2 LYS 30 10.454 -0.729 8.775 244 HE3 LYS 30 HE3 LYS 30 10.084 0.333 7.414 245 HZ1 LYS 30 HZ1 LYS 30 11.738 1.327 8.847 246 HZ2 LYS 30 HZ2 LYS 30 10.401 2.236 8.904 247 HZ3 LYS 30 HZ3 LYS 30 10.751 1.242 10.157 248 H LYS 31 H LYS 31 4.094 -0.235 10.555 249 HA LYS 31 HA LYS 31 2.573 -2.663 10.697 250 HB2 LYS 31 HB2 LYS 31 2.776 -0.172 12.357 251 HB3 LYS 31 HB3 LYS 31 1.444 -1.307 12.651 252 HG2 LYS 31 HG2 LYS 31 2.890 -3.061 13.238 253 HG3 LYS 31 HG3 LYS 31 4.306 -2.292 12.514 254 HD2 LYS 31 HD2 LYS 31 4.341 -0.566 14.256 255 HD3 LYS 31 HD3 LYS 31 2.795 -1.138 14.889 256 HE2 LYS 31 HE2 LYS 31 4.422 -2.029 16.359 257 HE3 LYS 31 HE3 LYS 31 3.857 -3.367 15.352 258 HZ1 LYS 31 HZ1 LYS 31 6.472 -2.161 15.507 259 HZ2 LYS 31 HZ2 LYS 31 6.061 -3.693 15.161 260 HZ3 LYS 31 HZ3 LYS 31 5.989 -2.540 13.979 261 H GLY 32 H GLY 32 0.732 -3.125 9.792 262 HA2 GLY 32 HA2 GLY 32 -0.631 -1.612 7.906 263 HA3 GLY 32 HA3 GLY 32 -1.274 -2.993 8.769 264 H ASN 33 H ASN 33 -0.951 -1.203 11.341 265 HA ASN 33 HA ASN 33 -3.650 -0.037 11.178 266 HB2 ASN 33 HB2 ASN 33 -3.473 0.181 13.624 267 HB3 ASN 33 HB3 ASN 33 -3.289 -1.458 13.027 268 HD21 ASN 33 HD21 ASN 33 -0.607 1.113 13.215 269 HD22 ASN 33 HD22 ASN 33 0.218 0.204 14.437 270 H GLN 34 H GLN 34 -0.488 1.212 10.809 271 HA GLN 34 HA GLN 34 -1.414 3.939 11.641 272 HB2 GLN 34 HB2 GLN 34 1.063 4.425 11.943 273 HB3 GLN 34 HB3 GLN 34 0.311 3.384 13.151 274 HG2 GLN 34 HG2 GLN 34 1.243 1.404 12.167 275 HG3 GLN 34 HG3 GLN 34 1.808 2.264 10.755 276 HE21 GLN 34 HE21 GLN 34 3.558 3.874 11.084 277 HE22 GLN 34 HE22 GLN 34 4.752 3.558 12.331 278 H VAL 35 H VAL 35 -1.450 2.235 9.053 279 HA VAL 35 HA VAL 35 0.228 3.605 7.166 280 HB VAL 35 HB VAL 35 -1.186 2.470 5.490 281 HG11 VAL 35 HG11 VAL 35 -0.682 0.148 6.146 282 HG12 VAL 35 HG12 VAL 35 0.667 1.236 6.563 283 HG13 VAL 35 HG13 VAL 35 -0.443 0.668 7.815 284 HG21 VAL 35 HG21 VAL 35 -2.978 0.888 6.192 285 HG22 VAL 35 HG22 VAL 35 -2.938 1.592 7.814 286 HG23 VAL 35 HG23 VAL 35 -3.401 2.590 6.433 287 H LYS 36 H LYS 36 -0.595 4.864 5.334 288 HA LYS 36 HA LYS 36 -2.919 6.635 5.852 289 HB2 LYS 36 HB2 LYS 36 -0.008 7.414 5.404 290 HB3 LYS 36 HB3 LYS 36 -1.287 8.419 4.784 291 HG2 LYS 36 HG2 LYS 36 -2.262 8.534 7.139 292 HG3 LYS 36 HG3 LYS 36 -0.729 7.831 7.709 293 HD2 LYS 36 HD2 LYS 36 0.526 9.708 6.707 294 HD3 LYS 36 HD3 LYS 36 -0.957 10.310 5.942 295 HE2 LYS 36 HE2 LYS 36 -1.943 10.639 8.229 296 HE3 LYS 36 HE3 LYS 36 -0.346 10.289 8.909 297 HZ1 LYS 36 HZ1 LYS 36 -0.698 12.645 8.641 298 HZ2 LYS 36 HZ2 LYS 36 0.502 12.210 7.624 299 HZ3 LYS 36 HZ3 LYS 36 -1.019 12.510 7.061 300 HA PRO 37 HA PRO 37 -3.313 5.772 1.508 301 HB2 PRO 37 HB2 PRO 37 -4.679 7.937 0.541 302 HB3 PRO 37 HB3 PRO 37 -5.410 6.722 1.617 303 HG2 PRO 37 HG2 PRO 37 -4.394 9.456 2.370 304 HG3 PRO 37 HG3 PRO 37 -5.844 8.574 2.945 305 HD2 PRO 37 HD2 PRO 37 -3.421 8.749 4.286 306 HD3 PRO 37 HD3 PRO 37 -4.623 7.448 4.525 307 H LEU 38 H LEU 38 -1.888 5.756 -0.026 308 HA LEU 38 HA LEU 38 0.179 7.872 -0.263 309 HB2 LEU 38 HB2 LEU 38 -0.093 5.037 -1.381 310 HB3 LEU 38 HB3 LEU 38 1.108 6.157 -1.951 311 HG LEU 38 HG LEU 38 2.200 4.706 -0.522 312 HD11 LEU 38 HD11 LEU 38 3.250 6.159 1.089 313 HD12 LEU 38 HD12 LEU 38 2.851 7.133 -0.326 314 HD13 LEU 38 HD13 LEU 38 1.848 7.246 1.129 315 HD21 LEU 38 HD21 LEU 38 0.184 3.947 0.767 316 HD22 LEU 38 HD22 LEU 38 1.661 4.186 1.720 317 HD23 LEU 38 HD23 LEU 38 0.368 5.411 1.754 318 H LYS 39 H LYS 39 0.899 8.344 -2.493 319 HA LYS 39 HA LYS 39 -0.998 9.681 -4.056 320 HB2 LYS 39 HB2 LYS 39 1.363 10.163 -3.979 321 HB3 LYS 39 HB3 LYS 39 1.802 8.586 -4.624 322 HG2 LYS 39 HG2 LYS 39 0.041 10.242 -6.350 323 HG3 LYS 39 HG3 LYS 39 1.631 10.927 -6.052 324 HD2 LYS 39 HD2 LYS 39 2.750 9.009 -7.001 325 HD3 LYS 39 HD3 LYS 39 1.229 8.104 -7.070 326 HE2 LYS 39 HE2 LYS 39 0.419 10.243 -8.468 327 HE3 LYS 39 HE3 LYS 39 2.146 10.473 -8.729 328 HZ1 LYS 39 HZ1 LYS 39 0.617 8.022 -9.421 329 HZ2 LYS 39 HZ2 LYS 39 1.078 9.174 -10.479 330 HZ3 LYS 39 HZ3 LYS 39 2.206 8.260 -9.761 331 H ILE 40 H ILE 40 -1.886 9.242 -6.114 332 HA ILE 40 HA ILE 40 -3.112 6.751 -6.437 333 HB ILE 40 HB ILE 40 -3.970 8.903 -7.263 334 HG12 ILE 40 HG12 ILE 40 -4.820 8.229 -9.484 335 HG13 ILE 40 HG13 ILE 40 -3.684 6.879 -9.533 336 HG21 ILE 40 HG21 ILE 40 -2.050 8.691 -9.599 337 HG22 ILE 40 HG22 ILE 40 -3.151 10.022 -9.189 338 HG23 ILE 40 HG23 ILE 40 -1.721 9.722 -8.202 339 HD11 ILE 40 HD11 ILE 40 -6.018 6.259 -8.864 340 HD12 ILE 40 HD12 ILE 40 -4.803 5.813 -7.653 341 HD13 ILE 40 HD13 ILE 40 -5.834 7.248 -7.405 342 H GLY 41 H GLY 41 -2.470 4.881 -7.246 343 HA2 GLY 41 HA2 GLY 41 -1.151 3.251 -8.231 344 HA3 GLY 41 HA3 GLY 41 -0.932 4.424 -9.536 345 H ILE 42 H ILE 42 0.259 4.934 -6.210 346 HA ILE 42 HA ILE 42 2.774 5.813 -6.861 347 HB ILE 42 HB ILE 42 1.693 6.020 -4.676 348 HG12 ILE 42 HG12 ILE 42 4.493 4.877 -4.427 349 HG13 ILE 42 HG13 ILE 42 4.104 6.476 -5.079 350 HG21 ILE 42 HG21 ILE 42 2.589 3.152 -4.149 351 HG22 ILE 42 HG22 ILE 42 1.825 4.236 -2.988 352 HG23 ILE 42 HG23 ILE 42 0.903 3.686 -4.385 353 HD11 ILE 42 HD11 ILE 42 4.765 6.710 -2.768 354 HD12 ILE 42 HD12 ILE 42 3.041 7.080 -2.899 355 HD13 ILE 42 HD13 ILE 42 3.586 5.512 -2.245 356 H PHE 43 H PHE 43 1.799 2.408 -6.799 357 HA PHE 43 HA PHE 43 4.411 1.264 -6.546 358 HB2 PHE 43 HB2 PHE 43 3.055 -0.489 -6.329 359 HB3 PHE 43 HB3 PHE 43 1.715 0.329 -7.098 360 HD1 PHE 43 HD1 PHE 43 1.379 0.230 -9.549 361 HD2 PHE 43 HD2 PHE 43 4.458 -2.135 -7.605 362 HE1 PHE 43 HE1 PHE 43 1.387 -1.360 -11.444 363 HE2 PHE 43 HE2 PHE 43 4.493 -3.639 -9.540 364 HZ PHE 43 HZ PHE 43 2.845 -3.355 -11.399 365 H ASP 44 H ASP 44 2.760 2.782 -9.314 366 HA ASP 44 HA ASP 44 4.633 1.682 -11.298 367 HB2 ASP 44 HB2 ASP 44 2.204 3.375 -11.340 368 HB3 ASP 44 HB3 ASP 44 3.469 3.935 -12.439 369 H ASP 45 H ASP 45 4.438 4.434 -9.181 370 HA ASP 45 HA ASP 45 6.551 5.959 -10.464 371 HB2 ASP 45 HB2 ASP 45 4.474 6.473 -8.633 372 HB3 ASP 45 HB3 ASP 45 5.904 6.564 -7.631 373 H LEU 46 H LEU 46 6.212 3.824 -7.726 374 HA LEU 46 HA LEU 46 8.843 4.070 -6.607 375 HB2 LEU 46 HB2 LEU 46 6.830 3.604 -5.319 376 HB3 LEU 46 HB3 LEU 46 6.522 2.136 -6.216 377 HG LEU 46 HG LEU 46 7.348 1.847 -3.905 378 HD11 LEU 46 HD11 LEU 46 9.385 0.495 -5.657 379 HD12 LEU 46 HD12 LEU 46 8.470 -0.115 -4.294 380 HD13 LEU 46 HD13 LEU 46 7.654 0.129 -5.833 381 HD21 LEU 46 HD21 LEU 46 10.007 2.895 -4.956 382 HD22 LEU 46 HD22 LEU 46 8.940 3.667 -3.765 383 HD23 LEU 46 HD23 LEU 46 9.754 2.150 -3.385 384 H ILE 47 H ILE 47 7.332 1.604 -8.784 385 HA ILE 47 HA ILE 47 9.280 -0.380 -8.496 386 HB ILE 47 HB ILE 47 7.084 -0.411 -9.713 387 HG12 ILE 47 HG12 ILE 47 8.962 -2.216 -9.758 388 HG13 ILE 47 HG13 ILE 47 7.477 -2.363 -10.666 389 HG21 ILE 47 HG21 ILE 47 7.348 1.496 -11.191 390 HG22 ILE 47 HG22 ILE 47 8.687 0.740 -12.054 391 HG23 ILE 47 HG23 ILE 47 7.072 0.059 -12.185 392 HD11 ILE 47 HD11 ILE 47 8.537 -1.759 -12.730 393 HD12 ILE 47 HD12 ILE 47 10.038 -1.331 -11.897 394 HD13 ILE 47 HD13 ILE 47 9.510 -3.022 -11.940 395 H ASP 48 H ASP 48 9.497 2.713 -10.119 396 HA ASP 48 HA ASP 48 11.566 2.233 -11.975 397 HB2 ASP 48 HB2 ASP 48 10.442 4.594 -10.571 398 HB3 ASP 48 HB3 ASP 48 12.114 4.795 -11.060 399 H PHE 49 H PHE 49 11.713 2.876 -8.468 400 HA PHE 49 HA PHE 49 14.572 3.093 -8.338 401 HB2 PHE 49 HB2 PHE 49 12.446 3.624 -6.635 402 HB3 PHE 49 HB3 PHE 49 13.121 2.196 -5.896 403 HD1 PHE 49 HD1 PHE 49 15.370 2.280 -4.840 404 HD2 PHE 49 HD2 PHE 49 13.717 5.730 -6.822 405 HE1 PHE 49 HE1 PHE 49 17.039 3.722 -3.711 406 HE2 PHE 49 HE2 PHE 49 15.464 7.147 -5.794 407 HZ PHE 49 HZ PHE 49 17.076 6.170 -4.166 408 H TYR 50 H TYR 50 12.327 0.402 -8.359 409 HA TYR 50 HA TYR 50 14.207 -1.552 -7.233 410 HB2 TYR 50 HB2 TYR 50 12.054 -2.260 -6.860 411 HB3 TYR 50 HB3 TYR 50 11.415 -1.587 -8.341 412 HD1 TYR 50 HD1 TYR 50 13.372 -4.448 -6.956 413 HD2 TYR 50 HD2 TYR 50 11.358 -2.805 -10.387 414 HE1 TYR 50 HE1 TYR 50 13.572 -6.621 -8.109 415 HE2 TYR 50 HE2 TYR 50 11.532 -4.972 -11.563 416 HH TYR 50 HH TYR 50 13.172 -7.811 -10.017 417 H GLU 51 H GLU 51 13.200 -0.322 -10.406 418 HA GLU 51 HA GLU 51 14.717 -2.272 -11.936 419 HB2 GLU 51 HB2 GLU 51 13.321 0.370 -12.513 420 HB3 GLU 51 HB3 GLU 51 14.344 -0.359 -13.749 421 HG2 GLU 51 HG2 GLU 51 12.180 -1.965 -12.358 422 HG3 GLU 51 HG3 GLU 51 11.819 -0.932 -13.730 423 H ARG 52 H ARG 52 15.513 0.733 -10.360 424 HA ARG 52 HA ARG 52 17.872 1.218 -11.968 425 HB2 ARG 52 HB2 ARG 52 16.482 2.940 -10.722 426 HB3 ARG 52 HB3 ARG 52 17.132 2.315 -9.209 427 HG2 ARG 52 HG2 ARG 52 18.370 4.298 -9.836 428 HG3 ARG 52 HG3 ARG 52 19.392 2.890 -9.901 429 HD2 ARG 52 HD2 ARG 52 20.088 3.733 -11.879 430 HD3 ARG 52 HD3 ARG 52 18.654 2.980 -12.537 431 HE ARG 52 HE ARG 52 17.749 5.031 -12.953 432 HH11 ARG 52 HH11 ARG 52 20.480 5.412 -10.711 433 HH12 ARG 52 HH12 ARG 52 20.374 7.131 -10.627 434 HH21 ARG 52 HH21 ARG 52 17.819 7.349 -13.109 435 HH22 ARG 52 HH22 ARG 52 18.959 8.239 -12.110 436 H LEU 53 H LEU 53 17.198 -0.804 -9.240 437 HA LEU 53 HA LEU 53 19.697 -0.957 -7.996 438 HB2 LEU 53 HB2 LEU 53 17.790 -3.269 -8.538 439 HB3 LEU 53 HB3 LEU 53 18.981 -3.184 -7.237 440 HG LEU 53 HG LEU 53 16.529 -1.419 -7.514 441 HD11 LEU 53 HD11 LEU 53 17.089 -3.722 -5.629 442 HD12 LEU 53 HD12 LEU 53 15.612 -2.718 -5.678 443 HD13 LEU 53 HD13 LEU 53 16.010 -3.758 -7.040 444 HD21 LEU 53 HD21 LEU 53 17.049 -0.554 -5.305 445 HD22 LEU 53 HD22 LEU 53 18.558 -1.509 -5.271 446 HD23 LEU 53 HD23 LEU 53 18.321 -0.181 -6.434 447 H ASP 54 H ASP 54 21.429 -2.255 -8.165 448 HA ASP 54 HA ASP 54 22.398 -3.076 -10.773 449 HB2 ASP 54 HB2 ASP 54 23.898 -2.166 -9.081 450 HB3 ASP 54 HB3 ASP 54 23.350 -3.331 -7.877 451 H THR 55 H THR 55 20.999 -4.612 -7.922 452 HA THR 55 HA THR 55 20.839 -7.216 -9.312 453 HB THR 55 HB THR 55 21.431 -7.795 -6.627 454 HG1 THR 55 HG1 THR 55 23.442 -6.090 -7.692 455 HG21 THR 55 HG21 THR 55 23.454 -8.804 -7.542 456 HG22 THR 55 HG22 THR 55 22.098 -9.095 -8.652 457 HG23 THR 55 HG23 THR 55 23.299 -7.844 -9.031 458 HA PRO 56 HA PRO 56 16.813 -5.906 -7.643 459 HB2 PRO 56 HB2 PRO 56 15.298 -6.853 -9.693 460 HB3 PRO 56 HB3 PRO 56 16.165 -5.303 -9.756 461 HG2 PRO 56 HG2 PRO 56 16.930 -7.976 -10.948 462 HG3 PRO 56 HG3 PRO 56 17.047 -6.339 -11.678 463 HD2 PRO 56 HD2 PRO 56 19.146 -7.664 -10.468 464 HD3 PRO 56 HD3 PRO 56 19.026 -5.882 -10.557 465 HA PRO 57 HA PRO 57 16.726 -10.129 -5.973 466 HB2 PRO 57 HB2 PRO 57 15.194 -9.757 -3.747 467 HB3 PRO 57 HB3 PRO 57 16.888 -9.233 -3.894 468 HG2 PRO 57 HG2 PRO 57 14.397 -7.548 -4.306 469 HG3 PRO 57 HG3 PRO 57 15.858 -7.157 -3.338 470 HD2 PRO 57 HD2 PRO 57 15.506 -6.257 -5.892 471 HD3 PRO 57 HD3 PRO 57 17.117 -6.698 -5.262 472 H PHE 58 H PHE 58 13.402 -8.707 -5.505 473 HA PHE 58 HA PHE 58 12.324 -11.238 -6.640 474 HB2 PHE 58 HB2 PHE 58 11.555 -9.559 -4.409 475 HB3 PHE 58 HB3 PHE 58 10.260 -9.587 -5.559 476 HD1 PHE 58 HD1 PHE 58 9.546 -11.978 -6.505 477 HD2 PHE 58 HD2 PHE 58 11.844 -11.374 -2.901 478 HE1 PHE 58 HE1 PHE 58 8.766 -14.149 -5.632 479 HE2 PHE 58 HE2 PHE 58 11.083 -13.550 -2.051 480 HZ PHE 58 HZ PHE 58 9.517 -14.947 -3.393 481 H SER 59 H SER 59 10.768 -11.257 -8.277 482 HA SER 59 HA SER 59 10.986 -9.284 -10.257 483 HB2 SER 59 HB2 SER 59 8.731 -11.294 -9.854 484 HB3 SER 59 HB3 SER 59 9.296 -10.593 -11.375 485 HG SER 59 HG SER 59 10.431 -12.372 -11.422 486 H LYS 60 H LYS 60 9.678 -7.547 -10.826 487 HA LYS 60 HA LYS 60 8.316 -5.954 -9.048 488 HB2 LYS 60 HB2 LYS 60 7.379 -4.846 -11.040 489 HB3 LYS 60 HB3 LYS 60 9.091 -5.234 -11.186 490 HG2 LYS 60 HG2 LYS 60 8.290 -7.385 -12.474 491 HG3 LYS 60 HG3 LYS 60 6.746 -6.569 -12.593 492 HD2 LYS 60 HD2 LYS 60 9.407 -5.391 -13.529 493 HD3 LYS 60 HD3 LYS 60 8.300 -6.313 -14.558 494 HE2 LYS 60 HE2 LYS 60 6.488 -4.636 -13.908 495 HE3 LYS 60 HE3 LYS 60 7.764 -3.680 -13.140 496 HZ1 LYS 60 HZ1 LYS 60 8.849 -3.645 -15.377 497 HZ2 LYS 60 HZ2 LYS 60 7.486 -4.329 -16.006 498 HZ3 LYS 60 HZ3 LYS 60 7.433 -2.847 -15.310 499 H LYS 61 H LYS 61 6.913 -8.671 -10.746 500 HA LYS 61 HA LYS 61 4.158 -8.154 -10.351 501 HB2 LYS 61 HB2 LYS 61 5.867 -10.651 -10.638 502 HB3 LYS 61 HB3 LYS 61 4.138 -10.792 -10.391 503 HG2 LYS 61 HG2 LYS 61 5.229 -8.989 -12.589 504 HG3 LYS 61 HG3 LYS 61 5.097 -10.727 -12.849 505 HD2 LYS 61 HD2 LYS 61 2.734 -9.023 -11.960 506 HD3 LYS 61 HD3 LYS 61 3.141 -9.360 -13.656 507 HE2 LYS 61 HE2 LYS 61 3.063 -11.803 -13.183 508 HE3 LYS 61 HE3 LYS 61 2.607 -11.468 -11.505 509 HZ1 LYS 61 HZ1 LYS 61 0.800 -12.029 -13.033 510 HZ2 LYS 61 HZ2 LYS 61 0.548 -10.605 -12.223 511 HZ3 LYS 61 HZ3 LYS 61 1.031 -10.619 -13.822 512 H SER 62 H SER 62 6.567 -9.728 -8.076 513 HA SER 62 HA SER 62 4.430 -10.378 -6.243 514 HB2 SER 62 HB2 SER 62 6.253 -10.956 -4.684 515 HB3 SER 62 HB3 SER 62 6.479 -11.740 -6.253 516 HG SER 62 HG SER 62 8.371 -10.751 -5.347 517 H LEU 63 H LEU 63 6.784 -7.724 -6.639 518 HA LEU 63 HA LEU 63 6.353 -6.337 -4.256 519 HB2 LEU 63 HB2 LEU 63 8.062 -5.845 -5.920 520 HB3 LEU 63 HB3 LEU 63 6.879 -5.134 -7.007 521 HG LEU 63 HG LEU 63 7.270 -4.065 -4.200 522 HD11 LEU 63 HD11 LEU 63 8.946 -2.485 -4.976 523 HD12 LEU 63 HD12 LEU 63 9.513 -4.107 -5.352 524 HD13 LEU 63 HD13 LEU 63 8.845 -3.088 -6.649 525 HD21 LEU 63 HD21 LEU 63 5.342 -3.144 -5.461 526 HD22 LEU 63 HD22 LEU 63 6.582 -1.932 -5.145 527 HD23 LEU 63 HD23 LEU 63 6.470 -2.645 -6.765 528 H ARG 64 H ARG 64 4.472 -6.120 -7.307 529 HA ARG 64 HA ARG 64 2.625 -4.240 -6.261 530 HB2 ARG 64 HB2 ARG 64 2.916 -4.930 -8.708 531 HB3 ARG 64 HB3 ARG 64 2.059 -6.375 -8.383 532 HG2 ARG 64 HG2 ARG 64 0.761 -4.416 -9.434 533 HG3 ARG 64 HG3 ARG 64 -0.020 -5.294 -8.102 534 HD2 ARG 64 HD2 ARG 64 0.444 -3.512 -6.545 535 HD3 ARG 64 HD3 ARG 64 1.549 -2.744 -7.640 536 HE ARG 64 HE ARG 64 -0.216 -1.960 -8.988 537 HH11 ARG 64 HH11 ARG 64 -1.380 -3.501 -5.992 538 HH12 ARG 64 HH12 ARG 64 -2.863 -2.593 -6.000 539 HH21 ARG 64 HH21 ARG 64 -2.176 -0.976 -9.061 540 HH22 ARG 64 HH22 ARG 64 -3.469 -1.348 -7.946 541 H GLU 65 H GLU 65 2.271 -7.827 -6.522 542 HA GLU 65 HA GLU 65 -0.339 -7.876 -5.422 543 HB2 GLU 65 HB2 GLU 65 1.170 -9.675 -6.676 544 HB3 GLU 65 HB3 GLU 65 1.561 -10.209 -5.052 545 HG2 GLU 65 HG2 GLU 65 -1.319 -9.779 -6.034 546 HG3 GLU 65 HG3 GLU 65 -0.453 -11.254 -6.357 547 H ALA 66 H ALA 66 2.856 -7.942 -3.884 548 HA ALA 66 HA ALA 66 1.975 -8.473 -1.228 549 HB1 ALA 66 HB1 ALA 66 4.412 -7.200 -2.485 550 HB2 ALA 66 HB2 ALA 66 4.233 -7.296 -0.756 551 HB3 ALA 66 HB3 ALA 66 4.286 -8.803 -1.704 552 H LEU 67 H LEU 67 2.803 -5.347 -2.899 553 HA LEU 67 HA LEU 67 2.161 -3.665 -0.722 554 HB2 LEU 67 HB2 LEU 67 3.008 -3.294 -3.375 555 HB3 LEU 67 HB3 LEU 67 1.439 -2.524 -3.363 556 HG LEU 67 HG LEU 67 3.769 -1.930 -1.488 557 HD11 LEU 67 HD11 LEU 67 4.152 -1.214 -3.819 558 HD12 LEU 67 HD12 LEU 67 2.615 -0.314 -3.798 559 HD13 LEU 67 HD13 LEU 67 3.963 0.175 -2.743 560 HD21 LEU 67 HD21 LEU 67 1.037 -0.604 -1.688 561 HD22 LEU 67 HD22 LEU 67 1.766 -1.369 -0.266 562 HD23 LEU 67 HD23 LEU 67 2.443 0.137 -0.891 563 H SER 68 H SER 68 0.114 -5.162 -3.191 564 HA SER 68 HA SER 68 -2.272 -3.803 -2.804 565 HB2 SER 68 HB2 SER 68 -1.509 -5.725 -4.473 566 HB3 SER 68 HB3 SER 68 -2.308 -6.782 -3.294 567 HG SER 68 HG SER 68 -4.199 -5.681 -3.637 568 H TYR 69 H TYR 69 -0.801 -6.266 -0.687 569 HA TYR 69 HA TYR 69 -3.199 -6.813 0.858 570 HB2 TYR 69 HB2 TYR 69 -0.277 -7.435 1.130 571 HB3 TYR 69 HB3 TYR 69 -1.223 -7.395 2.605 572 HD1 TYR 69 HD1 TYR 69 -2.405 -9.267 3.283 573 HD2 TYR 69 HD2 TYR 69 -1.387 -8.845 -0.879 574 HE1 TYR 69 HE1 TYR 69 -3.316 -11.499 2.855 575 HE2 TYR 69 HE2 TYR 69 -2.327 -11.048 -1.337 576 HH TYR 69 HH TYR 69 -3.451 -12.910 -0.472 577 H TYR 70 H TYR 70 -0.445 -4.491 1.165 578 HA TYR 70 HA TYR 70 -1.237 -3.501 3.772 579 HB2 TYR 70 HB2 TYR 70 0.607 -2.562 1.591 580 HB3 TYR 70 HB3 TYR 70 0.023 -1.395 2.732 581 HD1 TYR 70 HD1 TYR 70 0.836 -4.976 3.607 582 HD2 TYR 70 HD2 TYR 70 2.040 -0.824 3.814 583 HE1 TYR 70 HE1 TYR 70 2.708 -5.584 5.069 584 HE2 TYR 70 HE2 TYR 70 3.883 -1.449 5.316 585 HH TYR 70 HH TYR 70 4.558 -4.716 6.494 586 H SER 71 H SER 71 -1.814 -2.441 0.380 587 HA SER 71 HA SER 71 -3.509 -0.240 1.042 588 HB2 SER 71 HB2 SER 71 -3.553 -1.937 -1.464 589 HB3 SER 71 HB3 SER 71 -4.083 -0.258 -1.278 590 HG SER 71 HG SER 71 -1.808 0.197 -0.733 591 H ALA 72 H ALA 72 -4.223 -3.700 0.842 592 HA ALA 72 HA ALA 72 -7.157 -3.255 0.953 593 HB1 ALA 72 HB1 ALA 72 -7.281 -5.657 0.449 594 HB2 ALA 72 HB2 ALA 72 -6.240 -4.846 -0.716 595 HB3 ALA 72 HB3 ALA 72 -5.514 -5.820 0.600 596 H SER 73 H SER 73 -4.860 -3.135 3.222 597 HA SER 73 HA SER 73 -5.542 -5.226 5.050 598 HB2 SER 73 HB2 SER 73 -4.248 -2.489 5.342 599 HB3 SER 73 HB3 SER 73 -4.514 -3.559 6.717 600 HG SER 73 HG SER 73 -3.266 -4.568 4.404 601 HA PRO 74 HA PRO 74 -9.392 -3.898 6.653 602 HB2 PRO 74 HB2 PRO 74 -9.154 -4.409 9.398 603 HB3 PRO 74 HB3 PRO 74 -9.560 -5.614 8.128 604 HG2 PRO 74 HG2 PRO 74 -6.916 -4.985 9.421 605 HG3 PRO 74 HG3 PRO 74 -7.589 -6.597 9.000 606 HD2 PRO 74 HD2 PRO 74 -5.704 -5.366 7.472 607 HD3 PRO 74 HD3 PRO 74 -7.004 -6.330 6.731 608 H ALA 75 H ALA 75 -6.665 -2.834 8.843 609 HA ALA 75 HA ALA 75 -8.035 -0.555 9.747 610 HB1 ALA 75 HB1 ALA 75 -5.055 -1.000 9.498 611 HB2 ALA 75 HB2 ALA 75 -5.854 0.199 10.532 612 HB3 ALA 75 HB3 ALA 75 -6.070 -1.536 10.854 613 H TYR 76 H TYR 76 -6.310 -0.994 6.646 614 HA TYR 76 HA TYR 76 -5.967 1.867 6.189 615 HB2 TYR 76 HB2 TYR 76 -4.728 0.236 4.685 616 HB3 TYR 76 HB3 TYR 76 -6.254 -0.458 4.198 617 HD1 TYR 76 HD1 TYR 76 -4.195 2.665 4.079 618 HD2 TYR 76 HD2 TYR 76 -7.588 0.554 2.473 619 HE1 TYR 76 HE1 TYR 76 -4.421 4.357 2.339 620 HE2 TYR 76 HE2 TYR 76 -7.924 2.344 0.787 621 HH TYR 76 HH TYR 76 -7.321 4.574 0.240 622 H LEU 77 H LEU 77 -8.378 -0.520 5.135 623 HA LEU 77 HA LEU 77 -10.090 1.404 3.951 624 HB2 LEU 77 HB2 LEU 77 -10.832 -1.331 5.019 625 HB3 LEU 77 HB3 LEU 77 -11.709 -0.416 3.812 626 HG LEU 77 HG LEU 77 -8.822 -1.316 3.362 627 HD11 LEU 77 HD11 LEU 77 -10.178 -3.238 3.971 628 HD12 LEU 77 HD12 LEU 77 -11.325 -2.847 2.669 629 HD13 LEU 77 HD13 LEU 77 -9.647 -3.299 2.280 630 HD21 LEU 77 HD21 LEU 77 -11.043 -0.574 1.424 631 HD22 LEU 77 HD22 LEU 77 -9.705 0.458 1.868 632 HD23 LEU 77 HD23 LEU 77 -9.373 -1.057 1.012 633 H SER 78 H SER 78 -10.238 -0.187 7.145 634 HA SER 78 HA SER 78 -12.558 1.160 8.047 635 HB2 SER 78 HB2 SER 78 -11.180 -0.870 9.063 636 HB3 SER 78 HB3 SER 78 -10.379 0.402 9.994 637 HG SER 78 HG SER 78 -12.594 1.062 10.614 638 H CYS 79 H CYS 79 -9.386 2.549 7.571 639 HA CYS 79 HA CYS 79 -9.897 4.721 9.521 640 HB2 CYS 79 HB2 CYS 79 -7.689 3.556 9.381 641 HB3 CYS 79 HB3 CYS 79 -7.456 4.310 7.785 642 HG CYS 79 HG CYS 79 -6.067 5.402 9.788 643 H GLN 80 H GLN 80 -11.070 4.064 6.587 644 HA GLN 80 HA GLN 80 -10.701 5.876 4.671 645 HB2 GLN 80 HB2 GLN 80 -13.202 5.917 4.370 646 HB3 GLN 80 HB3 GLN 80 -12.453 4.343 4.382 647 HG2 GLN 80 HG2 GLN 80 -13.576 3.659 6.277 648 HG3 GLN 80 HG3 GLN 80 -13.483 5.234 7.043 649 HE21 GLN 80 HE21 GLN 80 -14.899 6.961 6.226 650 HE22 GLN 80 HE22 GLN 80 -16.492 6.528 5.658 651 H LYS 81 H LYS 81 -9.884 7.893 5.254 652 HA LYS 81 HA LYS 81 -11.876 9.854 6.193 653 HB2 LYS 81 HB2 LYS 81 -9.068 9.346 7.133 654 HB3 LYS 81 HB3 LYS 81 -9.713 10.994 7.128 655 HG2 LYS 81 HG2 LYS 81 -11.658 10.264 8.453 656 HG3 LYS 81 HG3 LYS 81 -11.034 8.608 8.499 657 HD2 LYS 81 HD2 LYS 81 -9.046 9.322 9.715 658 HD3 LYS 81 HD3 LYS 81 -9.506 11.041 9.528 659 HE2 LYS 81 HE2 LYS 81 -11.618 10.587 10.735 660 HE3 LYS 81 HE3 LYS 81 -11.102 8.912 11.003 661 HZ1 LYS 81 HZ1 LYS 81 -9.311 9.688 12.338 662 HZ2 LYS 81 HZ2 LYS 81 -9.555 11.263 11.899 663 HZ3 LYS 81 HZ3 LYS 81 -10.653 10.526 12.855 664 HA PRO 82 HA PRO 82 -10.395 11.520 2.213 665 HB2 PRO 82 HB2 PRO 82 -12.405 13.344 1.825 666 HB3 PRO 82 HB3 PRO 82 -12.699 11.597 1.641 667 HG2 PRO 82 HG2 PRO 82 -13.268 13.349 4.030 668 HG3 PRO 82 HG3 PRO 82 -14.331 12.135 3.269 669 HD2 PRO 82 HD2 PRO 82 -12.763 11.680 5.503 670 HD3 PRO 82 HD3 PRO 82 -13.220 10.368 4.357 671 H ASP 83 H ASP 83 -10.294 14.087 1.623 672 HA ASP 83 HA ASP 83 -9.176 16.014 1.972 673 HB2 ASP 83 HB2 ASP 83 -11.319 16.250 3.320 674 HB3 ASP 83 HB3 ASP 83 -10.355 15.988 4.765 675 H THR 84 H THR 84 -7.977 13.483 2.996 676 HA THR 84 HA THR 84 -6.135 13.953 5.075 677 HB THR 84 HB THR 84 -7.181 11.870 4.434 678 HG1 THR 84 HG1 THR 84 -5.615 10.735 5.049 679 HG21 THR 84 HG21 THR 84 -7.119 12.174 1.916 680 HG22 THR 84 HG22 THR 84 -5.390 11.748 1.986 681 HG23 THR 84 HG23 THR 84 -6.642 10.591 2.497 682 H ALA 85 H ALA 85 -5.690 14.486 1.595 683 HA ALA 85 HA ALA 85 -3.908 15.349 0.405 684 HB1 ALA 85 HB1 ALA 85 -2.675 17.062 1.353 685 HB2 ALA 85 HB2 ALA 85 -4.166 17.047 2.289 686 HB3 ALA 85 HB3 ALA 85 -2.692 16.323 2.967 687 H ARG 86 H ARG 86 -3.400 13.330 -0.332 688 HA ARG 86 HA ARG 86 -1.652 11.512 1.183 689 HB2 ARG 86 HB2 ARG 86 -2.318 11.605 -1.799 690 HB3 ARG 86 HB3 ARG 86 -1.429 10.333 -1.007 691 HG2 ARG 86 HG2 ARG 86 -3.415 9.321 -1.010 692 HG3 ARG 86 HG3 ARG 86 -3.538 10.159 0.526 693 HD2 ARG 86 HD2 ARG 86 -5.572 10.226 -0.849 694 HD3 ARG 86 HD3 ARG 86 -4.982 11.820 -0.365 695 HE ARG 86 HE ARG 86 -4.793 12.403 -2.522 696 HH11 ARG 86 HH11 ARG 86 -4.146 8.898 -2.663 697 HH12 ARG 86 HH12 ARG 86 -4.847 8.720 -4.226 698 HH21 ARG 86 HH21 ARG 86 -5.461 12.208 -4.690 699 HH22 ARG 86 HH22 ARG 86 -5.102 10.787 -5.550 700 H VAL 87 H VAL 87 0.455 10.751 0.075 701 HA VAL 87 HA VAL 87 1.952 12.909 -1.213 702 HB VAL 87 HB VAL 87 3.844 12.496 0.370 703 HG11 VAL 87 HG11 VAL 87 3.008 13.899 2.167 704 HG12 VAL 87 HG12 VAL 87 2.303 14.445 0.660 705 HG13 VAL 87 HG13 VAL 87 1.331 13.493 1.797 706 HG21 VAL 87 HG21 VAL 87 3.405 11.449 2.547 707 HG22 VAL 87 HG22 VAL 87 1.755 11.033 2.064 708 HG23 VAL 87 HG23 VAL 87 3.130 10.284 1.233 709 H ASP 88 H ASP 88 3.897 12.108 -2.226 710 HA ASP 88 HA ASP 88 3.583 9.358 -3.290 711 HB2 ASP 88 HB2 ASP 88 4.582 10.106 -5.237 712 HB3 ASP 88 HB3 ASP 88 3.454 11.389 -4.806 713 H ILE 89 H ILE 89 6.062 8.843 -4.241 714 HA ILE 89 HA ILE 89 7.488 7.912 -1.975 715 HB ILE 89 HB ILE 89 9.211 7.256 -3.689 716 HG12 ILE 89 HG12 ILE 89 7.493 8.893 -5.586 717 HG13 ILE 89 HG13 ILE 89 9.207 9.070 -5.178 718 HG21 ILE 89 HG21 ILE 89 7.131 5.911 -3.177 719 HG22 ILE 89 HG22 ILE 89 6.417 6.601 -4.663 720 HG23 ILE 89 HG23 ILE 89 7.883 5.610 -4.743 721 HD11 ILE 89 HD11 ILE 89 8.940 8.156 -7.386 722 HD12 ILE 89 HD12 ILE 89 9.694 6.945 -6.329 723 HD13 ILE 89 HD13 ILE 89 7.982 6.808 -6.765 724 H TYR 90 H TYR 90 7.752 10.976 -3.776 725 HA TYR 90 HA TYR 90 10.361 11.667 -2.689 726 HB2 TYR 90 HB2 TYR 90 8.224 13.224 -4.181 727 HB3 TYR 90 HB3 TYR 90 9.771 13.866 -3.721 728 HD1 TYR 90 HD1 TYR 90 8.212 11.115 -5.824 729 HD2 TYR 90 HD2 TYR 90 11.562 13.764 -5.196 730 HE1 TYR 90 HE1 TYR 90 9.195 10.344 -7.914 731 HE2 TYR 90 HE2 TYR 90 12.587 12.941 -7.284 732 HH TYR 90 HH TYR 90 12.524 11.114 -8.831 733 H GLY 91 H GLY 91 7.107 11.612 -1.526 734 HA2 GLY 91 HA2 GLY 91 6.308 12.183 0.539 735 HA3 GLY 91 HA3 GLY 91 7.771 13.114 0.889 736 H ASN 92 H ASN 92 6.622 14.036 -2.207 737 HA ASN 92 HA ASN 92 5.965 16.676 -1.367 738 HB2 ASN 92 HB2 ASN 92 5.551 15.101 -3.962 739 HB3 ASN 92 HB3 ASN 92 5.125 16.802 -3.798 740 HD21 ASN 92 HD21 ASN 92 7.479 15.098 -5.216 741 HD22 ASN 92 HD22 ASN 92 8.881 15.999 -4.682 742 H GLU 93 H GLU 93 3.983 17.786 -1.471 743 HA GLU 93 HA GLU 93 1.814 16.220 -0.463 744 HB2 GLU 93 HB2 GLU 93 2.484 19.123 -0.874 745 HB3 GLU 93 HB3 GLU 93 0.799 18.684 -0.896 746 HG2 GLU 93 HG2 GLU 93 1.014 17.616 1.344 747 HG3 GLU 93 HG3 GLU 93 2.726 18.012 1.353 748 H VAL 94 H VAL 94 0.263 15.320 -1.597 749 HA VAL 94 HA VAL 94 -0.315 16.199 -4.316 750 HB VAL 94 HB VAL 94 -0.641 14.198 -5.227 751 HG11 VAL 94 HG11 VAL 94 1.742 14.887 -4.952 752 HG12 VAL 94 HG12 VAL 94 1.868 13.814 -3.552 753 HG13 VAL 94 HG13 VAL 94 1.538 13.139 -5.157 754 HG21 VAL 94 HG21 VAL 94 -0.563 12.029 -4.308 755 HG22 VAL 94 HG22 VAL 94 -0.112 12.630 -2.725 756 HG23 VAL 94 HG23 VAL 94 -1.747 12.973 -3.383 757 H ASP 95 H ASP 95 -2.776 15.066 -4.774 758 HA ASP 95 HA ASP 95 -4.350 16.933 -3.212 759 HB2 ASP 95 HB2 ASP 95 -6.095 16.300 -4.768 760 HB3 ASP 95 HB3 ASP 95 -4.600 16.404 -5.668 761 H VAL 96 H VAL 96 -6.780 15.907 -2.735 762 HA VAL 96 HA VAL 96 -6.273 13.748 -0.739 763 HB VAL 96 HB VAL 96 -7.905 14.679 0.625 764 HG11 VAL 96 HG11 VAL 96 -6.713 16.381 1.452 765 HG12 VAL 96 HG12 VAL 96 -5.681 16.304 -0.002 766 HG13 VAL 96 HG13 VAL 96 -7.037 17.388 0.058 767 HG21 VAL 96 HG21 VAL 96 -9.272 16.735 0.025 768 HG22 VAL 96 HG22 VAL 96 -8.696 16.549 -1.624 769 HG23 VAL 96 HG23 VAL 96 -9.658 15.270 -0.867 770 H VAL 97 H VAL 97 -8.026 12.388 -0.201 771 HA VAL 97 HA VAL 97 -9.257 11.247 -2.595 772 HB VAL 97 HB VAL 97 -9.866 10.475 0.303 773 HG11 VAL 97 HG11 VAL 97 -11.322 9.475 -1.393 774 HG12 VAL 97 HG12 VAL 97 -9.921 8.882 -2.308 775 HG13 VAL 97 HG13 VAL 97 -10.290 8.240 -0.687 776 HG21 VAL 97 HG21 VAL 97 -7.567 9.448 -1.401 777 HG22 VAL 97 HG22 VAL 97 -7.458 10.348 0.143 778 HG23 VAL 97 HG23 VAL 97 -8.123 8.725 0.126 779 H THR 98 H THR 98 -11.461 11.529 -3.262 780 HA THR 98 HA THR 98 -12.869 13.752 -2.191 781 HB THR 98 HB THR 98 -14.692 12.291 -3.686 782 HG1 THR 98 HG1 THR 98 -13.033 11.992 -5.556 783 HG21 THR 98 HG21 THR 98 -12.621 14.178 -4.873 784 HG22 THR 98 HG22 THR 98 -14.298 13.872 -5.404 785 HG23 THR 98 HG23 THR 98 -13.992 14.736 -3.904 786 HA PRO 99 HA PRO 99 -15.098 12.086 1.163 787 HB2 PRO 99 HB2 PRO 99 -17.800 12.574 0.529 788 HB3 PRO 99 HB3 PRO 99 -16.663 13.710 1.320 789 HG2 PRO 99 HG2 PRO 99 -17.464 13.549 -1.565 790 HG3 PRO 99 HG3 PRO 99 -17.167 14.990 -0.542 791 HD2 PRO 99 HD2 PRO 99 -15.335 14.118 -2.303 792 HD3 PRO 99 HD3 PRO 99 -14.821 14.748 -0.713 793 H GLU 100 H GLU 100 -16.824 11.331 -1.859 794 HA GLU 100 HA GLU 100 -17.929 8.881 -0.940 795 HB2 GLU 100 HB2 GLU 100 -17.628 10.133 -3.639 796 HB3 GLU 100 HB3 GLU 100 -18.325 8.524 -3.408 797 HG2 GLU 100 HG2 GLU 100 -19.711 9.872 -1.461 798 HG3 GLU 100 HG3 GLU 100 -19.320 11.245 -2.485 799 H GLN 101 H GLN 101 -14.965 9.593 -2.836 800 HA GLN 101 HA GLN 101 -14.368 6.832 -3.303 801 HB2 GLN 101 HB2 GLN 101 -12.591 9.300 -3.264 802 HB3 GLN 101 HB3 GLN 101 -12.047 7.676 -3.699 803 HG2 GLN 101 HG2 GLN 101 -13.874 7.646 -5.485 804 HG3 GLN 101 HG3 GLN 101 -14.177 9.335 -5.121 805 HE21 GLN 101 HE21 GLN 101 -13.493 9.970 -7.332 806 HE22 GLN 101 HE22 GLN 101 -11.784 10.015 -7.733 807 H ALA 102 H ALA 102 -13.863 8.926 -0.460 808 HA ALA 102 HA ALA 102 -11.959 7.091 0.727 809 HB1 ALA 102 HB1 ALA 102 -13.610 9.321 1.980 810 HB2 ALA 102 HB2 ALA 102 -12.298 8.433 2.779 811 HB3 ALA 102 HB3 ALA 102 -11.945 9.439 1.363 812 H LYS 103 H LYS 103 -15.443 7.800 1.301 813 HA LYS 103 HA LYS 103 -15.810 5.754 3.219 814 HB2 LYS 103 HB2 LYS 103 -18.231 5.973 2.898 815 HB3 LYS 103 HB3 LYS 103 -17.482 7.567 3.004 816 HG2 LYS 103 HG2 LYS 103 -17.533 7.789 0.637 817 HG3 LYS 103 HG3 LYS 103 -18.178 6.172 0.363 818 HD2 LYS 103 HD2 LYS 103 -19.709 8.378 1.769 819 HD3 LYS 103 HD3 LYS 103 -19.809 7.967 0.039 820 HE2 LYS 103 HE2 LYS 103 -20.410 5.608 0.687 821 HE3 LYS 103 HE3 LYS 103 -20.548 6.164 2.359 822 HZ1 LYS 103 HZ1 LYS 103 -22.144 7.197 0.077 823 HZ2 LYS 103 HZ2 LYS 103 -22.661 6.131 1.229 824 HZ3 LYS 103 HZ3 LYS 103 -22.291 7.657 1.655 825 H TYR 104 H TYR 104 -15.809 5.528 -0.288 826 HA TYR 104 HA TYR 104 -17.189 3.174 -0.755 827 HB2 TYR 104 HB2 TYR 104 -16.420 4.326 -2.620 828 HB3 TYR 104 HB3 TYR 104 -14.842 4.612 -1.954 829 HD1 TYR 104 HD1 TYR 104 -16.534 2.837 -4.437 830 HD2 TYR 104 HD2 TYR 104 -13.180 2.566 -1.757 831 HE1 TYR 104 HE1 TYR 104 -15.468 1.208 -5.949 832 HE2 TYR 104 HE2 TYR 104 -12.101 0.926 -3.258 833 HH TYR 104 HH TYR 104 -13.451 0.093 -6.433 834 H ALA 105 H ALA 105 -14.080 3.610 0.818 835 HA ALA 105 HA ALA 105 -12.979 1.058 0.593 836 HB1 ALA 105 HB1 ALA 105 -11.881 3.083 1.558 837 HB2 ALA 105 HB2 ALA 105 -12.922 2.897 2.989 838 HB3 ALA 105 HB3 ALA 105 -11.724 1.653 2.599 839 H TYR 106 H TYR 106 -15.690 2.103 2.668 840 HA TYR 106 HA TYR 106 -15.702 0.074 4.566 841 HB2 TYR 106 HB2 TYR 106 -17.682 0.888 5.204 842 HB3 TYR 106 HB3 TYR 106 -17.222 2.230 4.200 843 HD1 TYR 106 HD1 TYR 106 -18.166 2.097 1.631 844 HD2 TYR 106 HD2 TYR 106 -19.722 -0.162 4.967 845 HE1 TYR 106 HE1 TYR 106 -20.376 1.941 0.518 846 HE2 TYR 106 HE2 TYR 106 -21.889 -0.358 3.843 847 HH TYR 106 HH TYR 106 -23.235 0.477 2.108 848 H GLN 107 H GLN 107 -17.059 -0.004 1.285 849 HA GLN 107 HA GLN 107 -18.373 -2.527 1.522 850 HB2 GLN 107 HB2 GLN 107 -18.684 -2.561 -0.693 851 HB3 GLN 107 HB3 GLN 107 -18.979 -0.943 -0.038 852 HG2 GLN 107 HG2 GLN 107 -16.375 -0.858 -1.142 853 HG3 GLN 107 HG3 GLN 107 -17.275 -1.922 -2.141 854 HE21 GLN 107 HE21 GLN 107 -18.508 1.002 -0.439 855 HE22 GLN 107 HE22 GLN 107 -18.925 1.907 -1.874 856 H ARG 108 H ARG 108 -15.381 -1.628 0.224 857 HA ARG 108 HA ARG 108 -14.253 -4.212 -0.365 858 HB2 ARG 108 HB2 ARG 108 -12.531 -1.952 0.709 859 HB3 ARG 108 HB3 ARG 108 -12.081 -3.146 -0.490 860 HG2 ARG 108 HG2 ARG 108 -14.076 -0.874 -0.967 861 HG3 ARG 108 HG3 ARG 108 -12.374 -0.750 -1.299 862 HD2 ARG 108 HD2 ARG 108 -13.979 -3.003 -2.538 863 HD3 ARG 108 HD3 ARG 108 -14.032 -1.376 -3.221 864 HE ARG 108 HE ARG 108 -11.323 -1.903 -2.898 865 HH11 ARG 108 HH11 ARG 108 -14.013 -2.996 -4.917 866 HH12 ARG 108 HH12 ARG 108 -13.035 -3.906 -6.022 867 HH21 ARG 108 HH21 ARG 108 -9.989 -2.667 -4.644 868 HH22 ARG 108 HH22 ARG 108 -10.668 -3.585 -5.926 869 H TYR 109 H TYR 109 -14.318 -2.419 2.745 870 HA TYR 109 HA TYR 109 -12.626 -4.263 4.172 871 HB2 TYR 109 HB2 TYR 109 -13.199 -1.960 4.917 872 HB3 TYR 109 HB3 TYR 109 -14.851 -2.422 5.204 873 HD1 TYR 109 HD1 TYR 109 -15.406 -4.298 6.947 874 HD2 TYR 109 HD2 TYR 109 -11.571 -2.293 6.713 875 HE1 TYR 109 HE1 TYR 109 -14.765 -5.260 9.102 876 HE2 TYR 109 HE2 TYR 109 -11.002 -3.172 8.942 877 HH TYR 109 HH TYR 109 -13.035 -5.509 10.732 878 H GLN 110 H GLN 110 -16.233 -3.869 4.066 879 HA GLN 110 HA GLN 110 -16.683 -6.184 5.655 880 HB2 GLN 110 HB2 GLN 110 -18.991 -5.992 5.147 881 HB3 GLN 110 HB3 GLN 110 -18.354 -4.370 5.403 882 HG2 GLN 110 HG2 GLN 110 -18.282 -3.963 3.031 883 HG3 GLN 110 HG3 GLN 110 -18.829 -5.593 2.643 884 HE21 GLN 110 HE21 GLN 110 -21.073 -6.148 3.087 885 HE22 GLN 110 HE22 GLN 110 -22.251 -4.842 3.099 886 H GLU 111 H GLU 111 -16.120 -5.833 2.189 887 HA GLU 111 HA GLU 111 -17.211 -8.282 1.320 888 HB2 GLU 111 HB2 GLU 111 -14.973 -6.495 0.339 889 HB3 GLU 111 HB3 GLU 111 -15.221 -8.066 -0.428 890 HG2 GLU 111 HG2 GLU 111 -17.538 -6.131 -0.049 891 HG3 GLU 111 HG3 GLU 111 -16.402 -5.961 -1.385 892 H ARG 112 H ARG 112 -13.993 -7.653 2.710 893 HA ARG 112 HA ARG 112 -13.486 -10.609 2.799 894 HB2 ARG 112 HB2 ARG 112 -11.737 -8.146 2.889 895 HB3 ARG 112 HB3 ARG 112 -11.109 -9.678 3.464 896 HG2 ARG 112 HG2 ARG 112 -12.356 -9.455 0.697 897 HG3 ARG 112 HG3 ARG 112 -10.655 -9.049 0.986 898 HD2 ARG 112 HD2 ARG 112 -10.165 -11.267 1.800 899 HD3 ARG 112 HD3 ARG 112 -11.868 -11.738 1.758 900 HE ARG 112 HE ARG 112 -11.850 -11.507 -0.653 901 HH11 ARG 112 HH11 ARG 112 -8.786 -12.408 0.916 902 HH12 ARG 112 HH12 ARG 112 -8.080 -12.920 -0.595 903 HH21 ARG 112 HH21 ARG 112 -10.850 -12.146 -2.563 904 HH22 ARG 112 HH22 ARG 112 -9.212 -12.761 -2.561 905 H TYR 113 H TYR 113 -13.953 -7.905 5.042 906 HA TYR 113 HA TYR 113 -13.301 -9.714 7.328 907 HB2 TYR 113 HB2 TYR 113 -13.278 -6.694 7.234 908 HB3 TYR 113 HB3 TYR 113 -12.751 -7.710 8.570 909 HD1 TYR 113 HD1 TYR 113 -11.670 -5.888 5.724 910 HD2 TYR 113 HD2 TYR 113 -10.832 -9.464 7.978 911 HE1 TYR 113 HE1 TYR 113 -9.438 -6.024 4.661 912 HE2 TYR 113 HE2 TYR 113 -8.640 -9.662 6.872 913 HH TYR 113 HH TYR 113 -7.113 -8.594 5.534 914 H GLY 114 H GLY 114 -15.827 -9.358 5.689 915 HA2 GLY 114 HA2 GLY 114 -17.736 -9.264 7.914 916 HA3 GLY 114 HA3 GLY 114 -17.976 -8.103 6.580 917 H ASN 115 H ASN 115 -20.017 -9.458 6.333 918 HA ASN 115 HA ASN 115 -19.564 -11.519 4.287 919 HB2 ASN 115 HB2 ASN 115 -19.700 -12.615 6.646 920 HB3 ASN 115 HB3 ASN 115 -21.391 -12.108 6.648 921 HD21 ASN 115 HD21 ASN 115 -18.922 -14.027 4.919 922 HD22 ASN 115 HD22 ASN 115 -20.051 -15.014 4.019 923 H LYS 116 H LYS 116 -20.918 -10.861 2.590 924 HA LYS 116 HA LYS 116 -23.554 -9.748 3.295 925 HB2 LYS 116 HB2 LYS 116 -23.403 -8.065 1.612 926 HB3 LYS 116 HB3 LYS 116 -22.139 -7.861 2.783 927 HG2 LYS 116 HG2 LYS 116 -21.059 -7.342 0.828 928 HG3 LYS 116 HG3 LYS 116 -20.584 -9.028 0.999 929 HD2 LYS 116 HD2 LYS 116 -22.184 -9.701 -0.710 930 HD3 LYS 116 HD3 LYS 116 -22.942 -8.102 -0.689 931 HE2 LYS 116 HE2 LYS 116 -20.690 -7.171 -1.458 932 HE3 LYS 116 HE3 LYS 116 -20.169 -8.842 -1.697 933 HZ1 LYS 116 HZ1 LYS 116 -22.038 -9.090 -3.276 934 HZ2 LYS 116 HZ2 LYS 116 -22.420 -7.494 -3.077 935 HZ3 LYS 116 HZ3 LYS 116 -21.000 -7.933 -3.738 936 H LYS 117 H LYS 117 -25.138 -10.024 1.788 937 HA LYS 117 HA LYS 117 -25.240 -12.586 0.572 938 HB2 LYS 117 HB2 LYS 117 -27.145 -11.272 1.540 939 HB3 LYS 117 HB3 LYS 117 -27.031 -10.119 0.197 940 HG2 LYS 117 HG2 LYS 117 -27.612 -11.899 -1.405 941 HG3 LYS 117 HG3 LYS 117 -27.562 -13.091 -0.097 942 HD2 LYS 117 HD2 LYS 117 -29.477 -11.872 1.001 943 HD3 LYS 117 HD3 LYS 117 -29.507 -10.743 -0.356 944 HE2 LYS 117 HE2 LYS 117 -31.231 -12.574 -0.480 945 HE3 LYS 117 HE3 LYS 117 -30.172 -12.472 -1.902 946 HZ1 LYS 117 HZ1 LYS 117 -30.537 -14.793 -0.963 947 HZ2 LYS 117 HZ2 LYS 117 -29.023 -14.327 -1.254 948 HZ3 LYS 117 HZ3 LYS 117 -29.579 -14.333 0.309 949 H SER 118 H SER 118 -25.242 -13.228 -1.634 950 HA SER 118 HA SER 118 -23.583 -11.757 -3.378 951 HB2 SER 118 HB2 SER 118 -24.450 -13.596 -4.992 952 HB3 SER 118 HB3 SER 118 -23.523 -14.074 -3.567 953 HG SER 118 HG SER 118 -25.309 -15.358 -3.853 954 H GLN 119 H GLN 119 -24.277 -11.311 -5.674 955 HA GLN 119 HA GLN 119 -25.368 -10.095 -7.178 956 HB2 GLN 119 HB2 GLN 119 -27.203 -11.930 -6.595 957 HB3 GLN 119 HB3 GLN 119 -28.077 -10.547 -5.930 958 HG2 GLN 119 HG2 GLN 119 -27.688 -9.421 -8.234 959 HG3 GLN 119 HG3 GLN 119 -27.121 -10.982 -8.791 960 HE21 GLN 119 HE21 GLN 119 -29.631 -9.111 -9.263 961 HE22 GLN 119 HE22 GLN 119 -30.941 -10.285 -9.206 962 H ASP 120 H ASP 120 -27.483 -8.246 -7.042 963 HA ASP 120 HA ASP 120 -26.889 -6.404 -4.811 964 HB2 ASP 120 HB2 ASP 120 -26.737 -5.718 -7.783 965 HB3 ASP 120 HB3 ASP 120 -26.536 -4.605 -6.436 966 H LEU 121 H LEU 121 -28.509 -4.558 -4.962 967 HA LEU 121 HA LEU 121 -31.131 -5.488 -6.058 968 HB2 LEU 121 HB2 LEU 121 -30.558 -3.560 -3.777 969 HB3 LEU 121 HB3 LEU 121 -32.148 -4.042 -4.373 970 HG LEU 121 HG LEU 121 -30.098 -5.808 -2.969 971 HD11 LEU 121 HD11 LEU 121 -31.837 -6.005 -1.243 972 HD12 LEU 121 HD12 LEU 121 -31.398 -4.312 -1.513 973 HD13 LEU 121 HD13 LEU 121 -32.916 -4.950 -2.189 974 HD21 LEU 121 HD21 LEU 121 -31.134 -7.227 -4.635 975 HD22 LEU 121 HD22 LEU 121 -31.813 -7.619 -3.059 976 HD23 LEU 121 HD23 LEU 121 -32.757 -6.632 -4.201 977 H LYS 122 H LYS 122 -31.970 -4.264 -7.670 978 HA LYS 122 HA LYS 122 -30.276 -2.303 -8.929 979 HB2 LYS 122 HB2 LYS 122 -31.774 -3.863 -10.170 980 HB3 LYS 122 HB3 LYS 122 -33.190 -3.001 -9.506 981 HG2 LYS 122 HG2 LYS 122 -32.644 -0.995 -10.667 982 HG3 LYS 122 HG3 LYS 122 -30.987 -1.545 -10.995 983 HD2 LYS 122 HD2 LYS 122 -31.872 -3.228 -12.579 984 HD3 LYS 122 HD3 LYS 122 -33.527 -2.611 -12.290 985 HE2 LYS 122 HE2 LYS 122 -32.841 -0.355 -12.993 986 HE3 LYS 122 HE3 LYS 122 -31.158 -0.868 -13.103 987 HZ1 LYS 122 HZ1 LYS 122 -33.297 -1.833 -14.892 988 HZ2 LYS 122 HZ2 LYS 122 -32.108 -0.731 -15.233 989 HZ3 LYS 122 HZ3 LYS 122 -31.699 -2.264 -14.960 Start of MODEL 11 1 H1 GLY 1 H GLY 1 29.472 -0.003 7.687 2 HA2 GLY 1 HA2 GLY 1 31.379 -1.557 7.753 3 HA3 GLY 1 HA3 GLY 1 29.820 -2.388 7.927 4 H SER 2 H SER 2 31.547 -4.171 7.123 5 HA SER 2 HA SER 2 32.237 -4.203 4.370 6 HB2 SER 2 HB2 SER 2 31.823 -6.634 6.142 7 HB3 SER 2 HB3 SER 2 33.022 -6.383 4.861 8 HG SER 2 HG SER 2 34.004 -6.138 6.876 9 H ASN 3 H ASN 3 29.374 -5.242 6.190 10 HA ASN 3 HA ASN 3 27.823 -5.693 3.754 11 HB2 ASN 3 HB2 ASN 3 28.984 -7.895 4.835 12 HB3 ASN 3 HB3 ASN 3 27.633 -7.788 5.937 13 HD21 ASN 3 HD21 ASN 3 28.273 -9.835 3.750 14 HD22 ASN 3 HD22 ASN 3 26.741 -9.844 2.872 15 H GLN 4 H GLN 4 25.439 -6.285 4.707 16 HA GLN 4 HA GLN 4 24.965 -4.856 7.222 17 HB2 GLN 4 HB2 GLN 4 23.565 -4.338 4.561 18 HB3 GLN 4 HB3 GLN 4 22.932 -3.757 6.088 19 HG2 GLN 4 HG2 GLN 4 25.633 -2.933 4.967 20 HG3 GLN 4 HG3 GLN 4 24.137 -2.038 4.761 21 HE21 GLN 4 HE21 GLN 4 26.394 -3.220 7.276 22 HE22 GLN 4 HE22 GLN 4 25.939 -2.019 8.491 23 H GLN 5 H GLN 5 22.393 -5.115 7.661 24 HA GLN 5 HA GLN 5 21.377 -7.787 7.033 25 HB2 GLN 5 HB2 GLN 5 21.132 -8.248 9.523 26 HB3 GLN 5 HB3 GLN 5 22.705 -8.500 8.781 27 HG2 GLN 5 HG2 GLN 5 23.568 -6.397 9.716 28 HG3 GLN 5 HG3 GLN 5 21.998 -6.013 10.414 29 HE21 GLN 5 HE21 GLN 5 21.230 -7.319 12.248 30 HE22 GLN 5 HE22 GLN 5 22.399 -8.283 13.165 31 H LEU 6 H LEU 6 19.746 -6.587 6.088 32 HA LEU 6 HA LEU 6 17.711 -5.460 7.964 33 HB2 LEU 6 HB2 LEU 6 18.514 -4.161 5.322 34 HB3 LEU 6 HB3 LEU 6 17.049 -3.833 6.223 35 HG LEU 6 HG LEU 6 18.644 -3.175 8.200 36 HD11 LEU 6 HD11 LEU 6 20.779 -3.874 7.167 37 HD12 LEU 6 HD12 LEU 6 20.478 -2.820 5.772 38 HD13 LEU 6 HD13 LEU 6 20.759 -2.129 7.373 39 HD21 LEU 6 HD21 LEU 6 18.305 -1.480 5.682 40 HD22 LEU 6 HD22 LEU 6 17.152 -1.618 7.035 41 HD23 LEU 6 HD23 LEU 6 18.719 -0.853 7.288 42 H ASN 7 H ASN 7 16.489 -7.412 7.817 43 HA ASN 7 HA ASN 7 14.958 -7.591 5.371 44 HB2 ASN 7 HB2 ASN 7 16.983 -9.027 4.827 45 HB3 ASN 7 HB3 ASN 7 16.504 -10.086 6.172 46 HD21 ASN 7 HD21 ASN 7 15.375 -11.917 5.254 47 HD22 ASN 7 HD22 ASN 7 14.095 -11.709 4.072 48 H ALA 8 H ALA 8 12.963 -8.517 5.682 49 HA ALA 8 HA ALA 8 11.927 -8.727 8.290 50 HB1 ALA 8 HB1 ALA 8 10.782 -10.118 5.847 51 HB2 ALA 8 HB2 ALA 8 9.901 -9.597 7.292 52 HB3 ALA 8 HB3 ALA 8 10.577 -8.375 6.199 53 H THR 9 H THR 9 10.914 -10.688 9.349 54 HA THR 9 HA THR 9 12.922 -12.748 9.481 55 HB THR 9 HB THR 9 10.395 -12.669 11.128 56 HG1 THR 9 HG1 THR 9 12.651 -10.945 11.240 57 HG21 THR 9 HG21 THR 9 13.315 -13.366 11.728 58 HG22 THR 9 HG22 THR 9 11.995 -13.381 12.903 59 HG23 THR 9 HG23 THR 9 11.978 -14.519 11.537 60 H LYS 10 H LYS 10 9.431 -12.823 8.435 61 HA LYS 10 HA LYS 10 10.093 -15.367 7.079 62 HB2 LYS 10 HB2 LYS 10 8.583 -16.731 8.183 63 HB3 LYS 10 HB3 LYS 10 9.438 -15.873 9.457 64 HG2 LYS 10 HG2 LYS 10 7.428 -15.477 10.373 65 HG3 LYS 10 HG3 LYS 10 7.224 -14.254 9.141 66 HD2 LYS 10 HD2 LYS 10 5.248 -15.614 9.181 67 HD3 LYS 10 HD3 LYS 10 6.111 -16.002 7.694 68 HE2 LYS 10 HE2 LYS 10 7.174 -17.952 9.039 69 HE3 LYS 10 HE3 LYS 10 5.964 -17.613 10.280 70 HZ1 LYS 10 HZ1 LYS 10 5.367 -18.291 7.455 71 HZ2 LYS 10 HZ2 LYS 10 5.337 -19.351 8.683 72 HZ3 LYS 10 HZ3 LYS 10 4.244 -18.133 8.685 73 H LYS 11 H LYS 11 8.132 -12.641 7.177 74 HA LYS 11 HA LYS 11 6.151 -13.754 5.231 75 HB2 LYS 11 HB2 LYS 11 6.362 -11.101 6.717 76 HB3 LYS 11 HB3 LYS 11 5.194 -11.363 5.430 77 HG2 LYS 11 HG2 LYS 11 5.277 -13.168 7.879 78 HG3 LYS 11 HG3 LYS 11 4.437 -11.632 7.881 79 HD2 LYS 11 HD2 LYS 11 2.704 -13.047 7.327 80 HD3 LYS 11 HD3 LYS 11 3.208 -12.487 5.736 81 HE2 LYS 11 HE2 LYS 11 4.554 -14.542 5.435 82 HE3 LYS 11 HE3 LYS 11 4.134 -15.080 7.071 83 HZ1 LYS 11 HZ1 LYS 11 1.981 -15.522 6.366 84 HZ2 LYS 11 HZ2 LYS 11 2.085 -14.565 5.027 85 HZ3 LYS 11 HZ3 LYS 11 2.909 -15.992 5.093 86 H ASP 12 H ASP 12 7.085 -14.081 3.308 87 HA ASP 12 HA ASP 12 9.030 -12.487 2.080 88 HB2 ASP 12 HB2 ASP 12 6.850 -14.351 1.042 89 HB3 ASP 12 HB3 ASP 12 7.917 -13.506 -0.044 90 H LYS 13 H LYS 13 5.479 -12.223 2.117 91 HA LYS 13 HA LYS 13 5.393 -10.227 -0.005 92 HB2 LYS 13 HB2 LYS 13 3.268 -10.983 2.020 93 HB3 LYS 13 HB3 LYS 13 3.028 -10.111 0.511 94 HG2 LYS 13 HG2 LYS 13 4.239 -12.865 0.280 95 HG3 LYS 13 HG3 LYS 13 2.577 -12.758 0.825 96 HD2 LYS 13 HD2 LYS 13 2.437 -13.010 -1.536 97 HD3 LYS 13 HD3 LYS 13 1.991 -11.352 -1.161 98 HE2 LYS 13 HE2 LYS 13 3.403 -11.036 -2.984 99 HE3 LYS 13 HE3 LYS 13 4.509 -10.810 -1.625 100 HZ1 LYS 13 HZ1 LYS 13 4.730 -13.440 -2.098 101 HZ2 LYS 13 HZ2 LYS 13 4.462 -12.858 -3.626 102 HZ3 LYS 13 HZ3 LYS 13 5.713 -12.267 -2.703 103 H LEU 14 H LEU 14 4.988 -10.116 3.604 104 HA LEU 14 HA LEU 14 4.829 -7.266 3.566 105 HB2 LEU 14 HB2 LEU 14 5.791 -8.984 5.856 106 HB3 LEU 14 HB3 LEU 14 5.172 -7.333 5.940 107 HG LEU 14 HG LEU 14 3.571 -9.799 5.114 108 HD11 LEU 14 HD11 LEU 14 2.453 -9.519 7.213 109 HD12 LEU 14 HD12 LEU 14 4.208 -9.471 7.536 110 HD13 LEU 14 HD13 LEU 14 3.287 -7.960 7.516 111 HD21 LEU 14 HD21 LEU 14 2.784 -6.880 5.280 112 HD22 LEU 14 HD22 LEU 14 2.697 -7.940 3.862 113 HD23 LEU 14 HD23 LEU 14 1.604 -8.218 5.225 114 H GLN 15 H GLN 15 7.588 -9.403 3.416 115 HA GLN 15 HA GLN 15 9.603 -7.616 4.226 116 HB2 GLN 15 HB2 GLN 15 9.834 -10.088 3.845 117 HB3 GLN 15 HB3 GLN 15 9.797 -9.811 2.110 118 HG2 GLN 15 HG2 GLN 15 11.794 -8.160 3.575 119 HG3 GLN 15 HG3 GLN 15 12.028 -9.881 3.760 120 HE21 GLN 15 HE21 GLN 15 11.965 -7.230 1.423 121 HE22 GLN 15 HE22 GLN 15 12.721 -8.136 0.104 122 H VAL 16 H VAL 16 7.949 -7.885 0.994 123 HA VAL 16 HA VAL 16 9.911 -6.058 -0.174 124 HB VAL 16 HB VAL 16 8.411 -5.929 -2.115 125 HG11 VAL 16 HG11 VAL 16 10.144 -7.655 -1.950 126 HG12 VAL 16 HG12 VAL 16 9.021 -8.741 -1.102 127 HG13 VAL 16 HG13 VAL 16 8.698 -8.285 -2.783 128 HG21 VAL 16 HG21 VAL 16 6.235 -6.369 -0.917 129 HG22 VAL 16 HG22 VAL 16 6.486 -7.368 -2.359 130 HG23 VAL 16 HG23 VAL 16 6.743 -8.084 -0.800 131 H ILE 17 H ILE 17 6.845 -5.770 1.533 132 HA ILE 17 HA ILE 17 6.485 -2.970 0.961 133 HB ILE 17 HB ILE 17 5.428 -4.296 3.463 134 HG12 ILE 17 HG12 ILE 17 4.122 -4.507 0.714 135 HG13 ILE 17 HG13 ILE 17 4.845 -5.833 1.625 136 HG21 ILE 17 HG21 ILE 17 5.244 -1.812 3.017 137 HG22 ILE 17 HG22 ILE 17 4.201 -2.190 1.637 138 HG23 ILE 17 HG23 ILE 17 3.705 -2.626 3.297 139 HD11 ILE 17 HD11 ILE 17 3.181 -5.315 3.493 140 HD12 ILE 17 HD12 ILE 17 2.345 -4.284 2.303 141 HD13 ILE 17 HD13 ILE 17 2.529 -6.015 2.001 142 H ASP 18 H ASP 18 8.050 -4.861 3.501 143 HA ASP 18 HA ASP 18 8.893 -2.673 5.186 144 HB2 ASP 18 HB2 ASP 18 8.912 -5.039 5.949 145 HB3 ASP 18 HB3 ASP 18 10.220 -5.388 4.821 146 H TRP 19 H TRP 19 10.369 -4.278 2.326 147 HA TRP 19 HA TRP 19 12.854 -2.904 2.480 148 HB2 TRP 19 HB2 TRP 19 12.735 -4.770 0.985 149 HB3 TRP 19 HB3 TRP 19 11.334 -4.128 0.144 150 HD1 TRP 19 HD1 TRP 19 11.715 -2.416 -1.845 151 HE1 TRP 19 HE1 TRP 19 13.782 -1.369 -2.967 152 HE3 TRP 19 HE3 TRP 19 15.415 -4.155 1.296 153 HZ2 TRP 19 HZ2 TRP 19 16.587 -1.457 -2.733 154 HZ3 TRP 19 HZ3 TRP 19 17.778 -3.559 0.838 155 HH2 TRP 19 HH2 TRP 19 18.377 -2.197 -1.144 156 H LEU 20 H LEU 20 9.910 -2.137 0.506 157 HA LEU 20 HA LEU 20 10.996 0.327 -0.352 158 HB2 LEU 20 HB2 LEU 20 8.850 0.885 -1.239 159 HB3 LEU 20 HB3 LEU 20 9.272 -0.791 -1.551 160 HG LEU 20 HG LEU 20 7.801 -1.158 0.632 161 HD11 LEU 20 HD11 LEU 20 6.501 1.292 -0.603 162 HD12 LEU 20 HD12 LEU 20 5.802 0.268 0.676 163 HD13 LEU 20 HD13 LEU 20 7.231 1.243 1.007 164 HD21 LEU 20 HD21 LEU 20 6.629 -0.761 -2.094 165 HD22 LEU 20 HD22 LEU 20 7.427 -2.237 -1.440 166 HD23 LEU 20 HD23 LEU 20 5.896 -1.665 -0.744 167 H ILE 21 H ILE 21 9.109 -0.363 2.591 168 HA ILE 21 HA ILE 21 8.554 2.328 3.352 169 HB ILE 21 HB ILE 21 8.887 -0.333 4.773 170 HG12 ILE 21 HG12 ILE 21 6.442 1.467 4.659 171 HG13 ILE 21 HG13 ILE 21 6.803 0.326 3.387 172 HG21 ILE 21 HG21 ILE 21 9.751 1.152 6.439 173 HG22 ILE 21 HG22 ILE 21 8.396 2.297 6.209 174 HG23 ILE 21 HG23 ILE 21 8.130 0.683 6.909 175 HD11 ILE 21 HD11 ILE 21 6.729 -1.520 5.109 176 HD12 ILE 21 HD12 ILE 21 6.296 -0.290 6.303 177 HD13 ILE 21 HD13 ILE 21 5.202 -0.614 4.964 178 H GLU 22 H GLU 22 11.346 0.187 3.920 179 HA GLU 22 HA GLU 22 12.752 2.079 5.579 180 HB2 GLU 22 HB2 GLU 22 12.682 -0.499 5.614 181 HB3 GLU 22 HB3 GLU 22 13.755 -0.447 4.210 182 HG2 GLU 22 HG2 GLU 22 15.039 -0.807 6.187 183 HG3 GLU 22 HG3 GLU 22 15.350 0.849 5.621 184 H ASN 23 H ASN 23 12.682 1.259 2.153 185 HA ASN 23 HA ASN 23 15.119 2.597 1.413 186 HB2 ASN 23 HB2 ASN 23 14.799 1.532 -0.400 187 HB3 ASN 23 HB3 ASN 23 13.317 0.847 0.120 188 HD21 ASN 23 HD21 ASN 23 11.287 2.511 -0.413 189 HD22 ASN 23 HD22 ASN 23 11.465 3.166 -2.030 190 H PHE 24 H PHE 24 11.822 3.474 1.266 191 HA PHE 24 HA PHE 24 12.528 6.366 0.856 192 HB2 PHE 24 HB2 PHE 24 10.528 4.780 -0.567 193 HB3 PHE 24 HB3 PHE 24 9.902 6.288 0.033 194 HD1 PHE 24 HD1 PHE 24 11.828 8.318 -0.197 195 HD2 PHE 24 HD2 PHE 24 11.073 5.006 -2.862 196 HE1 PHE 24 HE1 PHE 24 12.749 9.614 -2.082 197 HE2 PHE 24 HE2 PHE 24 11.906 6.332 -4.741 198 HZ PHE 24 HZ PHE 24 12.793 8.634 -4.370 199 HA PRO 25 HA PRO 25 10.508 6.303 4.916 200 HB2 PRO 25 HB2 PRO 25 12.331 7.672 6.360 201 HB3 PRO 25 HB3 PRO 25 12.657 6.012 5.793 202 HG2 PRO 25 HG2 PRO 25 13.486 8.612 4.450 203 HG3 PRO 25 HG3 PRO 25 14.541 7.235 4.909 204 HD2 PRO 25 HD2 PRO 25 13.457 7.524 2.408 205 HD3 PRO 25 HD3 PRO 25 13.727 5.920 3.160 206 H ASN 26 H ASN 26 10.146 8.498 2.457 207 HA ASN 26 HA ASN 26 10.108 10.976 3.996 208 HB2 ASN 26 HB2 ASN 26 9.152 10.186 1.280 209 HB3 ASN 26 HB3 ASN 26 8.500 11.631 2.019 210 HD21 ASN 26 HD21 ASN 26 11.192 10.311 0.549 211 HD22 ASN 26 HD22 ASN 26 12.287 11.686 0.581 212 H ALA 27 H ALA 27 7.847 8.393 3.243 213 HA ALA 27 HA ALA 27 5.884 9.095 5.277 214 HB1 ALA 27 HB1 ALA 27 5.200 10.707 3.515 215 HB2 ALA 27 HB2 ALA 27 5.462 9.493 2.239 216 HB3 ALA 27 HB3 ALA 27 4.109 9.310 3.372 217 H PHE 28 H PHE 28 5.604 6.968 5.913 218 HA PHE 28 HA PHE 28 4.265 5.038 4.459 219 HB2 PHE 28 HB2 PHE 28 7.177 4.932 4.048 220 HB3 PHE 28 HB3 PHE 28 6.610 3.504 4.842 221 HD1 PHE 28 HD1 PHE 28 4.306 2.464 3.747 222 HD2 PHE 28 HD2 PHE 28 7.069 5.056 1.693 223 HE1 PHE 28 HE1 PHE 28 3.288 1.847 1.582 224 HE2 PHE 28 HE2 PHE 28 5.984 4.491 -0.468 225 HZ PHE 28 HZ PHE 28 4.104 2.878 -0.530 226 H PHE 29 H PHE 29 4.352 2.844 5.902 227 HA PHE 29 HA PHE 29 5.141 3.273 8.670 228 HB2 PHE 29 HB2 PHE 29 2.220 3.109 7.841 229 HB3 PHE 29 HB3 PHE 29 2.802 2.602 9.421 230 HD1 PHE 29 HD1 PHE 29 2.097 5.551 7.323 231 HD2 PHE 29 HD2 PHE 29 3.773 4.145 11.042 232 HE1 PHE 29 HE1 PHE 29 2.160 7.878 8.195 233 HE2 PHE 29 HE2 PHE 29 3.724 6.448 11.938 234 HZ PHE 29 HZ PHE 29 2.983 8.305 10.521 235 H LYS 30 H LYS 30 5.593 1.359 9.599 236 HA LYS 30 HA LYS 30 5.742 -1.087 8.072 237 HB2 LYS 30 HB2 LYS 30 6.292 -0.462 10.994 238 HB3 LYS 30 HB3 LYS 30 6.527 -2.039 10.248 239 HG2 LYS 30 HG2 LYS 30 8.634 -1.184 10.270 240 HG3 LYS 30 HG3 LYS 30 8.134 -0.914 8.604 241 HD2 LYS 30 HD2 LYS 30 7.769 1.488 9.100 242 HD3 LYS 30 HD3 LYS 30 8.043 1.182 10.824 243 HE2 LYS 30 HE2 LYS 30 10.350 0.378 10.315 244 HE3 LYS 30 HE3 LYS 30 10.104 0.723 8.608 245 HZ1 LYS 30 HZ1 LYS 30 10.037 2.784 10.752 246 HZ2 LYS 30 HZ2 LYS 30 11.318 2.427 9.800 247 HZ3 LYS 30 HZ3 LYS 30 9.986 3.072 9.126 248 H LYS 31 H LYS 31 3.752 -0.210 10.930 249 HA LYS 31 HA LYS 31 2.493 -2.815 11.087 250 HB2 LYS 31 HB2 LYS 31 2.478 -0.183 12.475 251 HB3 LYS 31 HB3 LYS 31 0.858 -0.801 12.309 252 HG2 LYS 31 HG2 LYS 31 1.808 -1.432 14.434 253 HG3 LYS 31 HG3 LYS 31 1.434 -2.848 13.471 254 HD2 LYS 31 HD2 LYS 31 3.944 -2.852 12.788 255 HD3 LYS 31 HD3 LYS 31 4.157 -1.668 14.085 256 HE2 LYS 31 HE2 LYS 31 3.085 -4.513 14.334 257 HE3 LYS 31 HE3 LYS 31 4.683 -3.942 14.823 258 HZ1 LYS 31 HZ1 LYS 31 3.526 -2.420 16.379 259 HZ2 LYS 31 HZ2 LYS 31 2.105 -3.187 16.048 260 HZ3 LYS 31 HZ3 LYS 31 3.347 -3.997 16.749 261 H GLY 32 H GLY 32 -0.081 -2.731 11.094 262 HA2 GLY 32 HA2 GLY 32 -1.002 -1.698 8.415 263 HA3 GLY 32 HA3 GLY 32 -1.671 -3.045 9.330 264 H ASN 33 H ASN 33 -1.289 -1.235 11.799 265 HA ASN 33 HA ASN 33 -3.970 -0.131 11.788 266 HB2 ASN 33 HB2 ASN 33 -3.614 0.106 14.223 267 HB3 ASN 33 HB3 ASN 33 -3.316 -1.513 13.636 268 HD21 ASN 33 HD21 ASN 33 -0.870 1.300 13.650 269 HD22 ASN 33 HD22 ASN 33 -0.033 0.572 14.973 270 H GLN 34 H GLN 34 -0.800 1.328 11.414 271 HA GLN 34 HA GLN 34 -1.981 3.972 12.081 272 HB2 GLN 34 HB2 GLN 34 0.235 4.711 12.767 273 HB3 GLN 34 HB3 GLN 34 -0.437 3.435 13.785 274 HG2 GLN 34 HG2 GLN 34 0.986 1.772 12.605 275 HG3 GLN 34 HG3 GLN 34 1.652 3.073 11.629 276 HE21 GLN 34 HE21 GLN 34 3.813 2.433 12.451 277 HE22 GLN 34 HE22 GLN 34 4.264 2.900 14.073 278 H VAL 35 H VAL 35 -1.681 2.262 9.545 279 HA VAL 35 HA VAL 35 0.109 3.617 7.778 280 HB VAL 35 HB VAL 35 -1.309 2.749 5.947 281 HG11 VAL 35 HG11 VAL 35 0.392 1.302 7.125 282 HG12 VAL 35 HG12 VAL 35 -0.934 0.641 8.111 283 HG13 VAL 35 HG13 VAL 35 -0.929 0.413 6.359 284 HG21 VAL 35 HG21 VAL 35 -3.201 1.764 8.151 285 HG22 VAL 35 HG22 VAL 35 -3.568 2.988 6.919 286 HG23 VAL 35 HG23 VAL 35 -3.253 1.306 6.449 287 H LYS 36 H LYS 36 -0.428 5.097 5.928 288 HA LYS 36 HA LYS 36 -2.518 7.085 6.555 289 HB2 LYS 36 HB2 LYS 36 0.433 7.515 6.486 290 HB3 LYS 36 HB3 LYS 36 -0.466 8.548 5.401 291 HG2 LYS 36 HG2 LYS 36 -1.967 9.203 7.341 292 HG3 LYS 36 HG3 LYS 36 -0.763 8.426 8.389 293 HD2 LYS 36 HD2 LYS 36 0.991 9.910 7.454 294 HD3 LYS 36 HD3 LYS 36 -0.179 10.666 6.377 295 HE2 LYS 36 HE2 LYS 36 -0.387 10.734 9.412 296 HE3 LYS 36 HE3 LYS 36 0.483 11.952 8.487 297 HZ1 LYS 36 HZ1 LYS 36 -2.295 11.494 7.703 298 HZ2 LYS 36 HZ2 LYS 36 -2.018 12.269 9.121 299 HZ3 LYS 36 HZ3 LYS 36 -1.415 12.875 7.744 300 HA PRO 37 HA PRO 37 -3.324 6.494 2.302 301 HB2 PRO 37 HB2 PRO 37 -4.566 8.698 1.487 302 HB3 PRO 37 HB3 PRO 37 -5.118 7.813 2.918 303 HG2 PRO 37 HG2 PRO 37 -3.386 10.312 2.870 304 HG3 PRO 37 HG3 PRO 37 -4.851 9.993 3.848 305 HD2 PRO 37 HD2 PRO 37 -2.244 9.553 4.704 306 HD3 PRO 37 HD3 PRO 37 -3.673 8.707 5.364 307 H LEU 38 H LEU 38 -1.545 5.987 1.100 308 HA LEU 38 HA LEU 38 0.382 7.981 0.174 309 HB2 LEU 38 HB2 LEU 38 -0.101 5.037 -0.522 310 HB3 LEU 38 HB3 LEU 38 1.148 6.007 -1.246 311 HG LEU 38 HG LEU 38 2.139 4.601 0.329 312 HD11 LEU 38 HD11 LEU 38 3.144 6.861 0.172 313 HD12 LEU 38 HD12 LEU 38 2.157 7.398 1.521 314 HD13 LEU 38 HD13 LEU 38 3.375 6.136 1.762 315 HD21 LEU 38 HD21 LEU 38 1.677 4.476 2.664 316 HD22 LEU 38 HD22 LEU 38 0.489 5.785 2.562 317 HD23 LEU 38 HD23 LEU 38 0.161 4.215 1.782 318 H LYS 39 H LYS 39 0.847 8.207 -2.186 319 HA LYS 39 HA LYS 39 -1.233 9.215 -3.718 320 HB2 LYS 39 HB2 LYS 39 1.198 9.637 -4.145 321 HB3 LYS 39 HB3 LYS 39 1.458 8.081 -4.687 322 HG2 LYS 39 HG2 LYS 39 -0.363 8.690 -6.526 323 HG3 LYS 39 HG3 LYS 39 -0.156 10.332 -5.952 324 HD2 LYS 39 HD2 LYS 39 2.213 10.252 -6.609 325 HD3 LYS 39 HD3 LYS 39 2.089 8.544 -7.030 326 HE2 LYS 39 HE2 LYS 39 0.421 10.753 -8.327 327 HE3 LYS 39 HE3 LYS 39 1.966 10.183 -8.967 328 HZ1 LYS 39 HZ1 LYS 39 -0.338 8.366 -8.549 329 HZ2 LYS 39 HZ2 LYS 39 0.040 9.083 -9.991 330 HZ3 LYS 39 HZ3 LYS 39 1.077 8.032 -9.269 331 H ILE 40 H ILE 40 -2.468 8.491 -5.508 332 HA ILE 40 HA ILE 40 -3.263 5.739 -5.441 333 HB ILE 40 HB ILE 40 -4.779 7.584 -6.121 334 HG12 ILE 40 HG12 ILE 40 -5.763 6.606 -8.168 335 HG13 ILE 40 HG13 ILE 40 -4.320 5.618 -8.415 336 HG21 ILE 40 HG21 ILE 40 -4.610 8.761 -8.177 337 HG22 ILE 40 HG22 ILE 40 -3.042 8.952 -7.391 338 HG23 ILE 40 HG23 ILE 40 -3.227 7.808 -8.732 339 HD11 ILE 40 HD11 ILE 40 -6.170 5.484 -6.002 340 HD12 ILE 40 HD12 ILE 40 -6.181 4.358 -7.369 341 HD13 ILE 40 HD13 ILE 40 -4.768 4.423 -6.313 342 H GLY 41 H GLY 41 -2.307 4.039 -6.541 343 HA2 GLY 41 HA2 GLY 41 -0.869 2.913 -7.936 344 HA3 GLY 41 HA3 GLY 41 -0.891 4.341 -8.984 345 H ILE 42 H ILE 42 0.288 4.858 -5.744 346 HA ILE 42 HA ILE 42 2.732 5.937 -6.382 347 HB ILE 42 HB ILE 42 1.552 6.002 -4.171 348 HG12 ILE 42 HG12 ILE 42 4.463 5.208 -3.930 349 HG13 ILE 42 HG13 ILE 42 3.915 6.756 -4.590 350 HG21 ILE 42 HG21 ILE 42 1.133 3.528 -3.935 351 HG22 ILE 42 HG22 ILE 42 2.859 3.325 -3.567 352 HG23 ILE 42 HG23 ILE 42 1.826 4.277 -2.502 353 HD11 ILE 42 HD11 ILE 42 4.524 7.049 -2.263 354 HD12 ILE 42 HD12 ILE 42 2.774 7.243 -2.422 355 HD13 ILE 42 HD13 ILE 42 3.470 5.726 -1.772 356 H PHE 43 H PHE 43 1.891 2.484 -6.289 357 HA PHE 43 HA PHE 43 4.437 1.367 -5.860 358 HB2 PHE 43 HB2 PHE 43 2.669 -0.169 -5.819 359 HB3 PHE 43 HB3 PHE 43 1.837 0.578 -7.182 360 HD1 PHE 43 HD1 PHE 43 2.258 -0.019 -9.424 361 HD2 PHE 43 HD2 PHE 43 4.762 -1.505 -6.299 362 HE1 PHE 43 HE1 PHE 43 3.417 -1.495 -11.070 363 HE2 PHE 43 HE2 PHE 43 5.974 -2.972 -7.938 364 HZ PHE 43 HZ PHE 43 5.312 -2.932 -10.330 365 H ASP 44 H ASP 44 2.869 2.727 -8.794 366 HA ASP 44 HA ASP 44 4.881 1.785 -10.623 367 HB2 ASP 44 HB2 ASP 44 2.941 4.102 -10.896 368 HB3 ASP 44 HB3 ASP 44 3.962 3.452 -12.185 369 H ASP 45 H ASP 45 4.747 4.546 -8.441 370 HA ASP 45 HA ASP 45 6.823 6.091 -9.789 371 HB2 ASP 45 HB2 ASP 45 4.791 6.905 -8.300 372 HB3 ASP 45 HB3 ASP 45 5.784 6.435 -6.943 373 H LEU 46 H LEU 46 6.364 4.229 -6.853 374 HA LEU 46 HA LEU 46 8.948 4.287 -5.746 375 HB2 LEU 46 HB2 LEU 46 6.873 3.841 -4.536 376 HB3 LEU 46 HB3 LEU 46 6.564 2.403 -5.472 377 HG LEU 46 HG LEU 46 7.352 2.113 -3.106 378 HD11 LEU 46 HD11 LEU 46 9.110 0.603 -5.059 379 HD12 LEU 46 HD12 LEU 46 8.476 0.092 -3.507 380 HD13 LEU 46 HD13 LEU 46 7.373 0.334 -4.870 381 HD21 LEU 46 HD21 LEU 46 9.084 3.754 -2.941 382 HD22 LEU 46 HD22 LEU 46 9.781 2.159 -2.674 383 HD23 LEU 46 HD23 LEU 46 10.058 2.995 -4.208 384 H ILE 47 H ILE 47 7.399 1.814 -7.858 385 HA ILE 47 HA ILE 47 9.452 -0.098 -7.588 386 HB ILE 47 HB ILE 47 7.173 -0.443 -8.493 387 HG12 ILE 47 HG12 ILE 47 9.335 -1.957 -8.794 388 HG13 ILE 47 HG13 ILE 47 7.759 -2.400 -9.407 389 HG21 ILE 47 HG21 ILE 47 7.078 1.449 -10.070 390 HG22 ILE 47 HG22 ILE 47 8.305 0.729 -11.090 391 HG23 ILE 47 HG23 ILE 47 6.716 -0.078 -10.887 392 HD11 ILE 47 HD11 ILE 47 9.714 -0.946 -11.204 393 HD12 ILE 47 HD12 ILE 47 9.741 -2.685 -11.027 394 HD13 ILE 47 HD13 ILE 47 8.268 -1.893 -11.612 395 H ASP 48 H ASP 48 9.303 2.886 -9.553 396 HA ASP 48 HA ASP 48 11.211 2.140 -11.460 397 HB2 ASP 48 HB2 ASP 48 9.735 4.310 -11.199 398 HB3 ASP 48 HB3 ASP 48 11.162 4.980 -10.410 399 H PHE 49 H PHE 49 11.547 3.430 -8.190 400 HA PHE 49 HA PHE 49 14.373 3.721 -8.090 401 HB2 PHE 49 HB2 PHE 49 12.389 4.536 -6.528 402 HB3 PHE 49 HB3 PHE 49 12.724 3.062 -5.652 403 HD1 PHE 49 HD1 PHE 49 13.659 6.502 -6.209 404 HD2 PHE 49 HD2 PHE 49 15.066 2.736 -4.655 405 HE1 PHE 49 HE1 PHE 49 15.364 7.690 -4.863 406 HE2 PHE 49 HE2 PHE 49 16.645 3.936 -3.181 407 HZ PHE 49 HZ PHE 49 16.834 6.426 -3.314 408 H TYR 50 H TYR 50 12.255 0.888 -7.710 409 HA TYR 50 HA TYR 50 14.254 -0.869 -6.545 410 HB2 TYR 50 HB2 TYR 50 12.300 -1.825 -6.049 411 HB3 TYR 50 HB3 TYR 50 11.444 -1.103 -7.387 412 HD1 TYR 50 HD1 TYR 50 13.198 -4.125 -6.236 413 HD2 TYR 50 HD2 TYR 50 11.582 -2.101 -9.673 414 HE1 TYR 50 HE1 TYR 50 13.234 -6.237 -7.511 415 HE2 TYR 50 HE2 TYR 50 11.638 -4.196 -10.970 416 HH TYR 50 HH TYR 50 12.776 -6.309 -10.965 417 H GLU 51 H GLU 51 13.315 0.173 -9.829 418 HA GLU 51 HA GLU 51 14.882 -1.909 -11.159 419 HB2 GLU 51 HB2 GLU 51 13.684 0.625 -12.328 420 HB3 GLU 51 HB3 GLU 51 14.424 -0.712 -13.225 421 HG2 GLU 51 HG2 GLU 51 12.694 -2.232 -12.016 422 HG3 GLU 51 HG3 GLU 51 11.886 -0.738 -11.578 423 H ARG 52 H ARG 52 15.678 0.813 -9.367 424 HA ARG 52 HA ARG 52 18.073 1.546 -10.875 425 HB2 ARG 52 HB2 ARG 52 16.508 2.995 -9.241 426 HB3 ARG 52 HB3 ARG 52 17.526 2.289 -7.984 427 HG2 ARG 52 HG2 ARG 52 18.512 4.330 -8.458 428 HG3 ARG 52 HG3 ARG 52 19.540 3.178 -9.310 429 HD2 ARG 52 HD2 ARG 52 18.374 3.713 -11.445 430 HD3 ARG 52 HD3 ARG 52 17.300 4.815 -10.578 431 HE ARG 52 HE ARG 52 19.079 6.283 -10.118 432 HH11 ARG 52 HH11 ARG 52 19.983 3.890 -12.644 433 HH12 ARG 52 HH12 ARG 52 21.562 4.584 -12.842 434 HH21 ARG 52 HH21 ARG 52 21.002 7.231 -10.601 435 HH22 ARG 52 HH22 ARG 52 22.196 6.455 -11.629 436 H LEU 53 H LEU 53 17.213 -0.785 -8.234 437 HA LEU 53 HA LEU 53 19.759 -1.078 -7.097 438 HB2 LEU 53 HB2 LEU 53 17.674 -3.259 -7.489 439 HB3 LEU 53 HB3 LEU 53 18.837 -3.102 -6.173 440 HG LEU 53 HG LEU 53 16.434 -1.293 -6.671 441 HD11 LEU 53 HD11 LEU 53 15.789 -3.542 -5.959 442 HD12 LEU 53 HD12 LEU 53 16.851 -3.407 -4.539 443 HD13 LEU 53 HD13 LEU 53 15.437 -2.335 -4.721 444 HD21 LEU 53 HD21 LEU 53 18.270 -0.059 -5.617 445 HD22 LEU 53 HD22 LEU 53 16.850 -0.234 -4.611 446 HD23 LEU 53 HD23 LEU 53 18.294 -1.249 -4.295 447 H ASP 54 H ASP 54 21.415 -2.556 -7.571 448 HA ASP 54 HA ASP 54 21.662 -3.358 -10.379 449 HB2 ASP 54 HB2 ASP 54 23.557 -2.502 -8.913 450 HB3 ASP 54 HB3 ASP 54 23.488 -4.022 -8.024 451 H THR 55 H THR 55 20.940 -4.800 -7.237 452 HA THR 55 HA THR 55 20.437 -7.461 -8.513 453 HB THR 55 HB THR 55 21.161 -8.455 -6.387 454 HG1 THR 55 HG1 THR 55 20.742 -6.611 -5.157 455 HG21 THR 55 HG21 THR 55 23.557 -8.155 -6.635 456 HG22 THR 55 HG22 THR 55 22.810 -8.198 -8.244 457 HG23 THR 55 HG23 THR 55 23.334 -6.651 -7.543 458 HA PRO 56 HA PRO 56 16.424 -6.040 -6.678 459 HB2 PRO 56 HB2 PRO 56 14.884 -7.077 -8.706 460 HB3 PRO 56 HB3 PRO 56 15.638 -5.442 -8.760 461 HG2 PRO 56 HG2 PRO 56 16.567 -8.058 -9.983 462 HG3 PRO 56 HG3 PRO 56 16.494 -6.457 -10.766 463 HD2 PRO 56 HD2 PRO 56 18.778 -7.440 -9.691 464 HD3 PRO 56 HD3 PRO 56 18.398 -5.698 -9.574 465 HA PRO 57 HA PRO 57 16.490 -10.441 -5.437 466 HB2 PRO 57 HB2 PRO 57 15.502 -10.310 -2.952 467 HB3 PRO 57 HB3 PRO 57 17.133 -9.735 -3.371 468 HG2 PRO 57 HG2 PRO 57 14.629 -8.062 -3.010 469 HG3 PRO 57 HG3 PRO 57 16.270 -7.780 -2.358 470 HD2 PRO 57 HD2 PRO 57 15.329 -6.619 -4.699 471 HD3 PRO 57 HD3 PRO 57 17.045 -6.965 -4.380 472 H PHE 58 H PHE 58 13.528 -8.576 -4.503 473 HA PHE 58 HA PHE 58 11.855 -10.824 -5.459 474 HB2 PHE 58 HB2 PHE 58 11.689 -8.862 -3.285 475 HB3 PHE 58 HB3 PHE 58 10.256 -8.811 -4.297 476 HD1 PHE 58 HD1 PHE 58 9.276 -11.133 -4.962 477 HD2 PHE 58 HD2 PHE 58 11.658 -10.455 -1.472 478 HE1 PHE 58 HE1 PHE 58 8.496 -13.318 -4.037 479 HE2 PHE 58 HE2 PHE 58 10.864 -12.580 -0.505 480 HZ PHE 58 HZ PHE 58 9.319 -14.052 -1.804 481 H SER 59 H SER 59 10.636 -10.661 -7.288 482 HA SER 59 HA SER 59 11.015 -8.573 -9.165 483 HB2 SER 59 HB2 SER 59 10.390 -10.998 -9.564 484 HB3 SER 59 HB3 SER 59 8.757 -10.602 -9.001 485 HG SER 59 HG SER 59 10.175 -9.610 -11.251 486 H LYS 60 H LYS 60 9.696 -7.108 -9.977 487 HA LYS 60 HA LYS 60 8.294 -5.337 -8.404 488 HB2 LYS 60 HB2 LYS 60 7.322 -4.549 -10.665 489 HB3 LYS 60 HB3 LYS 60 9.074 -4.572 -10.423 490 HG2 LYS 60 HG2 LYS 60 9.440 -6.380 -11.850 491 HG3 LYS 60 HG3 LYS 60 7.777 -6.951 -11.716 492 HD2 LYS 60 HD2 LYS 60 8.144 -6.155 -13.867 493 HD3 LYS 60 HD3 LYS 60 6.971 -5.099 -13.073 494 HE2 LYS 60 HE2 LYS 60 8.768 -3.372 -12.841 495 HE3 LYS 60 HE3 LYS 60 9.925 -4.481 -13.582 496 HZ1 LYS 60 HZ1 LYS 60 8.442 -4.459 -15.580 497 HZ2 LYS 60 HZ2 LYS 60 7.587 -3.224 -14.889 498 HZ3 LYS 60 HZ3 LYS 60 9.148 -3.025 -15.241 499 H LYS 61 H LYS 61 6.897 -8.139 -10.123 500 HA LYS 61 HA LYS 61 4.158 -7.394 -9.671 501 HB2 LYS 61 HB2 LYS 61 5.608 -9.732 -10.716 502 HB3 LYS 61 HB3 LYS 61 4.316 -10.232 -9.623 503 HG2 LYS 61 HG2 LYS 61 3.468 -10.172 -11.821 504 HG3 LYS 61 HG3 LYS 61 2.683 -8.910 -10.860 505 HD2 LYS 61 HD2 LYS 61 4.293 -7.241 -11.918 506 HD3 LYS 61 HD3 LYS 61 4.859 -8.557 -12.973 507 HE2 LYS 61 HE2 LYS 61 2.633 -8.816 -13.925 508 HE3 LYS 61 HE3 LYS 61 1.939 -7.727 -12.706 509 HZ1 LYS 61 HZ1 LYS 61 3.824 -6.950 -14.834 510 HZ2 LYS 61 HZ2 LYS 61 2.218 -6.542 -14.732 511 HZ3 LYS 61 HZ3 LYS 61 3.311 -5.951 -13.650 512 H SER 62 H SER 62 6.428 -9.409 -7.711 513 HA SER 62 HA SER 62 4.595 -10.038 -5.670 514 HB2 SER 62 HB2 SER 62 7.601 -9.565 -5.411 515 HB3 SER 62 HB3 SER 62 6.589 -10.603 -4.394 516 HG SER 62 HG SER 62 7.908 -11.508 -6.352 517 H LEU 63 H LEU 63 6.821 -7.262 -6.130 518 HA LEU 63 HA LEU 63 6.315 -5.916 -3.704 519 HB2 LEU 63 HB2 LEU 63 8.142 -5.561 -5.338 520 HB3 LEU 63 HB3 LEU 63 7.045 -4.620 -6.344 521 HG LEU 63 HG LEU 63 7.552 -3.966 -3.408 522 HD11 LEU 63 HD11 LEU 63 9.258 -2.335 -4.105 523 HD12 LEU 63 HD12 LEU 63 9.745 -3.972 -4.552 524 HD13 LEU 63 HD13 LEU 63 9.117 -2.863 -5.794 525 HD21 LEU 63 HD21 LEU 63 6.912 -1.712 -4.045 526 HD22 LEU 63 HD22 LEU 63 6.782 -2.173 -5.739 527 HD23 LEU 63 HD23 LEU 63 5.624 -2.800 -4.525 528 H ARG 64 H ARG 64 4.646 -5.499 -6.889 529 HA ARG 64 HA ARG 64 2.838 -3.601 -5.838 530 HB2 ARG 64 HB2 ARG 64 3.180 -3.952 -8.284 531 HB3 ARG 64 HB3 ARG 64 2.503 -5.549 -8.188 532 HG2 ARG 64 HG2 ARG 64 1.060 -3.745 -9.191 533 HG3 ARG 64 HG3 ARG 64 0.297 -4.741 -7.953 534 HD2 ARG 64 HD2 ARG 64 0.109 -3.001 -6.433 535 HD3 ARG 64 HD3 ARG 64 1.545 -2.192 -7.029 536 HE ARG 64 HE ARG 64 0.288 -0.911 -8.377 537 HH11 ARG 64 HH11 ARG 64 -1.612 -3.802 -7.701 538 HH12 ARG 64 HH12 ARG 64 -3.081 -3.211 -8.396 539 HH21 ARG 64 HH21 ARG 64 -1.634 -0.036 -9.244 540 HH22 ARG 64 HH22 ARG 64 -3.112 -0.948 -9.240 541 H GLU 65 H GLU 65 2.458 -7.156 -6.213 542 HA GLU 65 HA GLU 65 -0.220 -7.185 -5.317 543 HB2 GLU 65 HB2 GLU 65 1.039 -8.946 -6.598 544 HB3 GLU 65 HB3 GLU 65 1.767 -9.469 -5.065 545 HG2 GLU 65 HG2 GLU 65 -0.406 -10.050 -4.179 546 HG3 GLU 65 HG3 GLU 65 -1.254 -9.147 -5.444 547 H ALA 66 H ALA 66 2.845 -7.412 -3.437 548 HA ALA 66 HA ALA 66 1.550 -7.935 -0.937 549 HB1 ALA 66 HB1 ALA 66 3.702 -7.190 0.012 550 HB2 ALA 66 HB2 ALA 66 3.944 -8.363 -1.296 551 HB3 ALA 66 HB3 ALA 66 4.201 -6.627 -1.597 552 H LEU 67 H LEU 67 2.572 -4.873 -2.573 553 HA LEU 67 HA LEU 67 1.732 -3.184 -0.428 554 HB2 LEU 67 HB2 LEU 67 2.884 -2.781 -2.960 555 HB3 LEU 67 HB3 LEU 67 1.315 -2.006 -3.087 556 HG LEU 67 HG LEU 67 3.413 -1.514 -0.899 557 HD11 LEU 67 HD11 LEU 67 3.880 0.612 -2.039 558 HD12 LEU 67 HD12 LEU 67 4.160 -0.740 -3.134 559 HD13 LEU 67 HD13 LEU 67 2.683 0.236 -3.298 560 HD21 LEU 67 HD21 LEU 67 1.153 -0.944 -0.072 561 HD22 LEU 67 HD22 LEU 67 2.130 0.501 -0.310 562 HD23 LEU 67 HD23 LEU 67 0.883 0.093 -1.497 563 H SER 68 H SER 68 -0.034 -4.873 -2.938 564 HA SER 68 HA SER 68 -2.467 -3.410 -2.951 565 HB2 SER 68 HB2 SER 68 -1.491 -5.495 -4.388 566 HB3 SER 68 HB3 SER 68 -2.516 -6.404 -3.267 567 HG SER 68 HG SER 68 -3.507 -5.711 -5.261 568 H TYR 69 H TYR 69 -1.227 -6.117 -0.982 569 HA TYR 69 HA TYR 69 -3.530 -6.588 0.632 570 HB2 TYR 69 HB2 TYR 69 -0.598 -7.135 1.022 571 HB3 TYR 69 HB3 TYR 69 -1.639 -7.221 2.407 572 HD1 TYR 69 HD1 TYR 69 -3.700 -8.657 2.341 573 HD2 TYR 69 HD2 TYR 69 -0.418 -9.096 -0.406 574 HE1 TYR 69 HE1 TYR 69 -4.435 -10.948 1.872 575 HE2 TYR 69 HE2 TYR 69 -1.117 -11.432 -0.865 576 HH TYR 69 HH TYR 69 -3.124 -12.996 -0.622 577 H TYR 70 H TYR 70 -0.708 -4.399 1.275 578 HA TYR 70 HA TYR 70 -1.790 -3.462 3.754 579 HB2 TYR 70 HB2 TYR 70 0.480 -2.650 2.039 580 HB3 TYR 70 HB3 TYR 70 -0.234 -1.384 3.033 581 HD1 TYR 70 HD1 TYR 70 -0.022 -5.056 3.934 582 HD2 TYR 70 HD2 TYR 70 1.412 -1.045 4.745 583 HE1 TYR 70 HE1 TYR 70 1.003 -5.822 6.029 584 HE2 TYR 70 HE2 TYR 70 2.527 -1.857 6.760 585 HH TYR 70 HH TYR 70 3.049 -3.744 8.068 586 H SER 71 H SER 71 -2.045 -2.052 0.481 587 HA SER 71 HA SER 71 -3.785 0.047 1.459 588 HB2 SER 71 HB2 SER 71 -4.327 0.451 -0.881 589 HB3 SER 71 HB3 SER 71 -2.601 0.458 -0.480 590 HG SER 71 HG SER 71 -2.826 -1.924 -1.201 591 H ALA 72 H ALA 72 -4.498 -3.210 1.298 592 HA ALA 72 HA ALA 72 -7.418 -2.759 0.961 593 HB1 ALA 72 HB1 ALA 72 -7.539 -5.146 0.427 594 HB2 ALA 72 HB2 ALA 72 -6.391 -4.364 -0.676 595 HB3 ALA 72 HB3 ALA 72 -5.794 -5.329 0.689 596 H SER 73 H SER 73 -5.145 -2.650 3.278 597 HA SER 73 HA SER 73 -5.965 -4.701 5.130 598 HB2 SER 73 HB2 SER 73 -4.640 -2.003 5.604 599 HB3 SER 73 HB3 SER 73 -4.843 -3.248 6.857 600 HG SER 73 HG SER 73 -3.785 -3.991 4.379 601 HA PRO 74 HA PRO 74 -9.868 -3.365 6.536 602 HB2 PRO 74 HB2 PRO 74 -9.767 -3.871 9.282 603 HB3 PRO 74 HB3 PRO 74 -10.079 -5.103 8.009 604 HG2 PRO 74 HG2 PRO 74 -7.519 -4.374 9.412 605 HG3 PRO 74 HG3 PRO 74 -8.147 -6.016 9.046 606 HD2 PRO 74 HD2 PRO 74 -6.230 -4.881 7.511 607 HD3 PRO 74 HD3 PRO 74 -7.548 -5.817 6.751 608 H ALA 75 H ALA 75 -7.273 -2.345 8.814 609 HA ALA 75 HA ALA 75 -8.537 -0.161 9.950 610 HB1 ALA 75 HB1 ALA 75 -5.592 -0.599 9.303 611 HB2 ALA 75 HB2 ALA 75 -6.226 0.545 10.513 612 HB3 ALA 75 HB3 ALA 75 -6.472 -1.204 10.720 613 H TYR 76 H TYR 76 -6.711 -0.260 6.891 614 HA TYR 76 HA TYR 76 -6.626 2.573 6.423 615 HB2 TYR 76 HB2 TYR 76 -5.117 0.956 5.265 616 HB3 TYR 76 HB3 TYR 76 -6.498 0.114 4.598 617 HD1 TYR 76 HD1 TYR 76 -4.647 3.340 4.538 618 HD2 TYR 76 HD2 TYR 76 -7.596 0.865 2.597 619 HE1 TYR 76 HE1 TYR 76 -4.484 4.750 2.522 620 HE2 TYR 76 HE2 TYR 76 -7.392 2.208 0.544 621 HH TYR 76 HH TYR 76 -6.310 3.930 -0.482 622 H LEU 77 H LEU 77 -8.882 0.027 5.369 623 HA LEU 77 HA LEU 77 -10.421 1.905 3.776 624 HB2 LEU 77 HB2 LEU 77 -11.184 -0.879 4.726 625 HB3 LEU 77 HB3 LEU 77 -11.909 0.047 3.425 626 HG LEU 77 HG LEU 77 -8.990 -0.725 3.284 627 HD11 LEU 77 HD11 LEU 77 -10.255 -2.732 3.701 628 HD12 LEU 77 HD12 LEU 77 -11.374 -2.329 2.389 629 HD13 LEU 77 HD13 LEU 77 -9.673 -2.707 2.024 630 HD21 LEU 77 HD21 LEU 77 -9.346 -0.438 0.878 631 HD22 LEU 77 HD22 LEU 77 -11.051 -0.015 1.168 632 HD23 LEU 77 HD23 LEU 77 -9.765 1.046 1.754 633 H SER 78 H SER 78 -10.887 0.267 6.891 634 HA SER 78 HA SER 78 -13.361 1.324 7.631 635 HB2 SER 78 HB2 SER 78 -11.993 -0.500 8.738 636 HB3 SER 78 HB3 SER 78 -11.001 0.747 9.481 637 HG SER 78 HG SER 78 -12.710 1.416 10.698 638 H CYS 79 H CYS 79 -10.165 2.977 7.729 639 HA CYS 79 HA CYS 79 -11.254 5.116 9.416 640 HB2 CYS 79 HB2 CYS 79 -9.097 5.893 9.611 641 HB3 CYS 79 HB3 CYS 79 -8.964 4.144 9.656 642 HG CYS 79 HG CYS 79 -6.933 5.326 8.379 643 H GLN 80 H GLN 80 -11.847 4.509 6.325 644 HA GLN 80 HA GLN 80 -11.443 6.300 4.486 645 HB2 GLN 80 HB2 GLN 80 -13.946 6.329 4.028 646 HB3 GLN 80 HB3 GLN 80 -13.176 4.756 4.123 647 HG2 GLN 80 HG2 GLN 80 -14.335 4.122 5.999 648 HG3 GLN 80 HG3 GLN 80 -14.338 5.725 6.708 649 HE21 GLN 80 HE21 GLN 80 -15.954 7.332 5.964 650 HE22 GLN 80 HE22 GLN 80 -17.459 6.715 5.314 651 H LYS 81 H LYS 81 -10.742 8.426 4.875 652 HA LYS 81 HA LYS 81 -12.855 10.323 5.717 653 HB2 LYS 81 HB2 LYS 81 -10.062 10.181 6.830 654 HB3 LYS 81 HB3 LYS 81 -10.931 11.722 6.714 655 HG2 LYS 81 HG2 LYS 81 -12.833 10.794 7.994 656 HG3 LYS 81 HG3 LYS 81 -11.988 9.251 8.121 657 HD2 LYS 81 HD2 LYS 81 -10.114 10.471 9.315 658 HD3 LYS 81 HD3 LYS 81 -11.155 11.907 9.347 659 HE2 LYS 81 HE2 LYS 81 -12.901 10.588 10.550 660 HE3 LYS 81 HE3 LYS 81 -11.866 9.162 10.494 661 HZ1 LYS 81 HZ1 LYS 81 -11.697 10.255 12.610 662 HZ2 LYS 81 HZ2 LYS 81 -10.244 10.368 11.837 663 HZ3 LYS 81 HZ3 LYS 81 -11.256 11.674 11.925 664 HA PRO 82 HA PRO 82 -11.256 11.774 1.715 665 HB2 PRO 82 HB2 PRO 82 -13.307 13.439 1.042 666 HB3 PRO 82 HB3 PRO 82 -13.500 11.667 1.008 667 HG2 PRO 82 HG2 PRO 82 -14.322 13.589 3.201 668 HG3 PRO 82 HG3 PRO 82 -15.299 12.273 2.478 669 HD2 PRO 82 HD2 PRO 82 -13.872 12.012 4.808 670 HD3 PRO 82 HD3 PRO 82 -14.181 10.629 3.712 671 H ASP 83 H ASP 83 -11.194 14.271 0.926 672 HA ASP 83 HA ASP 83 -10.012 16.189 1.233 673 HB2 ASP 83 HB2 ASP 83 -12.015 16.539 3.454 674 HB3 ASP 83 HB3 ASP 83 -11.093 17.816 2.668 675 H THR 84 H THR 84 -8.456 14.217 2.320 676 HA THR 84 HA THR 84 -7.309 15.531 4.745 677 HB THR 84 HB THR 84 -8.453 13.412 5.261 678 HG1 THR 84 HG1 THR 84 -5.701 13.723 5.524 679 HG21 THR 84 HG21 THR 84 -8.058 12.262 3.049 680 HG22 THR 84 HG22 THR 84 -6.353 12.082 3.510 681 HG23 THR 84 HG23 THR 84 -7.614 11.283 4.463 682 H ALA 85 H ALA 85 -6.673 14.864 1.533 683 HA ALA 85 HA ALA 85 -4.940 15.031 0.171 684 HB1 ALA 85 HB1 ALA 85 -3.459 16.356 2.450 685 HB2 ALA 85 HB2 ALA 85 -3.061 16.444 0.720 686 HB3 ALA 85 HB3 ALA 85 -4.565 17.153 1.324 687 H ARG 86 H ARG 86 -3.737 13.652 -0.709 688 HA ARG 86 HA ARG 86 -2.412 11.539 0.968 689 HB2 ARG 86 HB2 ARG 86 -2.881 11.769 -2.026 690 HB3 ARG 86 HB3 ARG 86 -1.913 10.488 -1.304 691 HG2 ARG 86 HG2 ARG 86 -3.844 9.609 -0.218 692 HG3 ARG 86 HG3 ARG 86 -4.849 10.991 -0.715 693 HD2 ARG 86 HD2 ARG 86 -4.542 10.418 -3.063 694 HD3 ARG 86 HD3 ARG 86 -3.483 9.058 -2.651 695 HE ARG 86 HE ARG 86 -6.283 9.158 -2.871 696 HH11 ARG 86 HH11 ARG 86 -3.901 7.398 -0.924 697 HH12 ARG 86 HH12 ARG 86 -5.074 6.221 -0.370 698 HH21 ARG 86 HH21 ARG 86 -7.660 7.659 -2.341 699 HH22 ARG 86 HH22 ARG 86 -7.400 6.416 -1.164 700 H VAL 87 H VAL 87 -0.163 10.902 -0.156 701 HA VAL 87 HA VAL 87 1.591 13.092 -0.834 702 HB VAL 87 HB VAL 87 3.286 12.401 0.896 703 HG11 VAL 87 HG11 VAL 87 1.872 14.471 1.012 704 HG12 VAL 87 HG12 VAL 87 0.756 13.591 2.067 705 HG13 VAL 87 HG13 VAL 87 2.434 13.872 2.586 706 HG21 VAL 87 HG21 VAL 87 2.274 10.241 1.595 707 HG22 VAL 87 HG22 VAL 87 2.534 11.334 2.959 708 HG23 VAL 87 HG23 VAL 87 0.896 11.122 2.306 709 H ASP 88 H ASP 88 3.503 12.400 -1.865 710 HA ASP 88 HA ASP 88 3.397 9.750 -3.099 711 HB2 ASP 88 HB2 ASP 88 5.221 12.065 -3.816 712 HB3 ASP 88 HB3 ASP 88 4.755 10.644 -4.790 713 H ILE 89 H ILE 89 5.870 9.031 -3.709 714 HA ILE 89 HA ILE 89 7.148 8.251 -1.281 715 HB ILE 89 HB ILE 89 9.082 7.602 -2.978 716 HG12 ILE 89 HG12 ILE 89 6.955 8.154 -5.073 717 HG13 ILE 89 HG13 ILE 89 8.209 9.323 -4.708 718 HG21 ILE 89 HG21 ILE 89 7.268 6.050 -2.129 719 HG22 ILE 89 HG22 ILE 89 6.329 6.466 -3.592 720 HG23 ILE 89 HG23 ILE 89 7.897 5.665 -3.740 721 HD11 ILE 89 HD11 ILE 89 9.948 7.641 -5.269 722 HD12 ILE 89 HD12 ILE 89 8.656 6.515 -5.757 723 HD13 ILE 89 HD13 ILE 89 8.894 8.042 -6.619 724 H TYR 90 H TYR 90 7.591 11.139 -3.241 725 HA TYR 90 HA TYR 90 10.205 11.747 -1.961 726 HB2 TYR 90 HB2 TYR 90 8.443 13.047 -4.037 727 HB3 TYR 90 HB3 TYR 90 9.652 13.997 -3.204 728 HD1 TYR 90 HD1 TYR 90 10.032 10.449 -4.493 729 HD2 TYR 90 HD2 TYR 90 11.147 14.601 -4.844 730 HE1 TYR 90 HE1 TYR 90 11.611 9.861 -6.283 731 HE2 TYR 90 HE2 TYR 90 12.763 14.004 -6.630 732 HH TYR 90 HH TYR 90 13.167 12.222 -8.327 733 H GLY 91 H GLY 91 6.983 11.736 -0.882 734 HA2 GLY 91 HA2 GLY 91 6.121 12.609 1.034 735 HA3 GLY 91 HA3 GLY 91 7.557 13.634 1.245 736 H ASN 92 H ASN 92 6.433 13.929 -1.932 737 HA ASN 92 HA ASN 92 5.739 16.646 -1.676 738 HB2 ASN 92 HB2 ASN 92 4.592 14.857 -3.824 739 HB3 ASN 92 HB3 ASN 92 4.943 16.562 -3.944 740 HD21 ASN 92 HD21 ASN 92 5.708 14.029 -5.516 741 HD22 ASN 92 HD22 ASN 92 7.444 14.137 -5.650 742 H GLU 93 H GLU 93 3.655 17.665 -1.692 743 HA GLU 93 HA GLU 93 1.499 16.002 -0.587 744 HB2 GLU 93 HB2 GLU 93 2.279 18.804 -0.457 745 HB3 GLU 93 HB3 GLU 93 0.638 18.698 -1.142 746 HG2 GLU 93 HG2 GLU 93 -0.138 17.364 0.676 747 HG3 GLU 93 HG3 GLU 93 1.487 17.242 1.376 748 H VAL 94 H VAL 94 -0.427 15.570 -1.598 749 HA VAL 94 HA VAL 94 -0.808 16.479 -4.371 750 HB VAL 94 HB VAL 94 -1.549 14.378 -5.200 751 HG11 VAL 94 HG11 VAL 94 1.029 13.890 -3.733 752 HG12 VAL 94 HG12 VAL 94 0.365 13.064 -5.160 753 HG13 VAL 94 HG13 VAL 94 0.823 14.758 -5.281 754 HG21 VAL 94 HG21 VAL 94 -1.722 12.417 -4.002 755 HG22 VAL 94 HG22 VAL 94 -1.102 13.239 -2.527 756 HG23 VAL 94 HG23 VAL 94 -2.693 13.629 -3.189 757 H ASP 95 H ASP 95 -3.259 15.614 -4.922 758 HA ASP 95 HA ASP 95 -4.891 17.443 -3.364 759 HB2 ASP 95 HB2 ASP 95 -5.496 15.366 -5.527 760 HB3 ASP 95 HB3 ASP 95 -6.659 16.550 -4.930 761 H VAL 96 H VAL 96 -7.295 16.328 -2.921 762 HA VAL 96 HA VAL 96 -6.723 14.110 -1.018 763 HB VAL 96 HB VAL 96 -8.441 15.041 0.281 764 HG11 VAL 96 HG11 VAL 96 -6.336 16.602 0.016 765 HG12 VAL 96 HG12 VAL 96 -7.384 17.644 -0.908 766 HG13 VAL 96 HG13 VAL 96 -7.783 17.275 0.774 767 HG21 VAL 96 HG21 VAL 96 -10.251 15.480 -1.281 768 HG22 VAL 96 HG22 VAL 96 -9.830 17.079 -0.665 769 HG23 VAL 96 HG23 VAL 96 -9.230 16.575 -2.236 770 H VAL 97 H VAL 97 -8.346 12.584 -0.585 771 HA VAL 97 HA VAL 97 -9.458 11.376 -2.980 772 HB VAL 97 HB VAL 97 -10.426 10.689 -0.166 773 HG11 VAL 97 HG11 VAL 97 -10.604 8.400 -1.113 774 HG12 VAL 97 HG12 VAL 97 -11.615 9.565 -1.966 775 HG13 VAL 97 HG13 VAL 97 -10.090 9.028 -2.700 776 HG21 VAL 97 HG21 VAL 97 -8.145 10.666 0.135 777 HG22 VAL 97 HG22 VAL 97 -8.564 8.981 -0.143 778 HG23 VAL 97 HG23 VAL 97 -7.804 9.944 -1.450 779 H THR 98 H THR 98 -11.712 11.548 -3.772 780 HA THR 98 HA THR 98 -13.222 13.802 -2.869 781 HB THR 98 HB THR 98 -14.971 12.736 -4.436 782 HG1 THR 98 HG1 THR 98 -14.407 10.977 -5.538 783 HG21 THR 98 HG21 THR 98 -13.305 14.409 -5.241 784 HG22 THR 98 HG22 THR 98 -12.186 13.075 -5.591 785 HG23 THR 98 HG23 THR 98 -13.718 13.207 -6.471 786 HA PRO 99 HA PRO 99 -15.581 12.071 0.352 787 HB2 PRO 99 HB2 PRO 99 -18.218 12.777 -0.131 788 HB3 PRO 99 HB3 PRO 99 -16.957 13.865 0.530 789 HG2 PRO 99 HG2 PRO 99 -17.886 13.594 -2.334 790 HG3 PRO 99 HG3 PRO 99 -17.579 15.097 -1.401 791 HD2 PRO 99 HD2 PRO 99 -15.743 14.123 -3.123 792 HD3 PRO 99 HD3 PRO 99 -15.221 14.807 -1.567 793 H GLU 100 H GLU 100 -16.796 11.203 -2.855 794 HA GLU 100 HA GLU 100 -18.306 8.921 -1.885 795 HB2 GLU 100 HB2 GLU 100 -17.524 9.848 -4.654 796 HB3 GLU 100 HB3 GLU 100 -18.453 8.377 -4.308 797 HG2 GLU 100 HG2 GLU 100 -20.049 9.863 -2.935 798 HG3 GLU 100 HG3 GLU 100 -19.231 11.256 -3.653 799 H GLN 101 H GLN 101 -15.155 9.370 -3.628 800 HA GLN 101 HA GLN 101 -14.651 6.574 -3.736 801 HB2 GLN 101 HB2 GLN 101 -12.724 8.920 -3.858 802 HB3 GLN 101 HB3 GLN 101 -12.250 7.233 -4.100 803 HG2 GLN 101 HG2 GLN 101 -13.940 7.045 -5.952 804 HG3 GLN 101 HG3 GLN 101 -14.319 8.742 -5.755 805 HE21 GLN 101 HE21 GLN 101 -11.813 6.450 -6.819 806 HE22 GLN 101 HE22 GLN 101 -11.026 7.653 -7.864 807 H ALA 102 H ALA 102 -14.174 8.890 -1.096 808 HA ALA 102 HA ALA 102 -12.467 7.143 0.447 809 HB1 ALA 102 HB1 ALA 102 -13.088 8.611 2.346 810 HB2 ALA 102 HB2 ALA 102 -12.595 9.536 0.919 811 HB3 ALA 102 HB3 ALA 102 -14.322 9.402 1.338 812 H LYS 103 H LYS 103 -16.071 7.758 0.601 813 HA LYS 103 HA LYS 103 -16.499 5.740 2.577 814 HB2 LYS 103 HB2 LYS 103 -18.884 5.896 2.031 815 HB3 LYS 103 HB3 LYS 103 -18.147 7.476 2.279 816 HG2 LYS 103 HG2 LYS 103 -18.055 7.815 -0.143 817 HG3 LYS 103 HG3 LYS 103 -18.718 6.219 -0.435 818 HD2 LYS 103 HD2 LYS 103 -20.548 7.579 -0.754 819 HD3 LYS 103 HD3 LYS 103 -20.780 7.041 0.916 820 HE2 LYS 103 HE2 LYS 103 -19.785 9.190 1.718 821 HE3 LYS 103 HE3 LYS 103 -19.491 9.673 0.039 822 HZ1 LYS 103 HZ1 LYS 103 -22.106 9.424 1.388 823 HZ2 LYS 103 HZ2 LYS 103 -21.491 10.725 0.583 824 HZ3 LYS 103 HZ3 LYS 103 -21.992 9.420 -0.226 825 H TYR 104 H TYR 104 -16.314 5.440 -0.923 826 HA TYR 104 HA TYR 104 -17.431 2.957 -1.347 827 HB2 TYR 104 HB2 TYR 104 -16.444 4.680 -2.988 828 HB3 TYR 104 HB3 TYR 104 -14.908 3.867 -2.741 829 HD1 TYR 104 HD1 TYR 104 -18.528 3.052 -3.489 830 HD2 TYR 104 HD2 TYR 104 -14.387 2.154 -4.329 831 HE1 TYR 104 HE1 TYR 104 -19.232 1.540 -5.303 832 HE2 TYR 104 HE2 TYR 104 -15.093 0.623 -6.120 833 HH TYR 104 HH TYR 104 -18.505 0.334 -7.152 834 H ALA 105 H ALA 105 -14.473 3.697 0.289 835 HA ALA 105 HA ALA 105 -13.005 1.311 0.028 836 HB1 ALA 105 HB1 ALA 105 -13.277 3.117 2.471 837 HB2 ALA 105 HB2 ALA 105 -11.947 2.010 2.138 838 HB3 ALA 105 HB3 ALA 105 -12.184 3.426 1.103 839 H TYR 106 H TYR 106 -15.919 2.006 1.953 840 HA TYR 106 HA TYR 106 -15.747 -0.153 3.743 841 HB2 TYR 106 HB2 TYR 106 -17.751 0.509 4.437 842 HB3 TYR 106 HB3 TYR 106 -17.471 1.922 3.448 843 HD1 TYR 106 HD1 TYR 106 -18.391 1.736 0.889 844 HD2 TYR 106 HD2 TYR 106 -19.595 -0.879 4.137 845 HE1 TYR 106 HE1 TYR 106 -20.486 1.144 -0.326 846 HE2 TYR 106 HE2 TYR 106 -21.654 -1.471 2.907 847 HH TYR 106 HH TYR 106 -22.635 -0.034 -0.162 848 H GLN 107 H GLN 107 -16.893 -0.122 0.346 849 HA GLN 107 HA GLN 107 -18.068 -2.738 0.409 850 HB2 GLN 107 HB2 GLN 107 -16.805 -1.132 -1.837 851 HB3 GLN 107 HB3 GLN 107 -17.451 -2.763 -2.052 852 HG2 GLN 107 HG2 GLN 107 -19.624 -1.706 -0.909 853 HG3 GLN 107 HG3 GLN 107 -18.933 -0.208 -1.566 854 HE21 GLN 107 HE21 GLN 107 -17.955 -0.767 -4.011 855 HE22 GLN 107 HE22 GLN 107 -19.132 -1.520 -5.038 856 H ARG 108 H ARG 108 -14.814 -1.526 -0.318 857 HA ARG 108 HA ARG 108 -13.680 -4.062 -0.947 858 HB2 ARG 108 HB2 ARG 108 -12.169 -1.713 0.286 859 HB3 ARG 108 HB3 ARG 108 -11.540 -2.914 -0.818 860 HG2 ARG 108 HG2 ARG 108 -13.497 -0.633 -1.439 861 HG3 ARG 108 HG3 ARG 108 -11.822 -0.765 -1.955 862 HD2 ARG 108 HD2 ARG 108 -14.174 -2.469 -2.850 863 HD3 ARG 108 HD3 ARG 108 -13.249 -1.329 -3.851 864 HE ARG 108 HE ARG 108 -12.763 -4.076 -3.325 865 HH11 ARG 108 HH11 ARG 108 -10.872 -1.104 -3.998 866 HH12 ARG 108 HH12 ARG 108 -9.497 -2.013 -4.492 867 HH21 ARG 108 HH21 ARG 108 -10.863 -5.174 -3.670 868 HH22 ARG 108 HH22 ARG 108 -9.371 -4.322 -3.974 869 H TYR 109 H TYR 109 -14.285 -2.439 2.186 870 HA TYR 109 HA TYR 109 -12.553 -4.162 3.705 871 HB2 TYR 109 HB2 TYR 109 -13.432 -1.983 4.461 872 HB3 TYR 109 HB3 TYR 109 -15.043 -2.613 4.593 873 HD1 TYR 109 HD1 TYR 109 -15.336 -4.840 6.132 874 HD2 TYR 109 HD2 TYR 109 -12.141 -1.932 6.433 875 HE1 TYR 109 HE1 TYR 109 -14.875 -5.565 8.448 876 HE2 TYR 109 HE2 TYR 109 -11.721 -2.649 8.738 877 HH TYR 109 HH TYR 109 -12.347 -3.978 10.449 878 H GLN 110 H GLN 110 -16.073 -4.189 3.002 879 HA GLN 110 HA GLN 110 -16.490 -6.648 4.383 880 HB2 GLN 110 HB2 GLN 110 -18.706 -6.744 3.405 881 HB3 GLN 110 HB3 GLN 110 -18.363 -5.152 4.085 882 HG2 GLN 110 HG2 GLN 110 -18.029 -4.208 1.908 883 HG3 GLN 110 HG3 GLN 110 -18.087 -5.791 1.116 884 HE21 GLN 110 HE21 GLN 110 -20.052 -3.151 2.408 885 HE22 GLN 110 HE22 GLN 110 -21.563 -3.866 1.848 886 H GLU 111 H GLU 111 -15.412 -5.978 1.122 887 HA GLU 111 HA GLU 111 -16.180 -8.406 -0.098 888 HB2 GLU 111 HB2 GLU 111 -14.983 -7.790 -1.773 889 HB3 GLU 111 HB3 GLU 111 -14.990 -6.186 -1.019 890 HG2 GLU 111 HG2 GLU 111 -12.654 -6.714 -0.306 891 HG3 GLU 111 HG3 GLU 111 -12.757 -8.218 -1.226 892 H ARG 112 H ARG 112 -13.397 -7.617 1.577 893 HA ARG 112 HA ARG 112 -12.306 -10.421 1.712 894 HB2 ARG 112 HB2 ARG 112 -11.158 -7.691 2.279 895 HB3 ARG 112 HB3 ARG 112 -10.313 -9.144 2.836 896 HG2 ARG 112 HG2 ARG 112 -9.807 -9.907 0.729 897 HG3 ARG 112 HG3 ARG 112 -11.243 -9.190 0.009 898 HD2 ARG 112 HD2 ARG 112 -10.020 -6.913 0.570 899 HD3 ARG 112 HD3 ARG 112 -8.567 -7.930 0.557 900 HE ARG 112 HE ARG 112 -10.238 -7.097 -1.666 901 HH11 ARG 112 HH11 ARG 112 -7.961 -9.736 -0.794 902 HH12 ARG 112 HH12 ARG 112 -8.117 -10.478 -2.358 903 HH21 ARG 112 HH21 ARG 112 -10.383 -8.071 -3.602 904 HH22 ARG 112 HH22 ARG 112 -9.446 -9.502 -4.020 905 H TYR 113 H TYR 113 -13.567 -8.019 4.029 906 HA TYR 113 HA TYR 113 -12.966 -9.922 6.254 907 HB2 TYR 113 HB2 TYR 113 -13.390 -6.956 6.448 908 HB3 TYR 113 HB3 TYR 113 -12.717 -8.026 7.685 909 HD1 TYR 113 HD1 TYR 113 -11.874 -5.500 5.535 910 HD2 TYR 113 HD2 TYR 113 -10.577 -9.484 6.547 911 HE1 TYR 113 HE1 TYR 113 -9.728 -5.071 4.402 912 HE2 TYR 113 HE2 TYR 113 -8.405 -9.070 5.436 913 HH TYR 113 HH TYR 113 -7.758 -5.945 3.761 914 H GLY 114 H GLY 114 -15.430 -9.305 4.329 915 HA2 GLY 114 HA2 GLY 114 -17.476 -9.426 6.494 916 HA3 GLY 114 HA3 GLY 114 -17.680 -8.368 5.093 917 H ASN 115 H ASN 115 -19.644 -9.618 4.828 918 HA ASN 115 HA ASN 115 -19.294 -12.110 3.284 919 HB2 ASN 115 HB2 ASN 115 -21.593 -12.713 4.256 920 HB3 ASN 115 HB3 ASN 115 -20.168 -12.962 5.242 921 HD21 ASN 115 HD21 ASN 115 -22.777 -10.478 4.738 922 HD22 ASN 115 HD22 ASN 115 -22.765 -9.978 6.435 923 H LYS 116 H LYS 116 -19.635 -11.419 1.284 924 HA LYS 116 HA LYS 116 -21.190 -9.059 0.613 925 HB2 LYS 116 HB2 LYS 116 -20.875 -9.856 -1.709 926 HB3 LYS 116 HB3 LYS 116 -19.351 -9.764 -0.827 927 HG2 LYS 116 HG2 LYS 116 -19.265 -12.169 -0.542 928 HG3 LYS 116 HG3 LYS 116 -20.912 -12.375 -1.178 929 HD2 LYS 116 HD2 LYS 116 -20.221 -11.469 -3.361 930 HD3 LYS 116 HD3 LYS 116 -18.586 -11.232 -2.748 931 HE2 LYS 116 HE2 LYS 116 -18.448 -13.732 -2.396 932 HE3 LYS 116 HE3 LYS 116 -20.026 -13.858 -3.209 933 HZ1 LYS 116 HZ1 LYS 116 -17.561 -12.741 -4.372 934 HZ2 LYS 116 HZ2 LYS 116 -18.236 -14.187 -4.765 935 HZ3 LYS 116 HZ3 LYS 116 -19.023 -12.775 -5.138 936 H LYS 117 H LYS 117 -23.205 -9.156 -0.812 937 HA LYS 117 HA LYS 117 -24.731 -11.661 -0.482 938 HB2 LYS 117 HB2 LYS 117 -25.358 -10.291 1.455 939 HB3 LYS 117 HB3 LYS 117 -25.730 -8.921 0.388 940 HG2 LYS 117 HG2 LYS 117 -27.567 -10.165 -0.673 941 HG3 LYS 117 HG3 LYS 117 -27.086 -11.642 0.138 942 HD2 LYS 117 HD2 LYS 117 -29.019 -10.742 1.292 943 HD3 LYS 117 HD3 LYS 117 -27.618 -10.634 2.351 944 HE2 LYS 117 HE2 LYS 117 -28.902 -8.614 2.558 945 HE3 LYS 117 HE3 LYS 117 -27.360 -8.226 1.784 946 HZ1 LYS 117 HZ1 LYS 117 -29.342 -7.186 0.740 947 HZ2 LYS 117 HZ2 LYS 117 -28.457 -8.041 -0.307 948 HZ3 LYS 117 HZ3 LYS 117 -29.851 -8.687 0.258 949 H SER 118 H SER 118 -26.096 -12.081 -2.126 950 HA SER 118 HA SER 118 -26.832 -10.027 -4.083 951 HB2 SER 118 HB2 SER 118 -25.115 -12.470 -4.600 952 HB3 SER 118 HB3 SER 118 -26.267 -11.847 -5.781 953 HG SER 118 HG SER 118 -24.046 -10.445 -4.652 954 H GLN 119 H GLN 119 -28.899 -10.400 -4.690 955 HA GLN 119 HA GLN 119 -30.130 -13.057 -4.576 956 HB2 GLN 119 HB2 GLN 119 -31.879 -12.504 -3.003 957 HB3 GLN 119 HB3 GLN 119 -30.316 -12.271 -2.225 958 HG2 GLN 119 HG2 GLN 119 -30.560 -9.767 -2.813 959 HG3 GLN 119 HG3 GLN 119 -32.231 -10.147 -3.248 960 HE21 GLN 119 HE21 GLN 119 -33.703 -10.830 -1.540 961 HE22 GLN 119 HE22 GLN 119 -33.314 -10.495 0.140 962 H ASP 120 H ASP 120 -30.282 -9.601 -5.259 963 HA ASP 120 HA ASP 120 -32.422 -9.968 -7.265 964 HB2 ASP 120 HB2 ASP 120 -32.042 -7.215 -6.904 965 HB3 ASP 120 HB3 ASP 120 -33.381 -8.193 -6.379 966 H LEU 121 H LEU 121 -32.089 -8.447 -9.196 967 HA LEU 121 HA LEU 121 -29.282 -8.702 -10.101 968 HB2 LEU 121 HB2 LEU 121 -31.950 -8.561 -11.579 969 HB3 LEU 121 HB3 LEU 121 -30.406 -8.293 -12.368 970 HG LEU 121 HG LEU 121 -29.649 -10.577 -11.687 971 HD11 LEU 121 HD11 LEU 121 -32.550 -10.889 -10.773 972 HD12 LEU 121 HD12 LEU 121 -31.453 -12.247 -11.099 973 HD13 LEU 121 HD13 LEU 121 -31.078 -11.133 -9.798 974 HD21 LEU 121 HD21 LEU 121 -31.016 -11.733 -13.394 975 HD22 LEU 121 HD22 LEU 121 -32.220 -10.428 -13.329 976 HD23 LEU 121 HD23 LEU 121 -30.578 -10.106 -13.925 977 H LYS 122 H LYS 122 -28.100 -6.796 -10.352 978 HA LYS 122 HA LYS 122 -29.480 -4.281 -10.876 979 HB2 LYS 122 HB2 LYS 122 -27.665 -4.866 -8.480 980 HB3 LYS 122 HB3 LYS 122 -27.921 -3.250 -9.098 981 HG2 LYS 122 HG2 LYS 122 -30.127 -5.072 -8.019 982 HG3 LYS 122 HG3 LYS 122 -29.303 -3.827 -7.093 983 HD2 LYS 122 HD2 LYS 122 -30.853 -3.215 -9.639 984 HD3 LYS 122 HD3 LYS 122 -31.564 -3.165 -8.025 985 HE2 LYS 122 HE2 LYS 122 -30.455 -1.270 -7.391 986 HE3 LYS 122 HE3 LYS 122 -28.990 -1.696 -8.268 987 HZ1 LYS 122 HZ1 LYS 122 -31.396 -0.709 -9.643 988 HZ2 LYS 122 HZ2 LYS 122 -30.135 0.241 -9.152 989 HZ3 LYS 122 HZ3 LYS 122 -29.876 -0.947 -10.261 Start of MODEL 12 1 H1 GLY 1 H GLY 1 11.768 -9.618 20.499 2 HA2 GLY 1 HA2 GLY 1 12.908 -11.101 22.016 3 HA3 GLY 1 HA3 GLY 1 11.983 -12.060 20.845 4 H SER 2 H SER 2 13.348 -13.880 20.716 5 HA SER 2 HA SER 2 16.057 -14.042 20.773 6 HB2 SER 2 HB2 SER 2 15.629 -16.153 19.312 7 HB3 SER 2 HB3 SER 2 14.956 -16.038 20.935 8 HG SER 2 HG SER 2 13.519 -16.801 19.324 9 H ASN 3 H ASN 3 14.148 -13.251 17.873 10 HA ASN 3 HA ASN 3 16.710 -12.561 16.482 11 HB2 ASN 3 HB2 ASN 3 15.432 -14.691 15.658 12 HB3 ASN 3 HB3 ASN 3 14.252 -13.576 15.019 13 HD21 ASN 3 HD21 ASN 3 16.089 -15.446 13.583 14 HD22 ASN 3 HD22 ASN 3 16.837 -14.402 12.387 15 H GLN 4 H GLN 4 16.641 -10.493 15.612 16 HA GLN 4 HA GLN 4 14.062 -9.317 15.079 17 HB2 GLN 4 HB2 GLN 4 14.648 -8.727 17.491 18 HB3 GLN 4 HB3 GLN 4 16.095 -7.913 16.914 19 HG2 GLN 4 HG2 GLN 4 14.861 -6.213 15.789 20 HG3 GLN 4 HG3 GLN 4 13.362 -7.150 15.815 21 HE21 GLN 4 HE21 GLN 4 12.727 -7.794 18.217 22 HE22 GLN 4 HE22 GLN 4 12.767 -6.461 19.375 23 H GLN 5 H GLN 5 14.273 -7.426 13.656 24 HA GLN 5 HA GLN 5 16.685 -6.420 12.649 25 HB2 GLN 5 HB2 GLN 5 16.617 -7.438 10.386 26 HB3 GLN 5 HB3 GLN 5 16.971 -8.624 11.621 27 HG2 GLN 5 HG2 GLN 5 14.265 -8.955 11.523 28 HG3 GLN 5 HG3 GLN 5 14.521 -8.334 9.905 29 HE21 GLN 5 HE21 GLN 5 17.083 -9.551 9.247 30 HE22 GLN 5 HE22 GLN 5 16.801 -11.272 9.219 31 H LEU 6 H LEU 6 15.916 -5.452 10.310 32 HA LEU 6 HA LEU 6 13.486 -3.879 10.891 33 HB2 LEU 6 HB2 LEU 6 15.233 -3.376 8.492 34 HB3 LEU 6 HB3 LEU 6 14.302 -2.270 9.467 35 HG LEU 6 HG LEU 6 16.136 -2.805 11.317 36 HD11 LEU 6 HD11 LEU 6 18.370 -3.237 10.315 37 HD12 LEU 6 HD12 LEU 6 17.345 -4.611 9.995 38 HD13 LEU 6 HD13 LEU 6 17.640 -3.427 8.719 39 HD21 LEU 6 HD21 LEU 6 15.827 -0.605 10.282 40 HD22 LEU 6 HD22 LEU 6 17.544 -0.967 10.441 41 HD23 LEU 6 HD23 LEU 6 16.748 -1.111 8.858 42 H ASN 7 H ASN 7 14.761 -6.284 8.690 43 HA ASN 7 HA ASN 7 12.960 -6.004 6.520 44 HB2 ASN 7 HB2 ASN 7 14.673 -8.305 7.566 45 HB3 ASN 7 HB3 ASN 7 13.666 -8.504 6.139 46 HD21 ASN 7 HD21 ASN 7 16.508 -8.760 6.174 47 HD22 ASN 7 HD22 ASN 7 17.167 -7.499 5.149 48 H ALA 8 H ALA 8 11.375 -7.486 5.735 49 HA ALA 8 HA ALA 8 9.321 -8.053 7.634 50 HB1 ALA 8 HB1 ALA 8 9.708 -9.126 4.794 51 HB2 ALA 8 HB2 ALA 8 8.201 -9.125 5.719 52 HB3 ALA 8 HB3 ALA 8 8.926 -7.583 5.206 53 H THR 9 H THR 9 11.672 -10.066 5.925 54 HA THR 9 HA THR 9 12.567 -12.004 6.097 55 HB THR 9 HB THR 9 11.567 -11.967 8.960 56 HG1 THR 9 HG1 THR 9 13.694 -11.186 9.256 57 HG21 THR 9 HG21 THR 9 13.484 -13.474 9.382 58 HG22 THR 9 HG22 THR 9 12.299 -14.237 8.313 59 HG23 THR 9 HG23 THR 9 13.806 -13.569 7.640 60 H LYS 10 H LYS 10 11.992 -13.660 4.992 61 HA LYS 10 HA LYS 10 10.957 -15.389 4.098 62 HB2 LYS 10 HB2 LYS 10 11.020 -16.252 6.339 63 HB3 LYS 10 HB3 LYS 10 9.452 -15.539 6.720 64 HG2 LYS 10 HG2 LYS 10 8.284 -16.995 5.228 65 HG3 LYS 10 HG3 LYS 10 9.796 -17.560 4.471 66 HD2 LYS 10 HD2 LYS 10 10.471 -18.477 6.726 67 HD3 LYS 10 HD3 LYS 10 8.846 -18.123 7.313 68 HE2 LYS 10 HE2 LYS 10 9.461 -19.917 4.904 69 HE3 LYS 10 HE3 LYS 10 9.365 -20.517 6.559 70 HZ1 LYS 10 HZ1 LYS 10 7.054 -19.737 6.637 71 HZ2 LYS 10 HZ2 LYS 10 7.120 -19.335 5.043 72 HZ3 LYS 10 HZ3 LYS 10 7.327 -20.885 5.495 73 H LYS 11 H LYS 11 8.513 -13.123 5.411 74 HA LYS 11 HA LYS 11 6.471 -14.001 3.504 75 HB2 LYS 11 HB2 LYS 11 6.743 -11.439 5.138 76 HB3 LYS 11 HB3 LYS 11 5.389 -11.797 4.060 77 HG2 LYS 11 HG2 LYS 11 4.463 -12.478 6.008 78 HG3 LYS 11 HG3 LYS 11 5.189 -14.003 5.509 79 HD2 LYS 11 HD2 LYS 11 7.188 -13.449 6.951 80 HD3 LYS 11 HD3 LYS 11 6.378 -11.976 7.478 81 HE2 LYS 11 HE2 LYS 11 5.561 -14.857 7.952 82 HE3 LYS 11 HE3 LYS 11 6.176 -13.708 9.145 83 HZ1 LYS 11 HZ1 LYS 11 3.926 -13.696 9.485 84 HZ2 LYS 11 HZ2 LYS 11 4.126 -12.355 8.614 85 HZ3 LYS 11 HZ3 LYS 11 3.524 -13.728 7.887 86 H ASP 12 H ASP 12 7.160 -13.944 1.361 87 HA ASP 12 HA ASP 12 8.973 -12.116 0.287 88 HB2 ASP 12 HB2 ASP 12 8.567 -13.084 -1.760 89 HB3 ASP 12 HB3 ASP 12 8.087 -14.374 -0.660 90 H LYS 13 H LYS 13 5.409 -11.967 0.250 91 HA LYS 13 HA LYS 13 5.175 -9.609 -1.272 92 HB2 LYS 13 HB2 LYS 13 3.341 -10.130 1.110 93 HB3 LYS 13 HB3 LYS 13 2.924 -9.338 -0.390 94 HG2 LYS 13 HG2 LYS 13 3.562 -12.306 -0.124 95 HG3 LYS 13 HG3 LYS 13 1.964 -11.653 0.100 96 HD2 LYS 13 HD2 LYS 13 3.482 -11.339 -2.520 97 HD3 LYS 13 HD3 LYS 13 2.410 -12.689 -2.134 98 HE2 LYS 13 HE2 LYS 13 0.693 -10.722 -1.506 99 HE3 LYS 13 HE3 LYS 13 1.703 -9.795 -2.627 100 HZ1 LYS 13 HZ1 LYS 13 1.246 -11.636 -4.261 101 HZ2 LYS 13 HZ2 LYS 13 0.184 -12.280 -3.204 102 HZ3 LYS 13 HZ3 LYS 13 -0.116 -10.815 -3.817 103 H LEU 14 H LEU 14 5.344 -9.920 2.285 104 HA LEU 14 HA LEU 14 5.344 -7.114 2.757 105 HB2 LEU 14 HB2 LEU 14 6.400 -9.402 4.436 106 HB3 LEU 14 HB3 LEU 14 6.077 -7.782 5.025 107 HG LEU 14 HG LEU 14 4.009 -9.777 3.981 108 HD11 LEU 14 HD11 LEU 14 4.919 -10.151 6.285 109 HD12 LEU 14 HD12 LEU 14 4.386 -8.519 6.709 110 HD13 LEU 14 HD13 LEU 14 3.185 -9.753 6.269 111 HD21 LEU 14 HD21 LEU 14 2.377 -7.978 4.825 112 HD22 LEU 14 HD22 LEU 14 3.775 -6.885 4.824 113 HD23 LEU 14 HD23 LEU 14 3.200 -7.612 3.306 114 H GLN 15 H GLN 15 7.998 -9.368 2.100 115 HA GLN 15 HA GLN 15 10.108 -7.701 2.994 116 HB2 GLN 15 HB2 GLN 15 10.175 -10.139 2.621 117 HB3 GLN 15 HB3 GLN 15 10.119 -9.890 0.875 118 HG2 GLN 15 HG2 GLN 15 12.290 -8.845 0.898 119 HG3 GLN 15 HG3 GLN 15 12.302 -8.802 2.672 120 HE21 GLN 15 HE21 GLN 15 14.399 -9.971 1.028 121 HE22 GLN 15 HE22 GLN 15 14.451 -11.652 1.499 122 H VAL 16 H VAL 16 8.473 -7.805 -0.240 123 HA VAL 16 HA VAL 16 10.420 -5.924 -1.305 124 HB VAL 16 HB VAL 16 8.863 -5.600 -3.181 125 HG11 VAL 16 HG11 VAL 16 9.025 -7.869 -4.067 126 HG12 VAL 16 HG12 VAL 16 10.490 -7.408 -3.175 127 HG13 VAL 16 HG13 VAL 16 9.309 -8.518 -2.435 128 HG21 VAL 16 HG21 VAL 16 6.689 -5.908 -2.016 129 HG22 VAL 16 HG22 VAL 16 6.853 -6.880 -3.480 130 HG23 VAL 16 HG23 VAL 16 7.043 -7.658 -1.904 131 H ILE 17 H ILE 17 7.361 -5.587 0.431 132 HA ILE 17 HA ILE 17 7.107 -2.774 -0.083 133 HB ILE 17 HB ILE 17 5.839 -4.255 2.231 134 HG12 ILE 17 HG12 ILE 17 4.453 -3.884 -0.458 135 HG13 ILE 17 HG13 ILE 17 5.379 -5.326 -0.113 136 HG21 ILE 17 HG21 ILE 17 4.034 -2.524 1.871 137 HG22 ILE 17 HG22 ILE 17 5.600 -1.834 2.312 138 HG23 ILE 17 HG23 ILE 17 5.032 -1.781 0.621 139 HD11 ILE 17 HD11 ILE 17 2.858 -4.374 1.202 140 HD12 ILE 17 HD12 ILE 17 3.216 -5.960 0.521 141 HD13 ILE 17 HD13 ILE 17 3.931 -5.496 2.068 142 H ASP 18 H ASP 18 8.543 -4.661 2.634 143 HA ASP 18 HA ASP 18 9.104 -2.309 4.230 144 HB2 ASP 18 HB2 ASP 18 10.130 -5.134 4.255 145 HB3 ASP 18 HB3 ASP 18 11.043 -3.900 5.116 146 H TRP 19 H TRP 19 10.831 -3.889 1.551 147 HA TRP 19 HA TRP 19 13.277 -2.452 1.828 148 HB2 TRP 19 HB2 TRP 19 13.248 -4.364 0.434 149 HB3 TRP 19 HB3 TRP 19 11.929 -3.770 -0.547 150 HD1 TRP 19 HD1 TRP 19 12.549 -2.032 -2.559 151 HE1 TRP 19 HE1 TRP 19 14.638 -1.534 -3.746 152 HE3 TRP 19 HE3 TRP 19 15.911 -4.011 0.818 153 HZ2 TRP 19 HZ2 TRP 19 17.481 -2.113 -3.520 154 HZ3 TRP 19 HZ3 TRP 19 18.335 -3.969 0.286 155 HH2 TRP 19 HH2 TRP 19 19.139 -3.051 -1.865 156 H LEU 20 H LEU 20 10.481 -1.766 -0.428 157 HA LEU 20 HA LEU 20 11.604 0.627 -1.357 158 HB2 LEU 20 HB2 LEU 20 9.526 1.178 -2.323 159 HB3 LEU 20 HB3 LEU 20 9.772 -0.556 -2.456 160 HG LEU 20 HG LEU 20 8.331 -0.461 -0.163 161 HD11 LEU 20 HD11 LEU 20 7.217 1.840 -1.786 162 HD12 LEU 20 HD12 LEU 20 6.438 1.076 -0.395 163 HD13 LEU 20 HD13 LEU 20 7.944 1.979 -0.179 164 HD21 LEU 20 HD21 LEU 20 6.394 -1.135 -1.379 165 HD22 LEU 20 HD22 LEU 20 7.008 -0.417 -2.869 166 HD23 LEU 20 HD23 LEU 20 7.829 -1.825 -2.136 167 H ILE 21 H ILE 21 9.655 0.126 1.576 168 HA ILE 21 HA ILE 21 9.115 2.865 2.141 169 HB ILE 21 HB ILE 21 9.348 0.371 3.871 170 HG12 ILE 21 HG12 ILE 21 6.813 1.903 3.144 171 HG13 ILE 21 HG13 ILE 21 7.426 0.606 2.165 172 HG21 ILE 21 HG21 ILE 21 9.827 2.086 5.405 173 HG22 ILE 21 HG22 ILE 21 8.665 3.210 4.702 174 HG23 ILE 21 HG23 ILE 21 8.087 1.808 5.617 175 HD11 ILE 21 HD11 ILE 21 5.706 -0.194 3.704 176 HD12 ILE 21 HD12 ILE 21 7.263 -0.938 4.144 177 HD13 ILE 21 HD13 ILE 21 6.585 0.406 5.085 178 H GLU 22 H GLU 22 11.806 0.710 3.199 179 HA GLU 22 HA GLU 22 13.088 2.787 4.743 180 HB2 GLU 22 HB2 GLU 22 13.197 0.325 5.098 181 HB3 GLU 22 HB3 GLU 22 14.175 0.159 3.651 182 HG2 GLU 22 HG2 GLU 22 16.030 1.302 4.648 183 HG3 GLU 22 HG3 GLU 22 15.018 1.972 5.944 184 H ASN 23 H ASN 23 13.129 1.921 1.358 185 HA ASN 23 HA ASN 23 15.659 3.126 0.703 186 HB2 ASN 23 HB2 ASN 23 15.199 1.698 -0.911 187 HB3 ASN 23 HB3 ASN 23 13.518 1.564 -0.543 188 HD21 ASN 23 HD21 ASN 23 12.022 2.919 -1.499 189 HD22 ASN 23 HD22 ASN 23 12.399 3.725 -3.042 190 H PHE 24 H PHE 24 12.331 4.061 0.346 191 HA PHE 24 HA PHE 24 13.128 6.882 -0.274 192 HB2 PHE 24 HB2 PHE 24 10.770 5.288 -1.170 193 HB3 PHE 24 HB3 PHE 24 10.541 7.004 -0.919 194 HD1 PHE 24 HD1 PHE 24 12.996 8.330 -1.849 195 HD2 PHE 24 HD2 PHE 24 10.766 5.045 -3.507 196 HE1 PHE 24 HE1 PHE 24 13.785 8.914 -4.109 197 HE2 PHE 24 HE2 PHE 24 11.582 5.667 -5.803 198 HZ PHE 24 HZ PHE 24 13.019 7.647 -6.075 199 HA PRO 25 HA PRO 25 11.491 7.186 3.975 200 HB2 PRO 25 HB2 PRO 25 13.363 8.871 5.017 201 HB3 PRO 25 HB3 PRO 25 13.718 7.148 4.709 202 HG2 PRO 25 HG2 PRO 25 14.306 9.511 2.881 203 HG3 PRO 25 HG3 PRO 25 15.457 8.267 3.484 204 HD2 PRO 25 HD2 PRO 25 14.282 7.971 1.094 205 HD3 PRO 25 HD3 PRO 25 14.482 6.575 2.204 206 H ASN 26 H ASN 26 10.946 9.126 1.355 207 HA ASN 26 HA ASN 26 10.658 11.687 2.717 208 HB2 ASN 26 HB2 ASN 26 9.868 10.635 -0.018 209 HB3 ASN 26 HB3 ASN 26 9.210 12.152 0.586 210 HD21 ASN 26 HD21 ASN 26 12.155 10.575 -0.433 211 HD22 ASN 26 HD22 ASN 26 13.184 11.992 -0.370 212 H ALA 27 H ALA 27 8.710 8.818 2.279 213 HA ALA 27 HA ALA 27 6.668 9.571 4.137 214 HB1 ALA 27 HB1 ALA 27 4.854 9.722 2.222 215 HB2 ALA 27 HB2 ALA 27 5.858 11.163 2.461 216 HB3 ALA 27 HB3 ALA 27 6.252 10.056 1.149 217 H PHE 28 H PHE 28 6.251 7.477 4.806 218 HA PHE 28 HA PHE 28 4.858 5.647 3.262 219 HB2 PHE 28 HB2 PHE 28 7.810 5.287 3.164 220 HB3 PHE 28 HB3 PHE 28 6.903 3.887 3.672 221 HD1 PHE 28 HD1 PHE 28 4.555 3.598 2.203 222 HD2 PHE 28 HD2 PHE 28 8.265 5.318 0.810 223 HE1 PHE 28 HE1 PHE 28 3.848 3.221 -0.131 224 HE2 PHE 28 HE2 PHE 28 7.539 4.951 -1.524 225 HZ PHE 28 HZ PHE 28 5.305 3.928 -2.002 226 H PHE 29 H PHE 29 4.435 3.573 4.577 227 HA PHE 29 HA PHE 29 5.087 3.788 7.448 228 HB2 PHE 29 HB2 PHE 29 2.268 3.486 6.343 229 HB3 PHE 29 HB3 PHE 29 2.725 3.467 8.042 230 HD1 PHE 29 HD1 PHE 29 2.157 5.592 5.048 231 HD2 PHE 29 HD2 PHE 29 3.360 5.575 9.182 232 HE1 PHE 29 HE1 PHE 29 2.011 8.073 5.102 233 HE2 PHE 29 HE2 PHE 29 3.130 8.050 9.258 234 HZ PHE 29 HZ PHE 29 2.487 9.303 7.199 235 H LYS 30 H LYS 30 4.815 1.708 8.518 236 HA LYS 30 HA LYS 30 4.843 -0.623 6.641 237 HB2 LYS 30 HB2 LYS 30 5.857 -0.453 9.513 238 HB3 LYS 30 HB3 LYS 30 5.837 -1.848 8.471 239 HG2 LYS 30 HG2 LYS 30 8.014 -1.196 8.371 240 HG3 LYS 30 HG3 LYS 30 7.346 -0.551 6.877 241 HD2 LYS 30 HD2 LYS 30 7.281 1.705 7.855 242 HD3 LYS 30 HD3 LYS 30 7.696 1.067 9.461 243 HE2 LYS 30 HE2 LYS 30 9.897 0.386 8.718 244 HE3 LYS 30 HE3 LYS 30 9.491 0.720 7.035 245 HZ1 LYS 30 HZ1 LYS 30 10.764 2.507 7.860 246 HZ2 LYS 30 HZ2 LYS 30 9.216 3.099 7.717 247 HZ3 LYS 30 HZ3 LYS 30 9.823 2.721 9.187 248 H LYS 31 H LYS 31 3.751 0.343 9.913 249 HA LYS 31 HA LYS 31 2.026 -1.979 10.168 250 HB2 LYS 31 HB2 LYS 31 2.571 0.454 11.897 251 HB3 LYS 31 HB3 LYS 31 1.545 -0.909 12.394 252 HG2 LYS 31 HG2 LYS 31 3.402 -2.477 12.212 253 HG3 LYS 31 HG3 LYS 31 4.450 -1.257 11.493 254 HD2 LYS 31 HD2 LYS 31 4.197 0.090 13.610 255 HD3 LYS 31 HD3 LYS 31 3.440 -1.327 14.334 256 HE2 LYS 31 HE2 LYS 31 5.805 -1.147 14.951 257 HE3 LYS 31 HE3 LYS 31 5.489 -2.630 14.065 258 HZ1 LYS 31 HZ1 LYS 31 6.550 -1.730 12.149 259 HZ2 LYS 31 HZ2 LYS 31 6.624 -0.200 12.829 260 HZ3 LYS 31 HZ3 LYS 31 7.522 -1.439 13.406 261 H GLY 32 H GLY 32 0.040 -2.139 9.432 262 HA2 GLY 32 HA2 GLY 32 -1.365 -0.374 7.878 263 HA3 GLY 32 HA3 GLY 32 -2.108 -1.667 8.825 264 H ASN 33 H ASN 33 -1.553 -0.669 11.425 265 HA ASN 33 HA ASN 33 -3.747 1.017 11.885 266 HB2 ASN 33 HB2 ASN 33 -2.788 1.397 14.172 267 HB3 ASN 33 HB3 ASN 33 -2.980 -0.277 13.687 268 HD21 ASN 33 HD21 ASN 33 -0.266 2.207 13.277 269 HD22 ASN 33 HD22 ASN 33 0.887 1.110 14.030 270 H GLN 34 H GLN 34 -0.587 2.064 10.781 271 HA GLN 34 HA GLN 34 -1.420 4.871 11.348 272 HB2 GLN 34 HB2 GLN 34 0.984 5.477 11.354 273 HB3 GLN 34 HB3 GLN 34 0.469 4.490 12.715 274 HG2 GLN 34 HG2 GLN 34 1.507 2.511 11.761 275 HG3 GLN 34 HG3 GLN 34 1.835 3.347 10.255 276 HE21 GLN 34 HE21 GLN 34 2.486 3.777 13.826 277 HE22 GLN 34 HE22 GLN 34 4.137 4.271 13.567 278 H VAL 35 H VAL 35 -1.287 2.660 8.957 279 HA VAL 35 HA VAL 35 -0.007 4.126 6.865 280 HB VAL 35 HB VAL 35 -0.733 1.658 7.002 281 HG11 VAL 35 HG11 VAL 35 -2.774 0.931 6.141 282 HG12 VAL 35 HG12 VAL 35 -3.267 2.274 7.167 283 HG13 VAL 35 HG13 VAL 35 -3.171 2.526 5.436 284 HG21 VAL 35 HG21 VAL 35 -1.044 3.124 4.351 285 HG22 VAL 35 HG22 VAL 35 0.480 2.568 5.086 286 HG23 VAL 35 HG23 VAL 35 -0.726 1.389 4.577 287 H LYS 36 H LYS 36 -0.887 5.331 5.068 288 HA LYS 36 HA LYS 36 -3.559 6.498 5.257 289 HB2 LYS 36 HB2 LYS 36 -0.927 8.078 5.273 290 HB3 LYS 36 HB3 LYS 36 -2.478 8.752 4.811 291 HG2 LYS 36 HG2 LYS 36 -3.264 7.799 7.160 292 HG3 LYS 36 HG3 LYS 36 -1.552 7.973 7.542 293 HD2 LYS 36 HD2 LYS 36 -3.424 10.182 6.515 294 HD3 LYS 36 HD3 LYS 36 -2.978 9.891 8.183 295 HE2 LYS 36 HE2 LYS 36 -1.544 11.597 7.714 296 HE3 LYS 36 HE3 LYS 36 -0.505 10.214 7.353 297 HZ1 LYS 36 HZ1 LYS 36 -1.951 11.905 5.369 298 HZ2 LYS 36 HZ2 LYS 36 -0.369 11.884 5.629 299 HZ3 LYS 36 HZ3 LYS 36 -1.115 10.584 4.956 300 HA PRO 37 HA PRO 37 -3.186 5.764 0.928 301 HB2 PRO 37 HB2 PRO 37 -4.572 7.780 -0.310 302 HB3 PRO 37 HB3 PRO 37 -5.352 6.525 0.705 303 HG2 PRO 37 HG2 PRO 37 -4.531 9.337 1.485 304 HG3 PRO 37 HG3 PRO 37 -6.090 8.515 1.791 305 HD2 PRO 37 HD2 PRO 37 -4.139 8.657 3.651 306 HD3 PRO 37 HD3 PRO 37 -5.173 7.216 3.519 307 H LEU 38 H LEU 38 -1.313 5.865 -0.222 308 HA LEU 38 HA LEU 38 0.336 8.280 -0.365 309 HB2 LEU 38 HB2 LEU 38 0.579 5.532 -1.693 310 HB3 LEU 38 HB3 LEU 38 1.726 6.828 -1.917 311 HG LEU 38 HG LEU 38 2.804 5.544 -0.412 312 HD11 LEU 38 HD11 LEU 38 3.008 6.678 1.667 313 HD12 LEU 38 HD12 LEU 38 2.639 7.881 0.430 314 HD13 LEU 38 HD13 LEU 38 1.360 7.352 1.552 315 HD21 LEU 38 HD21 LEU 38 0.293 5.088 1.232 316 HD22 LEU 38 HD22 LEU 38 0.993 3.944 0.070 317 HD23 LEU 38 HD23 LEU 38 1.893 4.389 1.526 318 H LYS 39 H LYS 39 1.238 8.910 -2.585 319 HA LYS 39 HA LYS 39 -0.682 10.116 -4.208 320 HB2 LYS 39 HB2 LYS 39 1.552 10.886 -4.256 321 HB3 LYS 39 HB3 LYS 39 2.194 9.304 -4.588 322 HG2 LYS 39 HG2 LYS 39 2.455 10.904 -6.402 323 HG3 LYS 39 HG3 LYS 39 1.704 9.393 -6.882 324 HD2 LYS 39 HD2 LYS 39 -0.262 10.439 -7.513 325 HD3 LYS 39 HD3 LYS 39 -0.103 11.733 -6.347 326 HE2 LYS 39 HE2 LYS 39 1.618 12.833 -7.658 327 HE3 LYS 39 HE3 LYS 39 1.750 11.449 -8.748 328 HZ1 LYS 39 HZ1 LYS 39 -0.264 11.946 -9.717 329 HZ2 LYS 39 HZ2 LYS 39 -0.780 12.943 -8.503 330 HZ3 LYS 39 HZ3 LYS 39 0.404 13.435 -9.497 331 H ILE 40 H ILE 40 -1.877 9.465 -6.031 332 HA ILE 40 HA ILE 40 -2.291 6.671 -6.396 333 HB ILE 40 HB ILE 40 -4.019 8.325 -6.602 334 HG12 ILE 40 HG12 ILE 40 -4.122 6.173 -7.916 335 HG13 ILE 40 HG13 ILE 40 -5.225 7.464 -8.346 336 HG21 ILE 40 HG21 ILE 40 -4.148 9.886 -8.546 337 HG22 ILE 40 HG22 ILE 40 -2.886 10.286 -7.385 338 HG23 ILE 40 HG23 ILE 40 -2.472 9.478 -8.906 339 HD11 ILE 40 HD11 ILE 40 -4.406 6.470 -10.365 340 HD12 ILE 40 HD12 ILE 40 -3.741 8.102 -10.241 341 HD13 ILE 40 HD13 ILE 40 -2.718 6.708 -9.872 342 H GLY 41 H GLY 41 -1.347 5.320 -7.822 343 HA2 GLY 41 HA2 GLY 41 0.045 4.537 -9.518 344 HA3 GLY 41 HA3 GLY 41 0.175 6.184 -10.132 345 H ILE 42 H ILE 42 1.064 5.905 -6.779 346 HA ILE 42 HA ILE 42 3.652 6.815 -7.141 347 HB ILE 42 HB ILE 42 2.405 7.040 -5.111 348 HG12 ILE 42 HG12 ILE 42 5.094 5.765 -4.626 349 HG13 ILE 42 HG13 ILE 42 4.792 7.401 -5.215 350 HG21 ILE 42 HG21 ILE 42 2.961 4.087 -4.607 351 HG22 ILE 42 HG22 ILE 42 2.261 5.209 -3.443 352 HG23 ILE 42 HG23 ILE 42 1.369 4.823 -4.909 353 HD11 ILE 42 HD11 ILE 42 5.272 7.484 -2.874 354 HD12 ILE 42 HD12 ILE 42 3.558 7.884 -3.088 355 HD13 ILE 42 HD13 ILE 42 4.046 6.275 -2.496 356 H PHE 43 H PHE 43 2.576 3.454 -7.489 357 HA PHE 43 HA PHE 43 5.170 2.257 -6.984 358 HB2 PHE 43 HB2 PHE 43 3.498 0.678 -6.818 359 HB3 PHE 43 HB3 PHE 43 2.553 1.367 -8.134 360 HD1 PHE 43 HD1 PHE 43 2.915 0.813 -10.414 361 HD2 PHE 43 HD2 PHE 43 5.503 -0.857 -7.396 362 HE1 PHE 43 HE1 PHE 43 3.857 -0.750 -12.093 363 HE2 PHE 43 HE2 PHE 43 6.488 -2.363 -9.090 364 HZ PHE 43 HZ PHE 43 5.654 -2.352 -11.420 365 H ASP 44 H ASP 44 3.525 3.667 -9.851 366 HA ASP 44 HA ASP 44 5.466 2.637 -11.713 367 HB2 ASP 44 HB2 ASP 44 3.319 4.760 -11.842 368 HB3 ASP 44 HB3 ASP 44 4.516 4.634 -13.122 369 H ASP 45 H ASP 45 5.464 5.470 -9.599 370 HA ASP 45 HA ASP 45 7.732 6.658 -11.044 371 HB2 ASP 45 HB2 ASP 45 5.985 7.458 -8.789 372 HB3 ASP 45 HB3 ASP 45 7.669 7.879 -8.550 373 H LEU 46 H LEU 46 7.146 4.690 -8.234 374 HA LEU 46 HA LEU 46 9.758 4.727 -7.064 375 HB2 LEU 46 HB2 LEU 46 7.854 4.193 -5.718 376 HB3 LEU 46 HB3 LEU 46 7.303 2.967 -6.866 377 HG LEU 46 HG LEU 46 9.363 1.568 -6.278 378 HD11 LEU 46 HD11 LEU 46 9.438 3.431 -3.879 379 HD12 LEU 46 HD12 LEU 46 10.499 2.038 -4.200 380 HD13 LEU 46 HD13 LEU 46 10.633 3.472 -5.213 381 HD21 LEU 46 HD21 LEU 46 7.487 2.046 -3.984 382 HD22 LEU 46 HD22 LEU 46 7.090 1.111 -5.462 383 HD23 LEU 46 HD23 LEU 46 8.414 0.607 -4.399 384 H ILE 47 H ILE 47 8.124 2.453 -9.318 385 HA ILE 47 HA ILE 47 10.022 0.409 -9.147 386 HB ILE 47 HB ILE 47 7.733 0.458 -10.261 387 HG12 ILE 47 HG12 ILE 47 9.557 -1.419 -10.257 388 HG13 ILE 47 HG13 ILE 47 8.065 -1.534 -11.172 389 HG21 ILE 47 HG21 ILE 47 9.333 1.427 -12.686 390 HG22 ILE 47 HG22 ILE 47 7.639 0.850 -12.700 391 HG23 ILE 47 HG23 ILE 47 8.089 2.295 -11.805 392 HD11 ILE 47 HD11 ILE 47 10.615 -0.564 -12.481 393 HD12 ILE 47 HD12 ILE 47 10.167 -2.265 -12.390 394 HD13 ILE 47 HD13 ILE 47 9.102 -1.118 -13.224 395 H ASP 48 H ASP 48 10.201 3.485 -10.881 396 HA ASP 48 HA ASP 48 12.226 2.949 -12.737 397 HB2 ASP 48 HB2 ASP 48 11.010 5.068 -12.614 398 HB3 ASP 48 HB3 ASP 48 11.659 5.404 -11.015 399 H PHE 49 H PHE 49 12.347 3.949 -9.416 400 HA PHE 49 HA PHE 49 15.142 4.078 -8.971 401 HB2 PHE 49 HB2 PHE 49 12.764 4.621 -7.534 402 HB3 PHE 49 HB3 PHE 49 13.629 3.453 -6.566 403 HD1 PHE 49 HD1 PHE 49 14.567 4.640 -4.793 404 HD2 PHE 49 HD2 PHE 49 14.641 6.443 -8.689 405 HE1 PHE 49 HE1 PHE 49 15.998 6.435 -3.904 406 HE2 PHE 49 HE2 PHE 49 15.979 8.319 -7.773 407 HZ PHE 49 HZ PHE 49 16.697 8.309 -5.394 408 H TYR 50 H TYR 50 12.895 1.332 -8.914 409 HA TYR 50 HA TYR 50 14.625 -0.525 -7.500 410 HB2 TYR 50 HB2 TYR 50 12.552 -1.388 -7.338 411 HB3 TYR 50 HB3 TYR 50 11.964 -0.625 -8.790 412 HD1 TYR 50 HD1 TYR 50 13.423 -3.692 -7.401 413 HD2 TYR 50 HD2 TYR 50 12.397 -1.631 -11.039 414 HE1 TYR 50 HE1 TYR 50 13.786 -5.790 -8.702 415 HE2 TYR 50 HE2 TYR 50 12.902 -3.656 -12.348 416 HH TYR 50 HH TYR 50 14.299 -5.820 -12.028 417 H GLU 51 H GLU 51 14.133 0.530 -10.873 418 HA GLU 51 HA GLU 51 15.636 -1.641 -12.064 419 HB2 GLU 51 HB2 GLU 51 14.870 1.090 -13.202 420 HB3 GLU 51 HB3 GLU 51 15.648 -0.207 -14.109 421 HG2 GLU 51 HG2 GLU 51 13.650 -1.677 -13.248 422 HG3 GLU 51 HG3 GLU 51 12.881 -0.141 -12.888 423 H ARG 52 H ARG 52 16.577 1.087 -10.242 424 HA ARG 52 HA ARG 52 19.210 1.398 -11.444 425 HB2 ARG 52 HB2 ARG 52 17.869 3.175 -10.165 426 HB3 ARG 52 HB3 ARG 52 18.205 2.262 -8.694 427 HG2 ARG 52 HG2 ARG 52 19.764 4.033 -8.763 428 HG3 ARG 52 HG3 ARG 52 20.649 2.557 -9.081 429 HD2 ARG 52 HD2 ARG 52 20.450 3.095 -11.584 430 HD3 ARG 52 HD3 ARG 52 19.806 4.669 -11.101 431 HE ARG 52 HE ARG 52 22.525 3.668 -10.976 432 HH11 ARG 52 HH11 ARG 52 20.316 6.061 -9.571 433 HH12 ARG 52 HH12 ARG 52 21.553 7.011 -8.837 434 HH21 ARG 52 HH21 ARG 52 24.173 4.908 -10.096 435 HH22 ARG 52 HH22 ARG 52 23.860 6.442 -9.299 436 H LEU 53 H LEU 53 17.792 -0.703 -8.908 437 HA LEU 53 HA LEU 53 20.132 -1.333 -7.488 438 HB2 LEU 53 HB2 LEU 53 17.831 -3.206 -8.092 439 HB3 LEU 53 HB3 LEU 53 18.873 -3.200 -6.673 440 HG LEU 53 HG LEU 53 16.806 -1.059 -7.378 441 HD11 LEU 53 HD11 LEU 53 15.768 -3.138 -6.795 442 HD12 LEU 53 HD12 LEU 53 16.752 -3.281 -5.319 443 HD13 LEU 53 HD13 LEU 53 15.556 -1.964 -5.501 444 HD21 LEU 53 HD21 LEU 53 18.704 -1.173 -5.052 445 HD22 LEU 53 HD22 LEU 53 18.489 0.092 -6.275 446 HD23 LEU 53 HD23 LEU 53 17.203 -0.189 -5.110 447 H ASP 54 H ASP 54 21.899 -2.506 -8.140 448 HA ASP 54 HA ASP 54 21.960 -3.584 -10.827 449 HB2 ASP 54 HB2 ASP 54 23.845 -2.408 -9.585 450 HB3 ASP 54 HB3 ASP 54 24.102 -3.925 -8.711 451 H THR 55 H THR 55 20.996 -4.939 -7.844 452 HA THR 55 HA THR 55 21.020 -7.679 -8.993 453 HB THR 55 HB THR 55 21.518 -8.420 -6.578 454 HG1 THR 55 HG1 THR 55 22.856 -6.797 -5.490 455 HG21 THR 55 HG21 THR 55 23.730 -6.993 -8.123 456 HG22 THR 55 HG22 THR 55 23.942 -8.278 -6.915 457 HG23 THR 55 HG23 THR 55 23.133 -8.629 -8.449 458 HA PRO 56 HA PRO 56 16.857 -6.201 -7.619 459 HB2 PRO 56 HB2 PRO 56 15.539 -7.177 -9.847 460 HB3 PRO 56 HB3 PRO 56 16.190 -5.510 -9.679 461 HG2 PRO 56 HG2 PRO 56 17.383 -7.898 -11.086 462 HG3 PRO 56 HG3 PRO 56 17.343 -6.185 -11.622 463 HD2 PRO 56 HD2 PRO 56 19.539 -7.273 -10.475 464 HD3 PRO 56 HD3 PRO 56 19.061 -5.585 -10.156 465 HA PRO 57 HA PRO 57 16.587 -10.605 -6.450 466 HB2 PRO 57 HB2 PRO 57 15.178 -10.386 -4.108 467 HB3 PRO 57 HB3 PRO 57 16.924 -10.067 -4.250 468 HG2 PRO 57 HG2 PRO 57 14.696 -8.081 -4.029 469 HG3 PRO 57 HG3 PRO 57 16.384 -7.983 -3.466 470 HD2 PRO 57 HD2 PRO 57 15.281 -6.850 -5.849 471 HD3 PRO 57 HD3 PRO 57 17.007 -6.970 -5.425 472 H PHE 58 H PHE 58 13.632 -8.839 -5.490 473 HA PHE 58 HA PHE 58 11.913 -10.842 -6.740 474 HB2 PHE 58 HB2 PHE 58 11.287 -8.295 -5.208 475 HB3 PHE 58 HB3 PHE 58 10.146 -9.578 -5.581 476 HD1 PHE 58 HD1 PHE 58 10.548 -11.916 -4.562 477 HD2 PHE 58 HD2 PHE 58 12.653 -8.405 -3.219 478 HE1 PHE 58 HE1 PHE 58 11.239 -13.114 -2.502 479 HE2 PHE 58 HE2 PHE 58 13.380 -9.618 -1.197 480 HZ PHE 58 HZ PHE 58 12.682 -11.979 -0.829 481 H SER 59 H SER 59 10.457 -10.412 -8.424 482 HA SER 59 HA SER 59 11.256 -8.385 -10.376 483 HB2 SER 59 HB2 SER 59 9.130 -9.407 -11.519 484 HB3 SER 59 HB3 SER 59 10.625 -10.335 -11.408 485 HG SER 59 HG SER 59 9.831 -11.605 -9.926 486 H LYS 60 H LYS 60 10.105 -6.732 -11.145 487 HA LYS 60 HA LYS 60 8.809 -4.991 -9.395 488 HB2 LYS 60 HB2 LYS 60 8.202 -3.733 -11.415 489 HB3 LYS 60 HB3 LYS 60 9.877 -4.305 -11.424 490 HG2 LYS 60 HG2 LYS 60 8.913 -6.313 -12.839 491 HG3 LYS 60 HG3 LYS 60 7.500 -5.283 -13.036 492 HD2 LYS 60 HD2 LYS 60 8.916 -5.098 -14.941 493 HD3 LYS 60 HD3 LYS 60 8.978 -3.552 -14.065 494 HE2 LYS 60 HE2 LYS 60 11.177 -4.274 -13.100 495 HE3 LYS 60 HE3 LYS 60 11.066 -5.774 -14.044 496 HZ1 LYS 60 HZ1 LYS 60 10.995 -4.365 -16.047 497 HZ2 LYS 60 HZ2 LYS 60 11.375 -3.035 -15.137 498 HZ3 LYS 60 HZ3 LYS 60 12.406 -4.271 -15.228 499 H LYS 61 H LYS 61 7.321 -7.588 -11.303 500 HA LYS 61 HA LYS 61 4.637 -6.673 -10.981 501 HB2 LYS 61 HB2 LYS 61 5.898 -8.871 -12.249 502 HB3 LYS 61 HB3 LYS 61 4.933 -9.608 -10.990 503 HG2 LYS 61 HG2 LYS 61 3.520 -9.543 -12.855 504 HG3 LYS 61 HG3 LYS 61 2.952 -8.237 -11.807 505 HD2 LYS 61 HD2 LYS 61 4.262 -6.592 -13.233 506 HD3 LYS 61 HD3 LYS 61 4.790 -7.949 -14.230 507 HE2 LYS 61 HE2 LYS 61 2.999 -7.060 -15.435 508 HE3 LYS 61 HE3 LYS 61 2.329 -8.488 -14.624 509 HZ1 LYS 61 HZ1 LYS 61 1.935 -5.651 -13.940 510 HZ2 LYS 61 HZ2 LYS 61 0.797 -6.770 -14.278 511 HZ3 LYS 61 HZ3 LYS 61 1.585 -6.832 -12.852 512 H SER 62 H SER 62 6.734 -8.798 -8.881 513 HA SER 62 HA SER 62 4.708 -9.251 -6.901 514 HB2 SER 62 HB2 SER 62 7.757 -9.257 -6.787 515 HB3 SER 62 HB3 SER 62 6.726 -9.624 -5.396 516 HG SER 62 HG SER 62 5.911 -11.350 -6.359 517 H LEU 63 H LEU 63 7.174 -6.674 -7.404 518 HA LEU 63 HA LEU 63 6.868 -5.327 -4.965 519 HB2 LEU 63 HB2 LEU 63 8.483 -4.956 -6.956 520 HB3 LEU 63 HB3 LEU 63 7.273 -3.851 -7.590 521 HG LEU 63 HG LEU 63 8.476 -3.644 -4.813 522 HD11 LEU 63 HD11 LEU 63 9.959 -1.877 -5.682 523 HD12 LEU 63 HD12 LEU 63 10.280 -3.406 -6.482 524 HD13 LEU 63 HD13 LEU 63 9.364 -2.139 -7.340 525 HD21 LEU 63 HD21 LEU 63 7.266 -1.394 -6.402 526 HD22 LEU 63 HD22 LEU 63 6.329 -2.357 -5.211 527 HD23 LEU 63 HD23 LEU 63 7.735 -1.453 -4.700 528 H ARG 64 H ARG 64 5.057 -4.759 -8.054 529 HA ARG 64 HA ARG 64 3.240 -2.983 -6.817 530 HB2 ARG 64 HB2 ARG 64 3.572 -3.137 -9.288 531 HB3 ARG 64 HB3 ARG 64 2.826 -4.719 -9.305 532 HG2 ARG 64 HG2 ARG 64 1.344 -2.891 -10.097 533 HG3 ARG 64 HG3 ARG 64 0.673 -3.785 -8.727 534 HD2 ARG 64 HD2 ARG 64 0.668 -2.023 -7.345 535 HD3 ARG 64 HD3 ARG 64 2.214 -1.403 -7.922 536 HE ARG 64 HE ARG 64 0.812 -0.703 -10.022 537 HH11 ARG 64 HH11 ARG 64 -0.152 -0.380 -6.627 538 HH12 ARG 64 HH12 ARG 64 -1.040 1.096 -6.874 539 HH21 ARG 64 HH21 ARG 64 -0.344 1.149 -10.373 540 HH22 ARG 64 HH22 ARG 64 -1.211 1.959 -9.081 541 H GLU 65 H GLU 65 2.791 -6.481 -7.538 542 HA GLU 65 HA GLU 65 0.168 -6.768 -6.646 543 HB2 GLU 65 HB2 GLU 65 1.654 -8.406 -7.897 544 HB3 GLU 65 HB3 GLU 65 2.460 -8.764 -6.378 545 HG2 GLU 65 HG2 GLU 65 0.859 -10.489 -6.849 546 HG3 GLU 65 HG3 GLU 65 0.304 -9.589 -5.441 547 H ALA 66 H ALA 66 3.164 -6.662 -4.749 548 HA ALA 66 HA ALA 66 1.937 -7.472 -2.245 549 HB1 ALA 66 HB1 ALA 66 4.319 -7.867 -2.735 550 HB2 ALA 66 HB2 ALA 66 4.568 -6.111 -2.909 551 HB3 ALA 66 HB3 ALA 66 4.100 -6.796 -1.340 552 H LEU 67 H LEU 67 2.862 -4.357 -3.814 553 HA LEU 67 HA LEU 67 2.233 -2.749 -1.547 554 HB2 LEU 67 HB2 LEU 67 3.236 -2.283 -4.140 555 HB3 LEU 67 HB3 LEU 67 1.746 -1.353 -4.083 556 HG LEU 67 HG LEU 67 4.013 -1.215 -2.029 557 HD11 LEU 67 HD11 LEU 67 4.691 -0.347 -4.227 558 HD12 LEU 67 HD12 LEU 67 3.264 0.715 -4.280 559 HD13 LEU 67 HD13 LEU 67 4.535 0.963 -3.060 560 HD21 LEU 67 HD21 LEU 67 1.453 0.412 -2.301 561 HD22 LEU 67 HD22 LEU 67 1.987 -0.547 -0.914 562 HD23 LEU 67 HD23 LEU 67 2.858 0.925 -1.326 563 H SER 68 H SER 68 0.183 -4.057 -4.234 564 HA SER 68 HA SER 68 -2.128 -2.527 -3.486 565 HB2 SER 68 HB2 SER 68 -3.290 -4.450 -4.782 566 HB3 SER 68 HB3 SER 68 -2.270 -3.283 -5.634 567 HG SER 68 HG SER 68 -1.928 -5.980 -5.335 568 H TYR 69 H TYR 69 -0.650 -5.529 -2.344 569 HA TYR 69 HA TYR 69 -2.832 -6.580 -0.849 570 HB2 TYR 69 HB2 TYR 69 -0.242 -7.372 -1.462 571 HB3 TYR 69 HB3 TYR 69 -0.096 -6.995 0.252 572 HD1 TYR 69 HD1 TYR 69 -1.429 -8.277 1.904 573 HD2 TYR 69 HD2 TYR 69 -1.644 -9.127 -2.299 574 HE1 TYR 69 HE1 TYR 69 -2.502 -10.447 2.430 575 HE2 TYR 69 HE2 TYR 69 -2.732 -11.333 -1.791 576 HH TYR 69 HH TYR 69 -3.655 -12.265 1.510 577 H TYR 70 H TYR 70 -0.203 -4.269 -0.077 578 HA TYR 70 HA TYR 70 -0.917 -3.930 2.711 579 HB2 TYR 70 HB2 TYR 70 1.067 -2.862 0.856 580 HB3 TYR 70 HB3 TYR 70 0.266 -1.525 1.644 581 HD1 TYR 70 HD1 TYR 70 1.017 -4.916 3.167 582 HD2 TYR 70 HD2 TYR 70 1.997 -0.699 3.011 583 HE1 TYR 70 HE1 TYR 70 2.598 -5.191 5.035 584 HE2 TYR 70 HE2 TYR 70 3.683 -1.034 4.778 585 HH TYR 70 HH TYR 70 4.938 -4.051 5.555 586 H SER 71 H SER 71 -1.721 -2.376 -0.278 587 HA SER 71 HA SER 71 -3.494 -0.339 0.769 588 HB2 SER 71 HB2 SER 71 -3.472 -1.405 -2.054 589 HB3 SER 71 HB3 SER 71 -4.023 0.167 -1.448 590 HG SER 71 HG SER 71 -1.321 -0.767 -1.493 591 H ALA 72 H ALA 72 -3.916 -3.562 0.914 592 HA ALA 72 HA ALA 72 -6.841 -3.506 0.495 593 HB1 ALA 72 HB1 ALA 72 -5.012 -5.918 0.079 594 HB2 ALA 72 HB2 ALA 72 -6.760 -5.828 -0.198 595 HB3 ALA 72 HB3 ALA 72 -5.671 -4.927 -1.241 596 H SER 73 H SER 73 -4.550 -3.226 2.768 597 HA SER 73 HA SER 73 -5.251 -5.382 4.621 598 HB2 SER 73 HB2 SER 73 -3.860 -4.286 6.212 599 HB3 SER 73 HB3 SER 73 -3.085 -4.068 4.648 600 HG SER 73 HG SER 73 -3.001 -2.108 5.444 601 HA PRO 74 HA PRO 74 -9.055 -3.733 6.173 602 HB2 PRO 74 HB2 PRO 74 -8.937 -4.077 8.920 603 HB3 PRO 74 HB3 PRO 74 -9.298 -5.395 7.751 604 HG2 PRO 74 HG2 PRO 74 -6.713 -4.645 9.094 605 HG3 PRO 74 HG3 PRO 74 -7.393 -6.287 8.840 606 HD2 PRO 74 HD2 PRO 74 -5.437 -5.297 7.235 607 HD3 PRO 74 HD3 PRO 74 -6.760 -6.292 6.555 608 H ALA 75 H ALA 75 -6.300 -2.758 8.269 609 HA ALA 75 HA ALA 75 -7.402 -0.491 9.406 610 HB1 ALA 75 HB1 ALA 75 -5.369 -1.657 10.110 611 HB2 ALA 75 HB2 ALA 75 -4.508 -1.045 8.679 612 HB3 ALA 75 HB3 ALA 75 -5.104 0.090 9.923 613 H TYR 76 H TYR 76 -5.571 -0.707 6.288 614 HA TYR 76 HA TYR 76 -5.540 2.106 5.781 615 HB2 TYR 76 HB2 TYR 76 -4.148 0.492 4.462 616 HB3 TYR 76 HB3 TYR 76 -5.561 -0.357 3.998 617 HD1 TYR 76 HD1 TYR 76 -3.222 2.200 3.121 618 HD2 TYR 76 HD2 TYR 76 -7.246 0.834 2.399 619 HE1 TYR 76 HE1 TYR 76 -3.241 3.421 0.991 620 HE2 TYR 76 HE2 TYR 76 -7.288 2.028 0.257 621 HH TYR 76 HH TYR 76 -6.014 3.136 -1.279 622 H LEU 77 H LEU 77 -8.037 -0.356 5.116 623 HA LEU 77 HA LEU 77 -9.662 1.453 3.565 624 HB2 LEU 77 HB2 LEU 77 -10.586 -1.043 5.023 625 HB3 LEU 77 HB3 LEU 77 -11.386 -0.204 3.687 626 HG LEU 77 HG LEU 77 -8.656 -1.362 3.473 627 HD11 LEU 77 HD11 LEU 77 -10.133 -3.162 4.116 628 HD12 LEU 77 HD12 LEU 77 -11.080 -2.832 2.656 629 HD13 LEU 77 HD13 LEU 77 -9.408 -3.378 2.512 630 HD21 LEU 77 HD21 LEU 77 -10.649 -0.590 1.348 631 HD22 LEU 77 HD22 LEU 77 -9.194 0.286 1.746 632 HD23 LEU 77 HD23 LEU 77 -9.071 -1.352 1.034 633 H SER 78 H SER 78 -9.783 0.239 6.870 634 HA SER 78 HA SER 78 -11.926 1.671 7.910 635 HB2 SER 78 HB2 SER 78 -10.675 -0.267 8.817 636 HB3 SER 78 HB3 SER 78 -9.297 0.785 9.185 637 HG SER 78 HG SER 78 -10.490 1.857 10.715 638 H CYS 79 H CYS 79 -8.672 2.777 7.176 639 HA CYS 79 HA CYS 79 -8.797 5.323 8.582 640 HB2 CYS 79 HB2 CYS 79 -6.734 3.782 7.942 641 HB3 CYS 79 HB3 CYS 79 -6.839 4.605 6.374 642 HG CYS 79 HG CYS 79 -4.926 5.685 7.743 643 H GLN 80 H GLN 80 -10.597 4.425 6.045 644 HA GLN 80 HA GLN 80 -10.514 6.088 3.908 645 HB2 GLN 80 HB2 GLN 80 -13.043 6.006 3.994 646 HB3 GLN 80 HB3 GLN 80 -12.216 4.469 4.045 647 HG2 GLN 80 HG2 GLN 80 -12.625 4.301 6.492 648 HG3 GLN 80 HG3 GLN 80 -13.413 5.872 6.481 649 HE21 GLN 80 HE21 GLN 80 -15.433 6.053 5.049 650 HE22 GLN 80 HE22 GLN 80 -16.435 4.620 4.906 651 H LYS 81 H LYS 81 -9.412 8.047 4.659 652 HA LYS 81 HA LYS 81 -11.305 10.155 5.667 653 HB2 LYS 81 HB2 LYS 81 -8.374 9.729 6.199 654 HB3 LYS 81 HB3 LYS 81 -9.239 11.206 6.626 655 HG2 LYS 81 HG2 LYS 81 -10.359 8.556 7.552 656 HG3 LYS 81 HG3 LYS 81 -8.901 9.141 8.339 657 HD2 LYS 81 HD2 LYS 81 -9.971 10.824 9.414 658 HD3 LYS 81 HD3 LYS 81 -11.125 11.101 8.078 659 HE2 LYS 81 HE2 LYS 81 -12.141 8.835 8.703 660 HE3 LYS 81 HE3 LYS 81 -11.218 8.918 10.206 661 HZ1 LYS 81 HZ1 LYS 81 -12.452 10.940 10.751 662 HZ2 LYS 81 HZ2 LYS 81 -13.153 10.962 9.277 663 HZ3 LYS 81 HZ3 LYS 81 -13.513 9.753 10.323 664 HA PRO 82 HA PRO 82 -10.093 11.564 1.478 665 HB2 PRO 82 HB2 PRO 82 -12.281 13.102 0.949 666 HB3 PRO 82 HB3 PRO 82 -12.362 11.328 0.911 667 HG2 PRO 82 HG2 PRO 82 -13.132 13.183 3.178 668 HG3 PRO 82 HG3 PRO 82 -14.089 11.843 2.479 669 HD2 PRO 82 HD2 PRO 82 -12.541 11.586 4.746 670 HD3 PRO 82 HD3 PRO 82 -12.786 10.222 3.616 671 H ASP 83 H ASP 83 -10.247 14.011 0.637 672 HA ASP 83 HA ASP 83 -9.160 16.049 0.814 673 HB2 ASP 83 HB2 ASP 83 -11.043 16.217 3.178 674 HB3 ASP 83 HB3 ASP 83 -10.209 17.582 2.443 675 H THR 84 H THR 84 -7.578 14.039 1.726 676 HA THR 84 HA THR 84 -6.298 15.014 4.190 677 HB THR 84 HB THR 84 -7.160 12.713 4.068 678 HG1 THR 84 HG1 THR 84 -5.403 11.744 4.964 679 HG21 THR 84 HG21 THR 84 -4.932 12.206 2.040 680 HG22 THR 84 HG22 THR 84 -5.993 10.991 2.775 681 HG23 THR 84 HG23 THR 84 -6.683 12.191 1.686 682 H ALA 85 H ALA 85 -5.598 15.097 0.814 683 HA ALA 85 HA ALA 85 -3.776 15.730 -0.376 684 HB1 ALA 85 HB1 ALA 85 -2.466 17.550 0.419 685 HB2 ALA 85 HB2 ALA 85 -4.137 17.763 1.033 686 HB3 ALA 85 HB3 ALA 85 -2.849 17.185 2.111 687 H ARG 86 H ARG 86 -2.985 13.773 -0.700 688 HA ARG 86 HA ARG 86 -1.072 12.464 1.110 689 HB2 ARG 86 HB2 ARG 86 -1.020 10.722 -0.639 690 HB3 ARG 86 HB3 ARG 86 -2.673 11.145 -0.154 691 HG2 ARG 86 HG2 ARG 86 -2.096 12.868 -2.281 692 HG3 ARG 86 HG3 ARG 86 -1.362 11.363 -2.764 693 HD2 ARG 86 HD2 ARG 86 -4.256 11.609 -1.842 694 HD3 ARG 86 HD3 ARG 86 -3.733 11.935 -3.496 695 HE ARG 86 HE ARG 86 -2.996 9.291 -2.408 696 HH11 ARG 86 HH11 ARG 86 -5.141 11.200 -4.568 697 HH12 ARG 86 HH12 ARG 86 -5.775 9.788 -5.351 698 HH21 ARG 86 HH21 ARG 86 -3.987 7.463 -3.405 699 HH22 ARG 86 HH22 ARG 86 -5.156 7.723 -4.689 700 H VAL 87 H VAL 87 1.005 11.542 -0.188 701 HA VAL 87 HA VAL 87 2.302 13.668 -1.714 702 HB VAL 87 HB VAL 87 4.390 13.354 -0.278 703 HG11 VAL 87 HG11 VAL 87 3.279 15.462 -0.077 704 HG12 VAL 87 HG12 VAL 87 2.015 14.794 0.960 705 HG13 VAL 87 HG13 VAL 87 3.684 14.930 1.542 706 HG21 VAL 87 HG21 VAL 87 2.447 12.414 1.849 707 HG22 VAL 87 HG22 VAL 87 3.564 11.329 0.961 708 HG23 VAL 87 HG23 VAL 87 4.191 12.634 1.996 709 H ASP 88 H ASP 88 4.369 12.876 -2.628 710 HA ASP 88 HA ASP 88 4.126 10.091 -3.554 711 HB2 ASP 88 HB2 ASP 88 5.071 10.751 -5.583 712 HB3 ASP 88 HB3 ASP 88 3.912 12.015 -5.175 713 H ILE 89 H ILE 89 6.701 9.782 -4.613 714 HA ILE 89 HA ILE 89 8.189 8.931 -2.272 715 HB ILE 89 HB ILE 89 9.867 8.173 -4.089 716 HG12 ILE 89 HG12 ILE 89 7.726 8.993 -6.111 717 HG13 ILE 89 HG13 ILE 89 9.065 10.050 -5.694 718 HG21 ILE 89 HG21 ILE 89 6.997 7.335 -4.613 719 HG22 ILE 89 HG22 ILE 89 8.454 6.381 -4.914 720 HG23 ILE 89 HG23 ILE 89 7.970 6.758 -3.241 721 HD11 ILE 89 HD11 ILE 89 9.541 8.816 -7.708 722 HD12 ILE 89 HD12 ILE 89 10.696 8.455 -6.435 723 HD13 ILE 89 HD13 ILE 89 9.416 7.266 -6.828 724 H TYR 90 H TYR 90 8.117 11.860 -4.100 725 HA TYR 90 HA TYR 90 10.870 12.683 -3.365 726 HB2 TYR 90 HB2 TYR 90 8.749 13.840 -5.197 727 HB3 TYR 90 HB3 TYR 90 10.274 14.616 -4.857 728 HD1 TYR 90 HD1 TYR 90 12.409 13.703 -5.731 729 HD2 TYR 90 HD2 TYR 90 8.585 12.028 -6.849 730 HE1 TYR 90 HE1 TYR 90 13.456 12.611 -7.681 731 HE2 TYR 90 HE2 TYR 90 9.616 10.981 -8.820 732 HH TYR 90 HH TYR 90 13.130 11.062 -9.439 733 H GLY 91 H GLY 91 7.716 12.715 -2.149 734 HA2 GLY 91 HA2 GLY 91 7.024 13.708 -0.136 735 HA3 GLY 91 HA3 GLY 91 8.445 14.763 -0.162 736 H ASN 92 H ASN 92 6.781 14.771 -3.197 737 HA ASN 92 HA ASN 92 6.066 17.557 -2.989 738 HB2 ASN 92 HB2 ASN 92 5.106 15.388 -4.920 739 HB3 ASN 92 HB3 ASN 92 4.780 17.105 -5.079 740 HD21 ASN 92 HD21 ASN 92 6.789 14.723 -6.186 741 HD22 ASN 92 HD22 ASN 92 8.132 15.741 -6.682 742 H GLU 93 H GLU 93 4.055 18.504 -2.534 743 HA GLU 93 HA GLU 93 2.022 16.782 -1.283 744 HB2 GLU 93 HB2 GLU 93 2.807 19.565 -1.059 745 HB3 GLU 93 HB3 GLU 93 1.090 19.470 -1.502 746 HG2 GLU 93 HG2 GLU 93 0.599 18.014 0.361 747 HG3 GLU 93 HG3 GLU 93 2.314 17.729 0.671 748 H VAL 94 H VAL 94 0.529 15.863 -2.350 749 HA VAL 94 HA VAL 94 -0.202 16.796 -5.029 750 HB VAL 94 HB VAL 94 -0.367 14.698 -5.899 751 HG11 VAL 94 HG11 VAL 94 1.864 13.776 -5.794 752 HG12 VAL 94 HG12 VAL 94 1.983 15.546 -5.680 753 HG13 VAL 94 HG13 VAL 94 2.161 14.541 -4.230 754 HG21 VAL 94 HG21 VAL 94 -1.381 13.362 -4.283 755 HG22 VAL 94 HG22 VAL 94 0.223 12.625 -4.506 756 HG23 VAL 94 HG23 VAL 94 -0.057 13.634 -3.117 757 H ASP 95 H ASP 95 -2.457 15.537 -5.602 758 HA ASP 95 HA ASP 95 -4.316 17.140 -4.152 759 HB2 ASP 95 HB2 ASP 95 -5.095 14.816 -5.936 760 HB3 ASP 95 HB3 ASP 95 -5.825 16.414 -5.848 761 H VAL 96 H VAL 96 -6.584 15.954 -3.720 762 HA VAL 96 HA VAL 96 -5.913 13.951 -1.604 763 HB VAL 96 HB VAL 96 -7.567 14.872 -0.306 764 HG11 VAL 96 HG11 VAL 96 -7.086 17.173 -0.017 765 HG12 VAL 96 HG12 VAL 96 -5.628 16.548 -0.807 766 HG13 VAL 96 HG13 VAL 96 -6.809 17.436 -1.741 767 HG21 VAL 96 HG21 VAL 96 -8.719 16.065 -2.832 768 HG22 VAL 96 HG22 VAL 96 -9.504 14.973 -1.675 769 HG23 VAL 96 HG23 VAL 96 -9.196 16.664 -1.239 770 H VAL 97 H VAL 97 -7.473 12.449 -0.977 771 HA VAL 97 HA VAL 97 -8.552 10.946 -3.236 772 HB VAL 97 HB VAL 97 -8.814 10.421 -0.261 773 HG11 VAL 97 HG11 VAL 97 -9.026 8.551 -2.682 774 HG12 VAL 97 HG12 VAL 97 -9.194 8.076 -0.973 775 HG13 VAL 97 HG13 VAL 97 -10.393 9.140 -1.714 776 HG21 VAL 97 HG21 VAL 97 -6.919 8.823 -0.562 777 HG22 VAL 97 HG22 VAL 97 -6.682 9.434 -2.209 778 HG23 VAL 97 HG23 VAL 97 -6.408 10.492 -0.803 779 H THR 98 H THR 98 -10.643 11.152 -3.930 780 HA THR 98 HA THR 98 -12.267 13.275 -3.009 781 HB THR 98 HB THR 98 -13.947 11.953 -4.607 782 HG1 THR 98 HG1 THR 98 -11.498 10.988 -5.603 783 HG21 THR 98 HG21 THR 98 -12.800 14.093 -5.144 784 HG22 THR 98 HG22 THR 98 -11.355 13.208 -5.640 785 HG23 THR 98 HG23 THR 98 -12.877 13.016 -6.541 786 HA PRO 99 HA PRO 99 -14.557 11.759 0.308 787 HB2 PRO 99 HB2 PRO 99 -17.214 12.303 -0.321 788 HB3 PRO 99 HB3 PRO 99 -16.020 13.461 0.329 789 HG2 PRO 99 HG2 PRO 99 -16.821 13.037 -2.548 790 HG3 PRO 99 HG3 PRO 99 -16.558 14.581 -1.667 791 HD2 PRO 99 HD2 PRO 99 -14.647 13.594 -3.254 792 HD3 PRO 99 HD3 PRO 99 -14.214 14.298 -1.664 793 H GLU 100 H GLU 100 -16.299 10.717 -2.697 794 HA GLU 100 HA GLU 100 -17.337 8.423 -1.271 795 HB2 GLU 100 HB2 GLU 100 -17.503 9.361 -4.105 796 HB3 GLU 100 HB3 GLU 100 -17.878 7.672 -3.718 797 HG2 GLU 100 HG2 GLU 100 -19.518 8.338 -2.025 798 HG3 GLU 100 HG3 GLU 100 -19.155 10.044 -2.306 799 H GLN 101 H GLN 101 -14.570 8.911 -3.578 800 HA GLN 101 HA GLN 101 -14.038 6.123 -3.672 801 HB2 GLN 101 HB2 GLN 101 -12.133 8.458 -4.040 802 HB3 GLN 101 HB3 GLN 101 -11.748 6.758 -4.363 803 HG2 GLN 101 HG2 GLN 101 -13.834 6.723 -5.885 804 HG3 GLN 101 HG3 GLN 101 -13.802 8.490 -5.804 805 HE21 GLN 101 HE21 GLN 101 -13.252 6.420 -8.077 806 HE22 GLN 101 HE22 GLN 101 -11.638 6.865 -8.646 807 H ALA 102 H ALA 102 -13.188 8.523 -1.200 808 HA ALA 102 HA ALA 102 -11.312 6.785 0.163 809 HB1 ALA 102 HB1 ALA 102 -11.636 8.357 2.052 810 HB2 ALA 102 HB2 ALA 102 -11.342 9.228 0.535 811 HB3 ALA 102 HB3 ALA 102 -12.993 9.122 1.192 812 H LYS 103 H LYS 103 -14.815 7.612 0.687 813 HA LYS 103 HA LYS 103 -15.066 5.695 2.787 814 HB2 LYS 103 HB2 LYS 103 -17.241 6.285 3.029 815 HB3 LYS 103 HB3 LYS 103 -16.565 7.727 2.289 816 HG2 LYS 103 HG2 LYS 103 -17.480 6.863 0.065 817 HG3 LYS 103 HG3 LYS 103 -18.233 5.546 0.944 818 HD2 LYS 103 HD2 LYS 103 -19.864 7.274 0.507 819 HD3 LYS 103 HD3 LYS 103 -19.573 7.131 2.251 820 HE2 LYS 103 HE2 LYS 103 -18.084 9.109 2.168 821 HE3 LYS 103 HE3 LYS 103 -18.341 9.258 0.426 822 HZ1 LYS 103 HZ1 LYS 103 -20.626 9.819 0.827 823 HZ2 LYS 103 HZ2 LYS 103 -20.546 9.400 2.389 824 HZ3 LYS 103 HZ3 LYS 103 -19.722 10.727 1.850 825 H TYR 104 H TYR 104 -15.423 5.284 -0.671 826 HA TYR 104 HA TYR 104 -16.860 2.954 -0.887 827 HB2 TYR 104 HB2 TYR 104 -16.113 4.367 -2.748 828 HB3 TYR 104 HB3 TYR 104 -14.452 3.838 -2.504 829 HD1 TYR 104 HD1 TYR 104 -17.829 2.883 -3.707 830 HD2 TYR 104 HD2 TYR 104 -13.720 1.620 -3.259 831 HE1 TYR 104 HE1 TYR 104 -18.187 1.142 -5.420 832 HE2 TYR 104 HE2 TYR 104 -14.094 -0.153 -4.957 833 HH TYR 104 HH TYR 104 -17.206 -0.724 -6.551 834 H ALA 105 H ALA 105 -13.620 3.388 0.341 835 HA ALA 105 HA ALA 105 -12.489 0.845 0.109 836 HB1 ALA 105 HB1 ALA 105 -12.352 2.811 2.434 837 HB2 ALA 105 HB2 ALA 105 -11.186 1.542 2.070 838 HB3 ALA 105 HB3 ALA 105 -11.362 2.902 0.955 839 H TYR 106 H TYR 106 -15.149 1.960 2.212 840 HA TYR 106 HA TYR 106 -15.084 -0.020 4.168 841 HB2 TYR 106 HB2 TYR 106 -17.130 0.761 4.805 842 HB3 TYR 106 HB3 TYR 106 -16.628 2.130 3.842 843 HD1 TYR 106 HD1 TYR 106 -17.483 2.032 1.229 844 HD2 TYR 106 HD2 TYR 106 -19.088 -0.441 4.358 845 HE1 TYR 106 HE1 TYR 106 -19.531 1.768 -0.063 846 HE2 TYR 106 HE2 TYR 106 -21.094 -0.844 3.001 847 HH TYR 106 HH TYR 106 -21.490 0.551 -0.293 848 H GLN 107 H GLN 107 -16.457 -0.181 0.875 849 HA GLN 107 HA GLN 107 -17.824 -2.661 1.161 850 HB2 GLN 107 HB2 GLN 107 -16.437 -1.431 -1.258 851 HB3 GLN 107 HB3 GLN 107 -17.400 -2.923 -1.286 852 HG2 GLN 107 HG2 GLN 107 -19.184 -1.272 -0.124 853 HG3 GLN 107 HG3 GLN 107 -18.296 -0.090 -1.107 854 HE21 GLN 107 HE21 GLN 107 -17.789 -1.827 -3.449 855 HE22 GLN 107 HE22 GLN 107 -19.378 -2.075 -4.169 856 H ARG 108 H ARG 108 -14.526 -1.843 0.083 857 HA ARG 108 HA ARG 108 -13.601 -4.490 -0.306 858 HB2 ARG 108 HB2 ARG 108 -11.924 -2.152 0.700 859 HB3 ARG 108 HB3 ARG 108 -11.358 -3.523 -0.229 860 HG2 ARG 108 HG2 ARG 108 -13.178 -1.255 -1.214 861 HG3 ARG 108 HG3 ARG 108 -11.463 -1.518 -1.617 862 HD2 ARG 108 HD2 ARG 108 -12.169 -3.876 -2.400 863 HD3 ARG 108 HD3 ARG 108 -13.836 -3.283 -2.326 864 HE ARG 108 HE ARG 108 -12.290 -1.494 -3.910 865 HH11 ARG 108 HH11 ARG 108 -13.548 -4.822 -3.871 866 HH12 ARG 108 HH12 ARG 108 -13.584 -4.990 -5.592 867 HH21 ARG 108 HH21 ARG 108 -12.336 -1.671 -6.157 868 HH22 ARG 108 HH22 ARG 108 -12.903 -3.125 -6.960 869 H TYR 109 H TYR 109 -13.853 -2.563 2.695 870 HA TYR 109 HA TYR 109 -12.217 -4.385 4.183 871 HB2 TYR 109 HB2 TYR 109 -12.729 -2.106 4.862 872 HB3 TYR 109 HB3 TYR 109 -14.363 -2.477 5.268 873 HD1 TYR 109 HD1 TYR 109 -14.441 -4.930 6.833 874 HD2 TYR 109 HD2 TYR 109 -11.486 -1.745 6.837 875 HE1 TYR 109 HE1 TYR 109 -13.642 -5.642 8.998 876 HE2 TYR 109 HE2 TYR 109 -10.806 -2.400 9.098 877 HH TYR 109 HH TYR 109 -12.148 -3.708 11.123 878 H GLN 110 H GLN 110 -15.762 -4.117 3.811 879 HA GLN 110 HA GLN 110 -16.204 -6.473 5.334 880 HB2 GLN 110 HB2 GLN 110 -18.546 -6.359 4.636 881 HB3 GLN 110 HB3 GLN 110 -17.923 -4.843 5.289 882 HG2 GLN 110 HG2 GLN 110 -17.675 -4.023 2.938 883 HG3 GLN 110 HG3 GLN 110 -18.442 -5.507 2.368 884 HE21 GLN 110 HE21 GLN 110 -20.219 -4.409 1.428 885 HE22 GLN 110 HE22 GLN 110 -21.299 -3.366 2.316 886 H GLU 111 H GLU 111 -15.515 -5.967 1.961 887 HA GLU 111 HA GLU 111 -16.701 -8.256 0.827 888 HB2 GLU 111 HB2 GLU 111 -15.538 -7.883 -0.954 889 HB3 GLU 111 HB3 GLU 111 -15.332 -6.273 -0.243 890 HG2 GLU 111 HG2 GLU 111 -12.988 -7.077 0.305 891 HG3 GLU 111 HG3 GLU 111 -13.360 -8.516 -0.636 892 H ARG 112 H ARG 112 -13.641 -7.897 2.232 893 HA ARG 112 HA ARG 112 -13.223 -10.885 2.362 894 HB2 ARG 112 HB2 ARG 112 -11.187 -8.679 2.897 895 HB3 ARG 112 HB3 ARG 112 -10.913 -10.413 2.848 896 HG2 ARG 112 HG2 ARG 112 -12.091 -10.001 0.385 897 HG3 ARG 112 HG3 ARG 112 -11.223 -8.472 0.645 898 HD2 ARG 112 HD2 ARG 112 -9.206 -9.988 1.212 899 HD3 ARG 112 HD3 ARG 112 -10.136 -11.286 0.447 900 HE ARG 112 HE ARG 112 -9.149 -8.769 -0.807 901 HH11 ARG 112 HH11 ARG 112 -10.997 -11.744 -1.468 902 HH12 ARG 112 HH12 ARG 112 -10.450 -11.864 -3.090 903 HH21 ARG 112 HH21 ARG 112 -8.601 -8.825 -2.970 904 HH22 ARG 112 HH22 ARG 112 -9.324 -10.000 -4.030 905 H TYR 113 H TYR 113 -12.943 -8.040 4.474 906 HA TYR 113 HA TYR 113 -12.754 -9.750 6.856 907 HB2 TYR 113 HB2 TYR 113 -12.605 -6.775 6.886 908 HB3 TYR 113 HB3 TYR 113 -11.914 -7.923 8.008 909 HD1 TYR 113 HD1 TYR 113 -11.097 -5.644 5.571 910 HD2 TYR 113 HD2 TYR 113 -10.217 -9.682 6.719 911 HE1 TYR 113 HE1 TYR 113 -9.002 -5.553 4.223 912 HE2 TYR 113 HE2 TYR 113 -8.085 -9.596 5.450 913 HH TYR 113 HH TYR 113 -7.134 -6.738 3.503 914 H GLY 114 H GLY 114 -15.432 -9.503 5.404 915 HA2 GLY 114 HA2 GLY 114 -17.019 -8.984 7.806 916 HA3 GLY 114 HA3 GLY 114 -17.382 -8.012 6.371 917 H ASN 115 H ASN 115 -19.301 -9.620 7.342 918 HA ASN 115 HA ASN 115 -19.985 -11.367 5.167 919 HB2 ASN 115 HB2 ASN 115 -19.242 -12.529 7.856 920 HB3 ASN 115 HB3 ASN 115 -20.598 -13.208 6.962 921 HD21 ASN 115 HD21 ASN 115 -17.309 -13.604 7.395 922 HD22 ASN 115 HD22 ASN 115 -16.955 -14.377 5.863 923 H LYS 116 H LYS 116 -21.858 -10.208 4.895 924 HA LYS 116 HA LYS 116 -23.655 -9.857 7.267 925 HB2 LYS 116 HB2 LYS 116 -24.364 -7.721 6.300 926 HB3 LYS 116 HB3 LYS 116 -22.666 -7.701 6.753 927 HG2 LYS 116 HG2 LYS 116 -21.942 -7.880 4.442 928 HG3 LYS 116 HG3 LYS 116 -23.573 -8.316 3.906 929 HD2 LYS 116 HD2 LYS 116 -24.409 -6.118 4.567 930 HD3 LYS 116 HD3 LYS 116 -22.751 -5.604 4.984 931 HE2 LYS 116 HE2 LYS 116 -22.046 -5.869 2.687 932 HE3 LYS 116 HE3 LYS 116 -23.526 -6.753 2.270 933 HZ1 LYS 116 HZ1 LYS 116 -23.490 -3.915 3.076 934 HZ2 LYS 116 HZ2 LYS 116 -23.592 -4.461 1.514 935 HZ3 LYS 116 HZ3 LYS 116 -24.794 -4.767 2.609 936 H LYS 117 H LYS 117 -25.922 -9.436 6.569 937 HA LYS 117 HA LYS 117 -26.797 -11.540 4.788 938 HB2 LYS 117 HB2 LYS 117 -27.923 -10.559 6.931 939 HB3 LYS 117 HB3 LYS 117 -28.488 -9.250 5.907 940 HG2 LYS 117 HG2 LYS 117 -29.808 -10.715 4.565 941 HG3 LYS 117 HG3 LYS 117 -29.023 -12.168 5.195 942 HD2 LYS 117 HD2 LYS 117 -30.565 -10.346 7.075 943 HD3 LYS 117 HD3 LYS 117 -31.421 -11.442 5.997 944 HE2 LYS 117 HE2 LYS 117 -31.185 -12.588 8.075 945 HE3 LYS 117 HE3 LYS 117 -30.149 -13.380 6.887 946 HZ1 LYS 117 HZ1 LYS 117 -29.005 -13.195 8.919 947 HZ2 LYS 117 HZ2 LYS 117 -28.245 -12.228 7.894 948 HZ3 LYS 117 HZ3 LYS 117 -29.231 -11.573 9.058 949 H SER 118 H SER 118 -28.302 -11.057 2.894 950 HA SER 118 HA SER 118 -27.547 -8.562 1.487 951 HB2 SER 118 HB2 SER 118 -26.588 -10.720 0.573 952 HB3 SER 118 HB3 SER 118 -28.243 -11.265 0.251 953 HG SER 118 HG SER 118 -28.388 -9.866 -1.390 954 H GLN 119 H GLN 119 -29.185 -7.414 0.642 955 HA GLN 119 HA GLN 119 -31.994 -8.277 1.231 956 HB2 GLN 119 HB2 GLN 119 -30.976 -5.509 0.460 957 HB3 GLN 119 HB3 GLN 119 -32.596 -5.950 0.958 958 HG2 GLN 119 HG2 GLN 119 -31.648 -4.900 2.836 959 HG3 GLN 119 HG3 GLN 119 -31.677 -6.620 3.215 960 HE21 GLN 119 HE21 GLN 119 -29.277 -4.573 1.299 961 HE22 GLN 119 HE22 GLN 119 -27.951 -4.958 2.380 962 H ASP 120 H ASP 120 -29.696 -7.334 -1.305 963 HA ASP 120 HA ASP 120 -31.781 -7.487 -3.385 964 HB2 ASP 120 HB2 ASP 120 -29.008 -7.148 -4.324 965 HB3 ASP 120 HB3 ASP 120 -30.463 -6.290 -4.761 966 H LEU 121 H LEU 121 -31.765 -9.090 -4.929 967 HA LEU 121 HA LEU 121 -29.829 -11.290 -4.921 968 HB2 LEU 121 HB2 LEU 121 -32.837 -11.685 -4.478 969 HB3 LEU 121 HB3 LEU 121 -31.716 -12.939 -4.966 970 HG LEU 121 HG LEU 121 -30.404 -12.147 -2.743 971 HD11 LEU 121 HD11 LEU 121 -33.365 -11.816 -2.048 972 HD12 LEU 121 HD12 LEU 121 -31.994 -11.769 -0.915 973 HD13 LEU 121 HD13 LEU 121 -32.200 -10.489 -2.113 974 HD21 LEU 121 HD21 LEU 121 -31.448 -14.075 -1.611 975 HD22 LEU 121 HD22 LEU 121 -32.716 -14.123 -2.861 976 HD23 LEU 121 HD23 LEU 121 -31.020 -14.445 -3.288 977 H LYS 122 H LYS 122 -31.423 -12.838 -6.792 978 HA LYS 122 HA LYS 122 -32.068 -11.195 -9.083 979 HB2 LYS 122 HB2 LYS 122 -29.541 -11.735 -9.099 980 HB3 LYS 122 HB3 LYS 122 -29.959 -13.437 -9.084 981 HG2 LYS 122 HG2 LYS 122 -30.579 -11.400 -11.254 982 HG3 LYS 122 HG3 LYS 122 -29.304 -12.603 -11.280 983 HD2 LYS 122 HD2 LYS 122 -32.282 -13.100 -11.602 984 HD3 LYS 122 HD3 LYS 122 -31.026 -13.209 -12.783 985 HE2 LYS 122 HE2 LYS 122 -31.253 -15.411 -12.400 986 HE3 LYS 122 HE3 LYS 122 -29.995 -15.077 -11.208 987 HZ1 LYS 122 HZ1 LYS 122 -32.882 -15.076 -10.515 988 HZ2 LYS 122 HZ2 LYS 122 -31.896 -16.436 -10.343 989 HZ3 LYS 122 HZ3 LYS 122 -31.696 -15.066 -9.494 Start of MODEL 13 1 H1 GLY 1 H GLY 1 33.806 -9.847 7.467 2 HA2 GLY 1 HA2 GLY 1 31.688 -10.533 8.524 3 HA3 GLY 1 HA3 GLY 1 31.949 -9.233 9.705 4 H SER 2 H SER 2 29.589 -9.251 8.271 5 HA SER 2 HA SER 2 29.697 -6.762 6.796 6 HB2 SER 2 HB2 SER 2 28.372 -9.200 5.565 7 HB3 SER 2 HB3 SER 2 28.585 -7.606 4.832 8 HG SER 2 HG SER 2 30.837 -8.012 4.793 9 H ASN 3 H ASN 3 27.224 -6.186 6.362 10 HA ASN 3 HA ASN 3 25.300 -7.505 8.072 11 HB2 ASN 3 HB2 ASN 3 24.884 -5.193 9.257 12 HB3 ASN 3 HB3 ASN 3 26.141 -6.246 9.853 13 HD21 ASN 3 HD21 ASN 3 25.640 -3.216 7.851 14 HD22 ASN 3 HD22 ASN 3 27.291 -2.705 8.061 15 H GLN 4 H GLN 4 23.248 -6.440 7.915 16 HA GLN 4 HA GLN 4 22.795 -4.512 5.763 17 HB2 GLN 4 HB2 GLN 4 21.605 -7.333 5.741 18 HB3 GLN 4 HB3 GLN 4 20.860 -5.955 4.911 19 HG2 GLN 4 HG2 GLN 4 23.039 -5.598 3.687 20 HG3 GLN 4 HG3 GLN 4 23.614 -7.123 4.361 21 HE21 GLN 4 HE21 GLN 4 22.498 -5.905 1.563 22 HE22 GLN 4 HE22 GLN 4 21.888 -7.411 0.873 23 H GLN 5 H GLN 5 21.299 -6.746 8.174 24 HA GLN 5 HA GLN 5 19.756 -6.463 9.757 25 HB2 GLN 5 HB2 GLN 5 21.762 -4.961 10.350 26 HB3 GLN 5 HB3 GLN 5 20.697 -3.603 10.002 27 HG2 GLN 5 HG2 GLN 5 19.313 -4.099 11.879 28 HG3 GLN 5 HG3 GLN 5 19.900 -5.770 11.973 29 HE21 GLN 5 HE21 GLN 5 21.608 -2.514 11.846 30 HE22 GLN 5 HE22 GLN 5 22.748 -2.990 13.081 31 H LEU 6 H LEU 6 19.057 -5.888 7.046 32 HA LEU 6 HA LEU 6 16.464 -4.459 7.328 33 HB2 LEU 6 HB2 LEU 6 18.532 -4.258 5.095 34 HB3 LEU 6 HB3 LEU 6 16.867 -3.717 4.911 35 HG LEU 6 HG LEU 6 18.666 -2.613 7.113 36 HD11 LEU 6 HD11 LEU 6 18.358 -1.562 4.282 37 HD12 LEU 6 HD12 LEU 6 19.159 -0.721 5.629 38 HD13 LEU 6 HD13 LEU 6 19.828 -2.237 5.016 39 HD21 LEU 6 HD21 LEU 6 17.113 -0.679 6.955 40 HD22 LEU 6 HD22 LEU 6 16.144 -1.561 5.761 41 HD23 LEU 6 HD23 LEU 6 16.292 -2.168 7.419 42 H ASN 7 H ASN 7 15.297 -6.315 7.452 43 HA ASN 7 HA ASN 7 14.570 -7.875 5.308 44 HB2 ASN 7 HB2 ASN 7 16.713 -9.103 5.371 45 HB3 ASN 7 HB3 ASN 7 16.532 -9.365 7.116 46 HD21 ASN 7 HD21 ASN 7 16.844 -11.718 6.406 47 HD22 ASN 7 HD22 ASN 7 15.389 -12.589 5.957 48 H ALA 8 H ALA 8 12.534 -8.380 5.959 49 HA ALA 8 HA ALA 8 11.532 -7.961 8.568 50 HB1 ALA 8 HB1 ALA 8 10.452 -9.663 6.260 51 HB2 ALA 8 HB2 ALA 8 9.521 -9.179 7.686 52 HB3 ALA 8 HB3 ALA 8 10.108 -7.941 6.558 53 H THR 9 H THR 9 13.123 -10.701 7.162 54 HA THR 9 HA THR 9 13.642 -12.762 7.753 55 HB THR 9 HB THR 9 13.717 -11.716 10.599 56 HG1 THR 9 HG1 THR 9 14.700 -10.163 9.295 57 HG21 THR 9 HG21 THR 9 14.412 -14.087 10.292 58 HG22 THR 9 HG22 THR 9 15.520 -13.586 8.997 59 HG23 THR 9 HG23 THR 9 15.801 -13.049 10.673 60 H LYS 10 H LYS 10 10.937 -12.420 7.354 61 HA LYS 10 HA LYS 10 9.939 -14.720 8.834 62 HB2 LYS 10 HB2 LYS 10 9.382 -12.357 10.080 63 HB3 LYS 10 HB3 LYS 10 7.992 -12.424 9.026 64 HG2 LYS 10 HG2 LYS 10 7.340 -13.510 11.054 65 HG3 LYS 10 HG3 LYS 10 7.608 -14.831 9.905 66 HD2 LYS 10 HD2 LYS 10 9.847 -15.191 10.872 67 HD3 LYS 10 HD3 LYS 10 9.643 -13.788 11.924 68 HE2 LYS 10 HE2 LYS 10 8.018 -14.866 13.257 69 HE3 LYS 10 HE3 LYS 10 7.744 -16.144 12.053 70 HZ1 LYS 10 HZ1 LYS 10 10.339 -15.761 13.401 71 HZ2 LYS 10 HZ2 LYS 10 9.201 -16.845 13.936 72 HZ3 LYS 10 HZ3 LYS 10 9.875 -17.011 12.457 73 H LYS 11 H LYS 11 8.242 -12.167 6.905 74 HA LYS 11 HA LYS 11 7.341 -14.361 5.076 75 HB2 LYS 11 HB2 LYS 11 5.960 -11.797 5.984 76 HB3 LYS 11 HB3 LYS 11 5.471 -12.683 4.553 77 HG2 LYS 11 HG2 LYS 11 3.976 -13.253 6.255 78 HG3 LYS 11 HG3 LYS 11 4.961 -14.675 5.914 79 HD2 LYS 11 HD2 LYS 11 6.096 -14.528 7.984 80 HD3 LYS 11 HD3 LYS 11 5.662 -12.814 8.202 81 HE2 LYS 11 HE2 LYS 11 3.310 -13.415 8.514 82 HE3 LYS 11 HE3 LYS 11 3.684 -15.133 8.260 83 HZ1 LYS 11 HZ1 LYS 11 4.979 -15.120 10.253 84 HZ2 LYS 11 HZ2 LYS 11 4.798 -13.487 10.442 85 HZ3 LYS 11 HZ3 LYS 11 3.510 -14.494 10.619 86 H ASP 12 H ASP 12 7.558 -14.037 2.920 87 HA ASP 12 HA ASP 12 9.511 -12.304 1.866 88 HB2 ASP 12 HB2 ASP 12 8.543 -14.521 0.992 89 HB3 ASP 12 HB3 ASP 12 7.156 -13.613 0.437 90 H LYS 13 H LYS 13 6.033 -12.158 2.102 91 HA LYS 13 HA LYS 13 5.466 -9.858 0.557 92 HB2 LYS 13 HB2 LYS 13 4.079 -11.133 2.974 93 HB3 LYS 13 HB3 LYS 13 3.351 -9.822 2.052 94 HG2 LYS 13 HG2 LYS 13 4.269 -12.385 0.676 95 HG3 LYS 13 HG3 LYS 13 2.701 -12.299 1.481 96 HD2 LYS 13 HD2 LYS 13 1.910 -10.503 0.126 97 HD3 LYS 13 HD3 LYS 13 3.507 -10.200 -0.550 98 HE2 LYS 13 HE2 LYS 13 1.921 -12.722 -1.104 99 HE3 LYS 13 HE3 LYS 13 1.894 -11.272 -2.117 100 HZ1 LYS 13 HZ1 LYS 13 4.423 -11.557 -2.171 101 HZ2 LYS 13 HZ2 LYS 13 4.186 -13.035 -1.596 102 HZ3 LYS 13 HZ3 LYS 13 3.561 -12.651 -3.051 103 H LEU 14 H LEU 14 6.094 -10.157 4.090 104 HA LEU 14 HA LEU 14 5.849 -7.320 4.507 105 HB2 LEU 14 HB2 LEU 14 7.296 -9.427 6.163 106 HB3 LEU 14 HB3 LEU 14 6.972 -7.772 6.682 107 HG LEU 14 HG LEU 14 4.821 -9.809 5.958 108 HD11 LEU 14 HD11 LEU 14 4.396 -10.049 8.320 109 HD12 LEU 14 HD12 LEU 14 6.117 -10.352 8.045 110 HD13 LEU 14 HD13 LEU 14 5.592 -8.802 8.718 111 HD21 LEU 14 HD21 LEU 14 3.943 -7.594 5.574 112 HD22 LEU 14 HD22 LEU 14 3.285 -8.164 7.113 113 HD23 LEU 14 HD23 LEU 14 4.626 -7.000 7.100 114 H GLN 15 H GLN 15 8.608 -9.386 3.592 115 HA GLN 15 HA GLN 15 10.653 -7.492 4.079 116 HB2 GLN 15 HB2 GLN 15 11.041 -9.884 3.631 117 HB3 GLN 15 HB3 GLN 15 10.383 -9.701 2.019 118 HG2 GLN 15 HG2 GLN 15 12.448 -7.876 1.897 119 HG3 GLN 15 HG3 GLN 15 13.097 -9.071 3.018 120 HE21 GLN 15 HE21 GLN 15 13.117 -8.337 -0.275 121 HE22 GLN 15 HE22 GLN 15 13.169 -9.991 -0.850 122 H VAL 16 H VAL 16 8.768 -8.051 1.007 123 HA VAL 16 HA VAL 16 10.171 -5.984 -0.417 124 HB VAL 16 HB VAL 16 8.356 -6.144 -2.042 125 HG11 VAL 16 HG11 VAL 16 10.274 -7.664 -2.151 126 HG12 VAL 16 HG12 VAL 16 9.448 -8.813 -1.075 127 HG13 VAL 16 HG13 VAL 16 8.772 -8.488 -2.676 128 HG21 VAL 16 HG21 VAL 16 7.120 -8.357 -0.388 129 HG22 VAL 16 HG22 VAL 16 6.483 -6.704 -0.467 130 HG23 VAL 16 HG23 VAL 16 6.570 -7.674 -1.936 131 H ILE 17 H ILE 17 7.206 -5.825 1.555 132 HA ILE 17 HA ILE 17 6.762 -3.069 0.841 133 HB ILE 17 HB ILE 17 5.725 -4.408 3.347 134 HG12 ILE 17 HG12 ILE 17 4.263 -4.369 0.664 135 HG13 ILE 17 HG13 ILE 17 5.180 -5.742 1.228 136 HG21 ILE 17 HG21 ILE 17 3.895 -2.796 3.165 137 HG22 ILE 17 HG22 ILE 17 5.434 -1.937 3.100 138 HG23 ILE 17 HG23 ILE 17 4.531 -2.203 1.603 139 HD11 ILE 17 HD11 ILE 17 3.724 -5.564 3.412 140 HD12 ILE 17 HD12 ILE 17 2.624 -4.647 2.337 141 HD13 ILE 17 HD13 ILE 17 3.066 -6.322 1.968 142 H ASP 18 H ASP 18 8.488 -4.667 3.525 143 HA ASP 18 HA ASP 18 8.975 -2.215 4.952 144 HB2 ASP 18 HB2 ASP 18 9.164 -4.639 5.811 145 HB3 ASP 18 HB3 ASP 18 10.798 -4.617 5.147 146 H TRP 19 H TRP 19 10.698 -3.819 2.291 147 HA TRP 19 HA TRP 19 13.079 -2.222 2.440 148 HB2 TRP 19 HB2 TRP 19 13.100 -4.236 1.114 149 HB3 TRP 19 HB3 TRP 19 11.739 -3.703 0.142 150 HD1 TRP 19 HD1 TRP 19 12.192 -1.731 -1.685 151 HE1 TRP 19 HE1 TRP 19 14.246 -1.048 -2.958 152 HE3 TRP 19 HE3 TRP 19 15.728 -4.175 1.127 153 HZ2 TRP 19 HZ2 TRP 19 17.072 -1.726 -3.000 154 HZ3 TRP 19 HZ3 TRP 19 18.086 -4.249 0.331 155 HH2 TRP 19 HH2 TRP 19 18.751 -3.054 -1.737 156 H LEU 20 H LEU 20 10.123 -1.881 0.329 157 HA LEU 20 HA LEU 20 11.012 0.570 -0.735 158 HB2 LEU 20 HB2 LEU 20 8.872 0.890 -1.667 159 HB3 LEU 20 HB3 LEU 20 9.350 -0.788 -1.814 160 HG LEU 20 HG LEU 20 7.908 -0.967 0.438 161 HD11 LEU 20 HD11 LEU 20 7.233 1.430 0.494 162 HD12 LEU 20 HD12 LEU 20 6.453 1.220 -1.077 163 HD13 LEU 20 HD13 LEU 20 5.850 0.343 0.345 164 HD21 LEU 20 HD21 LEU 20 7.589 -2.318 -1.529 165 HD22 LEU 20 HD22 LEU 20 6.046 -1.808 -0.805 166 HD23 LEU 20 HD23 LEU 20 6.627 -1.018 -2.289 167 H ILE 21 H ILE 21 9.255 -0.073 2.272 168 HA ILE 21 HA ILE 21 8.466 2.607 2.871 169 HB ILE 21 HB ILE 21 8.960 0.040 4.386 170 HG12 ILE 21 HG12 ILE 21 6.417 1.687 4.111 171 HG13 ILE 21 HG13 ILE 21 6.856 0.418 3.006 172 HG21 ILE 21 HG21 ILE 21 8.408 0.795 6.479 173 HG22 ILE 21 HG22 ILE 21 9.608 1.931 5.990 174 HG23 ILE 21 HG23 ILE 21 7.902 2.415 5.921 175 HD11 ILE 21 HD11 ILE 21 5.255 -0.378 4.681 176 HD12 ILE 21 HD12 ILE 21 6.809 -1.218 4.909 177 HD13 ILE 21 HD13 ILE 21 6.321 0.093 5.993 178 H GLU 22 H GLU 22 11.390 0.700 3.883 179 HA GLU 22 HA GLU 22 12.461 2.921 5.328 180 HB2 GLU 22 HB2 GLU 22 12.905 0.213 5.319 181 HB3 GLU 22 HB3 GLU 22 14.295 0.768 4.404 182 HG2 GLU 22 HG2 GLU 22 15.069 0.759 6.600 183 HG3 GLU 22 HG3 GLU 22 14.643 2.454 6.386 184 H ASN 23 H ASN 23 12.786 1.967 1.959 185 HA ASN 23 HA ASN 23 15.184 3.516 1.467 186 HB2 ASN 23 HB2 ASN 23 15.158 2.680 -0.513 187 HB3 ASN 23 HB3 ASN 23 13.871 1.604 -0.028 188 HD21 ASN 23 HD21 ASN 23 11.616 2.308 -0.780 189 HD22 ASN 23 HD22 ASN 23 11.571 3.204 -2.275 190 H PHE 24 H PHE 24 11.858 4.104 1.053 191 HA PHE 24 HA PHE 24 12.301 7.018 0.505 192 HB2 PHE 24 HB2 PHE 24 10.432 5.031 -0.602 193 HB3 PHE 24 HB3 PHE 24 9.687 6.557 -0.239 194 HD1 PHE 24 HD1 PHE 24 11.087 8.725 -0.980 195 HD2 PHE 24 HD2 PHE 24 11.105 4.850 -2.871 196 HE1 PHE 24 HE1 PHE 24 11.667 9.768 -3.135 197 HE2 PHE 24 HE2 PHE 24 11.715 5.878 -4.989 198 HZ PHE 24 HZ PHE 24 11.995 8.358 -5.163 199 HA PRO 25 HA PRO 25 10.320 6.860 4.686 200 HB2 PRO 25 HB2 PRO 25 12.128 8.251 6.158 201 HB3 PRO 25 HB3 PRO 25 12.428 6.561 5.661 202 HG2 PRO 25 HG2 PRO 25 13.373 9.081 4.249 203 HG3 PRO 25 HG3 PRO 25 14.373 7.700 4.807 204 HD2 PRO 25 HD2 PRO 25 13.445 7.859 2.257 205 HD3 PRO 25 HD3 PRO 25 13.532 6.301 3.134 206 H ASN 26 H ASN 26 9.951 8.763 2.239 207 HA ASN 26 HA ASN 26 9.753 11.458 3.424 208 HB2 ASN 26 HB2 ASN 26 9.209 10.122 0.775 209 HB3 ASN 26 HB3 ASN 26 8.235 11.528 1.151 210 HD21 ASN 26 HD21 ASN 26 11.608 10.457 0.796 211 HD22 ASN 26 HD22 ASN 26 12.243 12.063 0.506 212 H ALA 27 H ALA 27 7.811 8.632 2.941 213 HA ALA 27 HA ALA 27 5.708 9.323 4.786 214 HB1 ALA 27 HB1 ALA 27 4.918 10.821 3.009 215 HB2 ALA 27 HB2 ALA 27 5.237 9.601 1.756 216 HB3 ALA 27 HB3 ALA 27 3.907 9.364 2.908 217 H PHE 28 H PHE 28 5.426 7.255 5.517 218 HA PHE 28 HA PHE 28 4.170 5.276 4.065 219 HB2 PHE 28 HB2 PHE 28 7.094 5.133 3.831 220 HB3 PHE 28 HB3 PHE 28 6.443 3.717 4.605 221 HD1 PHE 28 HD1 PHE 28 4.021 2.948 3.344 222 HD2 PHE 28 HD2 PHE 28 7.331 5.006 1.503 223 HE1 PHE 28 HE1 PHE 28 3.166 2.337 1.086 224 HE2 PHE 28 HE2 PHE 28 6.411 4.453 -0.730 225 HZ PHE 28 HZ PHE 28 4.361 3.095 -0.946 226 H PHE 29 H PHE 29 4.190 3.137 5.536 227 HA PHE 29 HA PHE 29 4.635 3.728 8.369 228 HB2 PHE 29 HB2 PHE 29 1.882 3.229 7.160 229 HB3 PHE 29 HB3 PHE 29 2.247 3.102 8.870 230 HD1 PHE 29 HD1 PHE 29 1.349 5.335 6.191 231 HD2 PHE 29 HD2 PHE 29 3.362 5.219 9.989 232 HE1 PHE 29 HE1 PHE 29 1.184 7.805 6.358 233 HE2 PHE 29 HE2 PHE 29 3.102 7.689 10.202 234 HZ PHE 29 HZ PHE 29 1.998 8.969 8.378 235 H LYS 30 H LYS 30 4.714 1.813 9.612 236 HA LYS 30 HA LYS 30 4.926 -0.688 7.993 237 HB2 LYS 30 HB2 LYS 30 6.167 0.068 10.661 238 HB3 LYS 30 HB3 LYS 30 6.374 -1.480 9.840 239 HG2 LYS 30 HG2 LYS 30 7.897 -0.662 8.355 240 HG3 LYS 30 HG3 LYS 30 6.919 0.746 8.019 241 HD2 LYS 30 HD2 LYS 30 8.557 1.931 8.895 242 HD3 LYS 30 HD3 LYS 30 7.774 1.515 10.406 243 HE2 LYS 30 HE2 LYS 30 10.168 1.133 10.629 244 HE3 LYS 30 HE3 LYS 30 9.362 -0.435 10.633 245 HZ1 LYS 30 HZ1 LYS 30 11.306 -0.536 9.281 246 HZ2 LYS 30 HZ2 LYS 30 10.071 -0.658 8.251 247 HZ3 LYS 30 HZ3 LYS 30 10.925 0.768 8.401 248 H LYS 31 H LYS 31 3.722 0.507 11.163 249 HA LYS 31 HA LYS 31 2.281 -2.041 11.560 250 HB2 LYS 31 HB2 LYS 31 2.816 0.436 13.127 251 HB3 LYS 31 HB3 LYS 31 1.190 -0.177 13.354 252 HG2 LYS 31 HG2 LYS 31 3.704 -1.836 13.744 253 HG3 LYS 31 HG3 LYS 31 2.827 -0.988 15.016 254 HD2 LYS 31 HD2 LYS 31 0.757 -2.360 14.382 255 HD3 LYS 31 HD3 LYS 31 1.848 -3.355 13.375 256 HE2 LYS 31 HE2 LYS 31 3.312 -3.645 15.411 257 HE3 LYS 31 HE3 LYS 31 2.088 -2.798 16.365 258 HZ1 LYS 31 HZ1 LYS 31 1.780 -5.393 14.993 259 HZ2 LYS 31 HZ2 LYS 31 1.844 -5.117 16.605 260 HZ3 LYS 31 HZ3 LYS 31 0.533 -4.603 15.766 261 H GLY 32 H GLY 32 0.016 -2.438 11.171 262 HA2 GLY 32 HA2 GLY 32 -1.314 -0.821 9.283 263 HA3 GLY 32 HA3 GLY 32 -2.049 -2.086 10.249 264 H ASN 33 H ASN 33 -0.999 -0.389 12.700 265 HA ASN 33 HA ASN 33 -3.504 0.996 13.126 266 HB2 ASN 33 HB2 ASN 33 -2.672 1.481 15.350 267 HB3 ASN 33 HB3 ASN 33 -2.430 -0.204 14.952 268 HD21 ASN 33 HD21 ASN 33 -0.332 2.757 14.223 269 HD22 ASN 33 HD22 ASN 33 1.021 2.142 15.116 270 H GLN 34 H GLN 34 -0.506 2.032 11.756 271 HA GLN 34 HA GLN 34 -1.141 4.901 12.323 272 HB2 GLN 34 HB2 GLN 34 1.312 5.239 11.832 273 HB3 GLN 34 HB3 GLN 34 0.944 4.404 13.340 274 HG2 GLN 34 HG2 GLN 34 1.569 2.280 12.468 275 HG3 GLN 34 HG3 GLN 34 1.530 2.871 10.815 276 HE21 GLN 34 HE21 GLN 34 3.225 5.128 12.855 277 HE22 GLN 34 HE22 GLN 34 4.819 4.476 12.546 278 H VAL 35 H VAL 35 -1.587 2.669 9.942 279 HA VAL 35 HA VAL 35 -0.428 4.039 7.693 280 HB VAL 35 HB VAL 35 -1.947 2.769 6.261 281 HG11 VAL 35 HG11 VAL 35 -1.211 0.501 6.906 282 HG12 VAL 35 HG12 VAL 35 0.085 1.688 7.017 283 HG13 VAL 35 HG13 VAL 35 -0.716 1.119 8.491 284 HG21 VAL 35 HG21 VAL 35 -4.038 2.719 7.324 285 HG22 VAL 35 HG22 VAL 35 -3.463 1.039 7.424 286 HG23 VAL 35 HG23 VAL 35 -3.392 2.100 8.839 287 H LYS 36 H LYS 36 -1.522 5.175 5.949 288 HA LYS 36 HA LYS 36 -3.932 6.748 6.413 289 HB2 LYS 36 HB2 LYS 36 -1.112 7.775 6.581 290 HB3 LYS 36 HB3 LYS 36 -2.129 8.659 5.484 291 HG2 LYS 36 HG2 LYS 36 -3.225 8.160 8.256 292 HG3 LYS 36 HG3 LYS 36 -1.865 9.245 8.097 293 HD2 LYS 36 HD2 LYS 36 -3.307 10.418 6.203 294 HD3 LYS 36 HD3 LYS 36 -4.632 9.542 6.935 295 HE2 LYS 36 HE2 LYS 36 -4.699 11.648 7.956 296 HE3 LYS 36 HE3 LYS 36 -3.913 10.640 9.177 297 HZ1 LYS 36 HZ1 LYS 36 -2.483 12.393 7.245 298 HZ2 LYS 36 HZ2 LYS 36 -2.811 12.834 8.766 299 HZ3 LYS 36 HZ3 LYS 36 -1.782 11.578 8.460 300 HA PRO 37 HA PRO 37 -3.810 5.776 2.098 301 HB2 PRO 37 HB2 PRO 37 -5.087 7.781 0.783 302 HB3 PRO 37 HB3 PRO 37 -5.908 6.651 1.891 303 HG2 PRO 37 HG2 PRO 37 -4.913 9.441 2.512 304 HG3 PRO 37 HG3 PRO 37 -6.505 8.713 2.897 305 HD2 PRO 37 HD2 PRO 37 -4.435 8.838 4.696 306 HD3 PRO 37 HD3 PRO 37 -5.610 7.487 4.693 307 H LEU 38 H LEU 38 -2.867 6.333 -0.008 308 HA LEU 38 HA LEU 38 -0.641 8.326 0.035 309 HB2 LEU 38 HB2 LEU 38 -0.538 5.415 -0.797 310 HB3 LEU 38 HB3 LEU 38 0.662 6.597 -1.294 311 HG LEU 38 HG LEU 38 -0.023 6.074 1.625 312 HD11 LEU 38 HD11 LEU 38 0.800 4.010 0.580 313 HD12 LEU 38 HD12 LEU 38 2.267 4.864 0.056 314 HD13 LEU 38 HD13 LEU 38 1.917 4.661 1.786 315 HD21 LEU 38 HD21 LEU 38 2.351 7.463 0.292 316 HD22 LEU 38 HD22 LEU 38 1.122 8.228 1.313 317 HD23 LEU 38 HD23 LEU 38 2.265 7.074 2.012 318 H LYS 39 H LYS 39 0.160 8.633 -2.337 319 HA LYS 39 HA LYS 39 -2.013 9.611 -3.865 320 HB2 LYS 39 HB2 LYS 39 0.414 10.330 -4.071 321 HB3 LYS 39 HB3 LYS 39 0.766 8.779 -4.819 322 HG2 LYS 39 HG2 LYS 39 -0.998 9.495 -6.642 323 HG3 LYS 39 HG3 LYS 39 -0.873 11.088 -5.958 324 HD2 LYS 39 HD2 LYS 39 1.611 10.993 -6.438 325 HD3 LYS 39 HD3 LYS 39 1.384 9.359 -7.065 326 HE2 LYS 39 HE2 LYS 39 1.213 10.355 -9.028 327 HE3 LYS 39 HE3 LYS 39 -0.461 10.635 -8.577 328 HZ1 LYS 39 HZ1 LYS 39 0.235 12.907 -7.880 329 HZ2 LYS 39 HZ2 LYS 39 1.784 12.580 -8.336 330 HZ3 LYS 39 HZ3 LYS 39 0.534 12.602 -9.427 331 H ILE 40 H ILE 40 -2.831 8.753 -5.976 332 HA ILE 40 HA ILE 40 -3.260 5.896 -5.948 333 HB ILE 40 HB ILE 40 -4.883 7.659 -6.769 334 HG12 ILE 40 HG12 ILE 40 -5.700 6.451 -8.756 335 HG13 ILE 40 HG13 ILE 40 -4.229 5.475 -8.771 336 HG21 ILE 40 HG21 ILE 40 -3.099 7.832 -9.232 337 HG22 ILE 40 HG22 ILE 40 -4.674 8.593 -8.998 338 HG23 ILE 40 HG23 ILE 40 -3.302 9.112 -8.018 339 HD11 ILE 40 HD11 ILE 40 -6.223 4.415 -7.630 340 HD12 ILE 40 HD12 ILE 40 -4.802 4.520 -6.588 341 HD13 ILE 40 HD13 ILE 40 -6.150 5.675 -6.397 342 H GLY 41 H GLY 41 -2.315 4.395 -7.634 343 HA2 GLY 41 HA2 GLY 41 -0.543 3.614 -8.848 344 HA3 GLY 41 HA3 GLY 41 -0.476 5.219 -9.569 345 H ILE 42 H ILE 42 0.211 5.140 -6.105 346 HA ILE 42 HA ILE 42 2.774 6.205 -6.421 347 HB ILE 42 HB ILE 42 1.434 6.411 -4.432 348 HG12 ILE 42 HG12 ILE 42 4.129 5.161 -3.790 349 HG13 ILE 42 HG13 ILE 42 3.927 6.717 -4.543 350 HG21 ILE 42 HG21 ILE 42 1.277 4.658 -2.724 351 HG22 ILE 42 HG22 ILE 42 0.526 4.110 -4.219 352 HG23 ILE 42 HG23 ILE 42 2.146 3.520 -3.766 353 HD11 ILE 42 HD11 ILE 42 2.604 7.502 -2.557 354 HD12 ILE 42 HD12 ILE 42 2.966 5.946 -1.769 355 HD13 ILE 42 HD13 ILE 42 4.277 7.053 -2.177 356 H PHE 43 H PHE 43 1.792 2.824 -6.581 357 HA PHE 43 HA PHE 43 4.416 1.644 -6.145 358 HB2 PHE 43 HB2 PHE 43 2.775 0.054 -5.828 359 HB3 PHE 43 HB3 PHE 43 1.735 0.728 -7.075 360 HD1 PHE 43 HD1 PHE 43 1.851 0.103 -9.383 361 HD2 PHE 43 HD2 PHE 43 4.661 -1.633 -6.542 362 HE1 PHE 43 HE1 PHE 43 2.625 -1.476 -11.097 363 HE2 PHE 43 HE2 PHE 43 5.398 -3.191 -8.288 364 HZ PHE 43 HZ PHE 43 4.398 -3.127 -10.567 365 H ASP 44 H ASP 44 2.551 2.736 -9.063 366 HA ASP 44 HA ASP 44 4.406 1.689 -10.930 367 HB2 ASP 44 HB2 ASP 44 2.379 3.940 -11.175 368 HB3 ASP 44 HB3 ASP 44 3.366 3.343 -12.513 369 H ASP 45 H ASP 45 4.552 4.564 -8.923 370 HA ASP 45 HA ASP 45 6.704 5.788 -10.516 371 HB2 ASP 45 HB2 ASP 45 5.070 6.528 -8.141 372 HB3 ASP 45 HB3 ASP 45 6.757 7.053 -8.083 373 H LEU 46 H LEU 46 6.405 4.047 -7.489 374 HA LEU 46 HA LEU 46 9.125 4.075 -6.651 375 HB2 LEU 46 HB2 LEU 46 7.410 3.609 -5.060 376 HB3 LEU 46 HB3 LEU 46 6.694 2.375 -6.079 377 HG LEU 46 HG LEU 46 8.742 0.908 -5.698 378 HD11 LEU 46 HD11 LEU 46 10.181 1.486 -3.763 379 HD12 LEU 46 HD12 LEU 46 10.376 2.606 -5.119 380 HD13 LEU 46 HD13 LEU 46 9.428 3.111 -3.726 381 HD21 LEU 46 HD21 LEU 46 7.995 0.124 -3.667 382 HD22 LEU 46 HD22 LEU 46 7.255 1.692 -3.222 383 HD23 LEU 46 HD23 LEU 46 6.599 0.727 -4.577 384 H ILE 47 H ILE 47 7.338 1.865 -8.703 385 HA ILE 47 HA ILE 47 9.098 -0.332 -8.696 386 HB ILE 47 HB ILE 47 6.769 0.061 -9.854 387 HG12 ILE 47 HG12 ILE 47 8.169 -2.089 -9.661 388 HG13 ILE 47 HG13 ILE 47 6.819 -1.988 -10.777 389 HG21 ILE 47 HG21 ILE 47 8.548 0.560 -12.289 390 HG22 ILE 47 HG22 ILE 47 6.786 0.387 -12.255 391 HG23 ILE 47 HG23 ILE 47 7.580 1.761 -11.471 392 HD11 ILE 47 HD11 ILE 47 9.636 -1.451 -11.722 393 HD12 ILE 47 HD12 ILE 47 8.947 -3.080 -11.678 394 HD13 ILE 47 HD13 ILE 47 8.187 -1.818 -12.672 395 H ASP 48 H ASP 48 9.379 2.910 -10.280 396 HA ASP 48 HA ASP 48 11.441 2.190 -12.132 397 HB2 ASP 48 HB2 ASP 48 10.748 4.840 -10.794 398 HB3 ASP 48 HB3 ASP 48 12.042 4.632 -11.943 399 H PHE 49 H PHE 49 11.414 3.079 -8.725 400 HA PHE 49 HA PHE 49 14.259 3.366 -8.394 401 HB2 PHE 49 HB2 PHE 49 11.863 3.750 -6.809 402 HB3 PHE 49 HB3 PHE 49 12.983 2.743 -5.922 403 HD1 PHE 49 HD1 PHE 49 15.110 3.668 -5.109 404 HD2 PHE 49 HD2 PHE 49 12.409 6.057 -7.494 405 HE1 PHE 49 HE1 PHE 49 16.375 5.715 -4.507 406 HE2 PHE 49 HE2 PHE 49 13.747 8.070 -6.975 407 HZ PHE 49 HZ PHE 49 15.672 7.919 -5.435 408 H TYR 50 H TYR 50 11.930 0.695 -8.344 409 HA TYR 50 HA TYR 50 13.644 -1.231 -7.022 410 HB2 TYR 50 HB2 TYR 50 11.569 -2.133 -7.001 411 HB3 TYR 50 HB3 TYR 50 11.046 -1.297 -8.430 412 HD1 TYR 50 HD1 TYR 50 12.360 -4.444 -7.153 413 HD2 TYR 50 HD2 TYR 50 11.485 -2.210 -10.708 414 HE1 TYR 50 HE1 TYR 50 12.502 -6.540 -8.516 415 HE2 TYR 50 HE2 TYR 50 11.591 -4.268 -12.064 416 HH TYR 50 HH TYR 50 12.186 -6.567 -12.061 417 H GLU 51 H GLU 51 13.181 -0.167 -10.412 418 HA GLU 51 HA GLU 51 15.016 -2.145 -11.503 419 HB2 GLU 51 HB2 GLU 51 13.979 0.471 -12.714 420 HB3 GLU 51 HB3 GLU 51 14.892 -0.790 -13.567 421 HG2 GLU 51 HG2 GLU 51 12.965 -2.362 -12.645 422 HG3 GLU 51 HG3 GLU 51 12.057 -0.854 -12.546 423 H ARG 52 H ARG 52 15.393 0.900 -9.922 424 HA ARG 52 HA ARG 52 17.948 1.590 -11.066 425 HB2 ARG 52 HB2 ARG 52 16.221 3.134 -9.927 426 HB3 ARG 52 HB3 ARG 52 16.775 2.482 -8.388 427 HG2 ARG 52 HG2 ARG 52 17.764 4.618 -8.840 428 HG3 ARG 52 HG3 ARG 52 19.031 3.384 -8.772 429 HD2 ARG 52 HD2 ARG 52 19.238 3.399 -11.202 430 HD3 ARG 52 HD3 ARG 52 17.755 4.362 -11.344 431 HE ARG 52 HE ARG 52 20.270 5.351 -10.055 432 HH11 ARG 52 HH11 ARG 52 17.768 5.862 -12.553 433 HH12 ARG 52 HH12 ARG 52 18.004 7.571 -12.605 434 HH21 ARG 52 HH21 ARG 52 20.636 7.581 -10.200 435 HH22 ARG 52 HH22 ARG 52 19.782 8.504 -11.430 436 H LEU 53 H LEU 53 16.923 -0.596 -8.459 437 HA LEU 53 HA LEU 53 19.340 -0.625 -6.985 438 HB2 LEU 53 HB2 LEU 53 17.430 -2.946 -7.461 439 HB3 LEU 53 HB3 LEU 53 18.466 -2.680 -6.057 440 HG LEU 53 HG LEU 53 15.998 -1.078 -6.835 441 HD11 LEU 53 HD11 LEU 53 16.507 -3.132 -4.681 442 HD12 LEU 53 HD12 LEU 53 15.073 -2.070 -4.775 443 HD13 LEU 53 HD13 LEU 53 15.422 -3.235 -6.073 444 HD21 LEU 53 HD21 LEU 53 16.302 0.009 -4.568 445 HD22 LEU 53 HD22 LEU 53 17.987 -0.604 -4.601 446 HD23 LEU 53 HD23 LEU 53 17.407 0.515 -5.834 447 H ASP 54 H ASP 54 20.984 -2.224 -6.972 448 HA ASP 54 HA ASP 54 21.741 -3.245 -9.634 449 HB2 ASP 54 HB2 ASP 54 23.470 -2.294 -8.246 450 HB3 ASP 54 HB3 ASP 54 23.038 -3.353 -6.902 451 H THR 55 H THR 55 20.185 -4.386 -6.705 452 HA THR 55 HA THR 55 20.038 -7.105 -7.889 453 HB THR 55 HB THR 55 19.903 -6.819 -4.938 454 HG1 THR 55 HG1 THR 55 22.376 -6.834 -6.285 455 HG21 THR 55 HG21 THR 55 21.176 -8.852 -6.821 456 HG22 THR 55 HG22 THR 55 21.176 -8.965 -5.059 457 HG23 THR 55 HG23 THR 55 19.640 -9.021 -5.938 458 HA PRO 56 HA PRO 56 15.799 -5.348 -7.441 459 HB2 PRO 56 HB2 PRO 56 14.861 -6.434 -9.817 460 HB3 PRO 56 HB3 PRO 56 15.574 -4.794 -9.671 461 HG2 PRO 56 HG2 PRO 56 16.850 -7.361 -10.627 462 HG3 PRO 56 HG3 PRO 56 17.040 -5.702 -11.282 463 HD2 PRO 56 HD2 PRO 56 18.879 -6.850 -9.643 464 HD3 PRO 56 HD3 PRO 56 18.533 -5.094 -9.604 465 HA PRO 57 HA PRO 57 15.310 -9.541 -5.794 466 HB2 PRO 57 HB2 PRO 57 13.016 -9.269 -4.333 467 HB3 PRO 57 HB3 PRO 57 14.537 -8.451 -3.916 468 HG2 PRO 57 HG2 PRO 57 12.251 -7.296 -5.560 469 HG3 PRO 57 HG3 PRO 57 12.978 -6.610 -4.077 470 HD2 PRO 57 HD2 PRO 57 13.805 -5.846 -6.549 471 HD3 PRO 57 HD3 PRO 57 14.994 -6.069 -5.242 472 H PHE 58 H PHE 58 11.893 -9.653 -5.824 473 HA PHE 58 HA PHE 58 11.972 -11.498 -8.124 474 HB2 PHE 58 HB2 PHE 58 10.725 -11.600 -5.689 475 HB3 PHE 58 HB3 PHE 58 9.430 -10.944 -6.671 476 HD1 PHE 58 HD1 PHE 58 8.428 -12.375 -8.468 477 HD2 PHE 58 HD2 PHE 58 11.639 -13.793 -5.972 478 HE1 PHE 58 HE1 PHE 58 7.985 -14.715 -9.217 479 HE2 PHE 58 HE2 PHE 58 11.205 -16.112 -6.722 480 HZ PHE 58 HZ PHE 58 9.359 -16.578 -8.339 481 H SER 59 H SER 59 9.854 -11.251 -9.587 482 HA SER 59 HA SER 59 10.065 -8.700 -10.832 483 HB2 SER 59 HB2 SER 59 9.400 -10.848 -11.965 484 HB3 SER 59 HB3 SER 59 7.801 -10.704 -11.196 485 HG SER 59 HG SER 59 7.936 -9.801 -13.331 486 H LYS 60 H LYS 60 8.381 -7.211 -11.142 487 HA LYS 60 HA LYS 60 7.487 -5.903 -8.900 488 HB2 LYS 60 HB2 LYS 60 6.221 -4.454 -10.368 489 HB3 LYS 60 HB3 LYS 60 7.808 -4.850 -10.986 490 HG2 LYS 60 HG2 LYS 60 6.303 -6.793 -12.253 491 HG3 LYS 60 HG3 LYS 60 5.107 -5.511 -12.081 492 HD2 LYS 60 HD2 LYS 60 6.155 -5.210 -14.203 493 HD3 LYS 60 HD3 LYS 60 6.814 -3.935 -13.161 494 HE2 LYS 60 HE2 LYS 60 8.826 -5.447 -12.739 495 HE3 LYS 60 HE3 LYS 60 8.121 -6.614 -13.868 496 HZ1 LYS 60 HZ1 LYS 60 9.646 -5.362 -15.091 497 HZ2 LYS 60 HZ2 LYS 60 8.204 -4.738 -15.533 498 HZ3 LYS 60 HZ3 LYS 60 9.129 -3.905 -14.509 499 H LYS 61 H LYS 61 5.657 -8.504 -10.437 500 HA LYS 61 HA LYS 61 3.157 -7.864 -9.236 501 HB2 LYS 61 HB2 LYS 61 4.427 -10.259 -10.455 502 HB3 LYS 61 HB3 LYS 61 3.263 -10.654 -9.186 503 HG2 LYS 61 HG2 LYS 61 1.521 -9.380 -10.244 504 HG3 LYS 61 HG3 LYS 61 2.629 -8.762 -11.489 505 HD2 LYS 61 HD2 LYS 61 2.998 -10.995 -12.357 506 HD3 LYS 61 HD3 LYS 61 2.041 -11.727 -11.063 507 HE2 LYS 61 HE2 LYS 61 0.971 -9.799 -13.176 508 HE3 LYS 61 HE3 LYS 61 0.837 -11.565 -13.245 509 HZ1 LYS 61 HZ1 LYS 61 -1.164 -10.661 -12.323 510 HZ2 LYS 61 HZ2 LYS 61 -0.378 -11.462 -11.121 511 HZ3 LYS 61 HZ3 LYS 61 -0.346 -9.836 -11.165 512 H SER 62 H SER 62 6.014 -9.591 -7.842 513 HA SER 62 HA SER 62 4.722 -10.355 -5.432 514 HB2 SER 62 HB2 SER 62 6.939 -11.201 -6.265 515 HB3 SER 62 HB3 SER 62 7.649 -9.607 -5.955 516 HG SER 62 HG SER 62 8.101 -10.917 -4.206 517 H LEU 63 H LEU 63 6.717 -7.475 -6.210 518 HA LEU 63 HA LEU 63 6.551 -6.116 -3.800 519 HB2 LEU 63 HB2 LEU 63 7.910 -5.613 -5.942 520 HB3 LEU 63 HB3 LEU 63 6.487 -4.794 -6.537 521 HG LEU 63 HG LEU 63 6.751 -3.571 -4.089 522 HD11 LEU 63 HD11 LEU 63 9.042 -3.007 -3.689 523 HD12 LEU 63 HD12 LEU 63 8.845 -4.765 -3.554 524 HD13 LEU 63 HD13 LEU 63 9.590 -4.067 -5.008 525 HD21 LEU 63 HD21 LEU 63 7.776 -1.699 -5.244 526 HD22 LEU 63 HD22 LEU 63 8.389 -2.703 -6.557 527 HD23 LEU 63 HD23 LEU 63 6.654 -2.487 -6.365 528 H ARG 64 H ARG 64 4.311 -5.802 -6.640 529 HA ARG 64 HA ARG 64 2.659 -4.007 -5.149 530 HB2 ARG 64 HB2 ARG 64 2.780 -4.081 -7.670 531 HB3 ARG 64 HB3 ARG 64 1.870 -5.580 -7.652 532 HG2 ARG 64 HG2 ARG 64 0.533 -3.540 -8.166 533 HG3 ARG 64 HG3 ARG 64 -0.113 -4.456 -6.818 534 HD2 ARG 64 HD2 ARG 64 0.424 -2.832 -5.260 535 HD3 ARG 64 HD3 ARG 64 1.789 -2.212 -6.194 536 HE ARG 64 HE ARG 64 -0.116 -1.415 -7.810 537 HH11 ARG 64 HH11 ARG 64 -0.149 -1.222 -4.253 538 HH12 ARG 64 HH12 ARG 64 -0.871 0.355 -4.234 539 HH21 ARG 64 HH21 ARG 64 -1.064 0.720 -7.740 540 HH22 ARG 64 HH22 ARG 64 -1.486 1.381 -6.188 541 H GLU 65 H GLU 65 2.363 -7.585 -5.617 542 HA GLU 65 HA GLU 65 -0.304 -7.719 -4.610 543 HB2 GLU 65 HB2 GLU 65 2.009 -9.697 -4.688 544 HB3 GLU 65 HB3 GLU 65 0.524 -10.051 -3.802 545 HG2 GLU 65 HG2 GLU 65 -0.817 -9.664 -5.870 546 HG3 GLU 65 HG3 GLU 65 0.674 -9.417 -6.777 547 H ALA 66 H ALA 66 2.888 -7.756 -3.016 548 HA ALA 66 HA ALA 66 1.932 -8.175 -0.370 549 HB1 ALA 66 HB1 ALA 66 4.133 -7.521 0.270 550 HB2 ALA 66 HB2 ALA 66 4.331 -8.346 -1.285 551 HB3 ALA 66 HB3 ALA 66 4.370 -6.584 -1.223 552 H LEU 67 H LEU 67 2.804 -5.149 -2.119 553 HA LEU 67 HA LEU 67 2.104 -3.346 -0.095 554 HB2 LEU 67 HB2 LEU 67 3.085 -3.119 -2.641 555 HB3 LEU 67 HB3 LEU 67 1.461 -2.498 -2.896 556 HG LEU 67 HG LEU 67 3.510 -1.511 -0.844 557 HD11 LEU 67 HD11 LEU 67 3.737 0.442 -2.321 558 HD12 LEU 67 HD12 LEU 67 4.100 -1.022 -3.224 559 HD13 LEU 67 HD13 LEU 67 2.530 -0.214 -3.441 560 HD21 LEU 67 HD21 LEU 67 1.311 -1.009 0.032 561 HD22 LEU 67 HD22 LEU 67 1.969 0.475 -0.649 562 HD23 LEU 67 HD23 LEU 67 0.737 -0.441 -1.549 563 H SER 68 H SER 68 0.030 -4.910 -2.552 564 HA SER 68 HA SER 68 -2.346 -3.512 -2.075 565 HB2 SER 68 HB2 SER 68 -1.717 -5.269 -3.904 566 HB3 SER 68 HB3 SER 68 -2.294 -6.470 -2.735 567 HG SER 68 HG SER 68 -3.737 -4.203 -3.693 568 H TYR 69 H TYR 69 -0.991 -6.394 -0.376 569 HA TYR 69 HA TYR 69 -3.259 -6.838 1.299 570 HB2 TYR 69 HB2 TYR 69 -0.390 -7.702 1.300 571 HB3 TYR 69 HB3 TYR 69 -1.180 -7.688 2.858 572 HD1 TYR 69 HD1 TYR 69 -3.571 -8.788 2.993 573 HD2 TYR 69 HD2 TYR 69 -0.642 -9.649 -0.064 574 HE1 TYR 69 HE1 TYR 69 -4.608 -10.987 2.638 575 HE2 TYR 69 HE2 TYR 69 -1.628 -11.893 -0.368 576 HH TYR 69 HH TYR 69 -3.236 -13.390 0.331 577 H TYR 70 H TYR 70 -0.588 -4.503 1.517 578 HA TYR 70 HA TYR 70 -1.162 -3.810 4.293 579 HB2 TYR 70 HB2 TYR 70 0.819 -3.018 2.254 580 HB3 TYR 70 HB3 TYR 70 0.193 -1.654 3.163 581 HD1 TYR 70 HD1 TYR 70 0.895 -5.230 4.196 582 HD2 TYR 70 HD2 TYR 70 1.742 -1.040 4.794 583 HE1 TYR 70 HE1 TYR 70 2.299 -5.794 6.145 584 HE2 TYR 70 HE2 TYR 70 3.178 -1.594 6.703 585 HH TYR 70 HH TYR 70 3.614 -3.282 8.264 586 H SER 71 H SER 71 -1.857 -2.262 1.092 587 HA SER 71 HA SER 71 -3.459 -0.174 2.245 588 HB2 SER 71 HB2 SER 71 -4.444 -0.029 -0.111 589 HB3 SER 71 HB3 SER 71 -2.716 0.267 0.105 590 HG SER 71 HG SER 71 -3.987 -1.962 -1.040 591 H ALA 72 H ALA 72 -4.154 -3.534 1.482 592 HA ALA 72 HA ALA 72 -7.013 -3.229 1.864 593 HB1 ALA 72 HB1 ALA 72 -5.309 -5.746 1.671 594 HB2 ALA 72 HB2 ALA 72 -7.071 -5.640 1.490 595 HB3 ALA 72 HB3 ALA 72 -6.029 -4.903 0.275 596 H SER 73 H SER 73 -4.737 -2.852 4.125 597 HA SER 73 HA SER 73 -5.431 -4.794 6.124 598 HB2 SER 73 HB2 SER 73 -4.510 -1.908 6.513 599 HB3 SER 73 HB3 SER 73 -4.599 -3.138 7.788 600 HG SER 73 HG SER 73 -2.959 -3.085 5.494 601 HA PRO 74 HA PRO 74 -9.583 -3.555 7.021 602 HB2 PRO 74 HB2 PRO 74 -9.584 -3.880 9.846 603 HB3 PRO 74 HB3 PRO 74 -10.005 -5.130 8.619 604 HG2 PRO 74 HG2 PRO 74 -7.509 -4.654 10.146 605 HG3 PRO 74 HG3 PRO 74 -8.179 -6.210 9.563 606 HD2 PRO 74 HD2 PRO 74 -6.037 -4.916 8.406 607 HD3 PRO 74 HD3 PRO 74 -7.172 -5.932 7.456 608 H ALA 75 H ALA 75 -7.123 -2.410 9.324 609 HA ALA 75 HA ALA 75 -8.332 -0.152 10.309 610 HB1 ALA 75 HB1 ALA 75 -5.396 -0.676 9.661 611 HB2 ALA 75 HB2 ALA 75 -5.985 0.582 10.753 612 HB3 ALA 75 HB3 ALA 75 -6.262 -1.149 11.141 613 H TYR 76 H TYR 76 -6.409 -0.356 7.273 614 HA TYR 76 HA TYR 76 -6.385 2.456 6.757 615 HB2 TYR 76 HB2 TYR 76 -4.832 0.922 5.677 616 HB3 TYR 76 HB3 TYR 76 -6.134 0.006 4.974 617 HD1 TYR 76 HD1 TYR 76 -3.846 2.847 4.415 618 HD2 TYR 76 HD2 TYR 76 -7.512 0.945 3.149 619 HE1 TYR 76 HE1 TYR 76 -3.520 3.722 2.181 620 HE2 TYR 76 HE2 TYR 76 -7.257 1.939 0.902 621 HH TYR 76 HH TYR 76 -5.916 3.217 -0.485 622 H LEU 77 H LEU 77 -8.609 -0.147 5.702 623 HA LEU 77 HA LEU 77 -10.204 1.649 4.087 624 HB2 LEU 77 HB2 LEU 77 -10.977 -1.097 5.174 625 HB3 LEU 77 HB3 LEU 77 -11.720 -0.259 3.843 626 HG LEU 77 HG LEU 77 -8.780 -1.023 3.766 627 HD11 LEU 77 HD11 LEU 77 -9.401 -3.090 2.631 628 HD12 LEU 77 HD12 LEU 77 -10.043 -3.027 4.275 629 HD13 LEU 77 HD13 LEU 77 -11.119 -2.708 2.905 630 HD21 LEU 77 HD21 LEU 77 -8.958 -0.833 1.413 631 HD22 LEU 77 HD22 LEU 77 -10.725 -0.537 1.516 632 HD23 LEU 77 HD23 LEU 77 -9.575 0.655 2.152 633 H SER 78 H SER 78 -10.686 0.131 7.274 634 HA SER 78 HA SER 78 -13.214 1.248 7.832 635 HB2 SER 78 HB2 SER 78 -11.766 -0.616 9.022 636 HB3 SER 78 HB3 SER 78 -11.122 0.726 9.965 637 HG SER 78 HG SER 78 -13.750 -0.337 9.825 638 H CYS 79 H CYS 79 -9.943 2.697 8.133 639 HA CYS 79 HA CYS 79 -10.909 4.916 9.741 640 HB2 CYS 79 HB2 CYS 79 -8.601 3.860 9.808 641 HB3 CYS 79 HB3 CYS 79 -8.250 4.724 8.289 642 HG CYS 79 HG CYS 79 -9.381 5.994 11.129 643 H GLN 80 H GLN 80 -11.603 4.332 6.538 644 HA GLN 80 HA GLN 80 -10.912 6.332 4.953 645 HB2 GLN 80 HB2 GLN 80 -13.104 6.272 3.924 646 HB3 GLN 80 HB3 GLN 80 -12.461 4.679 4.277 647 HG2 GLN 80 HG2 GLN 80 -14.569 4.299 4.984 648 HG3 GLN 80 HG3 GLN 80 -13.893 4.938 6.485 649 HE21 GLN 80 HE21 GLN 80 -15.956 5.552 7.239 650 HE22 GLN 80 HE22 GLN 80 -16.815 6.938 6.603 651 H LYS 81 H LYS 81 -10.451 8.241 5.353 652 HA LYS 81 HA LYS 81 -12.439 10.185 6.395 653 HB2 LYS 81 HB2 LYS 81 -9.669 9.758 7.459 654 HB3 LYS 81 HB3 LYS 81 -10.409 11.376 7.488 655 HG2 LYS 81 HG2 LYS 81 -12.335 10.529 8.725 656 HG3 LYS 81 HG3 LYS 81 -11.727 8.876 8.633 657 HD2 LYS 81 HD2 LYS 81 -9.672 9.720 9.930 658 HD3 LYS 81 HD3 LYS 81 -10.622 11.211 10.200 659 HE2 LYS 81 HE2 LYS 81 -12.509 9.581 10.984 660 HE3 LYS 81 HE3 LYS 81 -11.244 8.348 11.032 661 HZ1 LYS 81 HZ1 LYS 81 -11.435 10.814 12.632 662 HZ2 LYS 81 HZ2 LYS 81 -11.438 9.264 13.160 663 HZ3 LYS 81 HZ3 LYS 81 -10.042 9.929 12.590 664 HA PRO 82 HA PRO 82 -10.923 11.458 2.312 665 HB2 PRO 82 HB2 PRO 82 -13.014 13.129 1.655 666 HB3 PRO 82 HB3 PRO 82 -13.108 11.355 1.544 667 HG2 PRO 82 HG2 PRO 82 -14.075 13.140 3.766 668 HG3 PRO 82 HG3 PRO 82 -14.953 11.787 3.010 669 HD2 PRO 82 HD2 PRO 82 -13.614 11.574 5.367 670 HD3 PRO 82 HD3 PRO 82 -13.726 10.202 4.222 671 H ASP 83 H ASP 83 -10.777 13.798 1.350 672 HA ASP 83 HA ASP 83 -9.570 15.755 1.459 673 HB2 ASP 83 HB2 ASP 83 -11.885 16.349 2.098 674 HB3 ASP 83 HB3 ASP 83 -11.389 16.338 3.799 675 H THR 84 H THR 84 -8.241 13.658 2.765 676 HA THR 84 HA THR 84 -6.941 14.873 5.117 677 HB THR 84 HB THR 84 -7.925 12.625 5.193 678 HG1 THR 84 HG1 THR 84 -6.303 11.630 6.220 679 HG21 THR 84 HG21 THR 84 -6.784 10.716 4.145 680 HG22 THR 84 HG22 THR 84 -7.592 11.770 2.985 681 HG23 THR 84 HG23 THR 84 -5.824 11.847 3.165 682 H ALA 85 H ALA 85 -6.261 14.578 1.778 683 HA ALA 85 HA ALA 85 -4.502 15.143 0.480 684 HB1 ALA 85 HB1 ALA 85 -4.532 17.238 1.518 685 HB2 ALA 85 HB2 ALA 85 -3.541 16.666 2.886 686 HB3 ALA 85 HB3 ALA 85 -2.849 16.742 1.249 687 H ARG 86 H ARG 86 -3.570 13.451 -0.127 688 HA ARG 86 HA ARG 86 -1.691 11.856 1.533 689 HB2 ARG 86 HB2 ARG 86 -2.210 11.128 -1.341 690 HB3 ARG 86 HB3 ARG 86 -1.847 10.131 0.047 691 HG2 ARG 86 HG2 ARG 86 -3.986 9.493 -0.031 692 HG3 ARG 86 HG3 ARG 86 -4.368 11.029 0.730 693 HD2 ARG 86 HD2 ARG 86 -5.747 11.149 -1.133 694 HD3 ARG 86 HD3 ARG 86 -4.299 11.910 -1.794 695 HE ARG 86 HE ARG 86 -4.300 9.020 -2.153 696 HH11 ARG 86 HH11 ARG 86 -5.137 12.123 -3.740 697 HH12 ARG 86 HH12 ARG 86 -5.723 11.363 -5.174 698 HH21 ARG 86 HH21 ARG 86 -5.321 8.048 -4.070 699 HH22 ARG 86 HH22 ARG 86 -5.599 9.136 -5.418 700 H VAL 87 H VAL 87 0.205 11.080 -0.128 701 HA VAL 87 HA VAL 87 1.340 13.234 -1.638 702 HB VAL 87 HB VAL 87 3.503 13.104 -0.402 703 HG11 VAL 87 HG11 VAL 87 2.979 14.558 1.452 704 HG12 VAL 87 HG12 VAL 87 1.964 14.982 0.077 705 HG13 VAL 87 HG13 VAL 87 1.276 14.071 1.439 706 HG21 VAL 87 HG21 VAL 87 3.183 10.929 0.734 707 HG22 VAL 87 HG22 VAL 87 3.622 12.229 1.845 708 HG23 VAL 87 HG23 VAL 87 1.943 11.661 1.785 709 H ASP 88 H ASP 88 3.402 12.409 -2.628 710 HA ASP 88 HA ASP 88 3.112 9.585 -3.541 711 HB2 ASP 88 HB2 ASP 88 3.135 11.682 -5.095 712 HB3 ASP 88 HB3 ASP 88 4.866 11.730 -4.775 713 H ILE 89 H ILE 89 5.556 8.762 -4.172 714 HA ILE 89 HA ILE 89 6.975 8.380 -1.736 715 HB ILE 89 HB ILE 89 8.817 7.436 -3.220 716 HG12 ILE 89 HG12 ILE 89 7.159 8.547 -5.508 717 HG13 ILE 89 HG13 ILE 89 8.825 8.929 -5.054 718 HG21 ILE 89 HG21 ILE 89 6.151 6.472 -4.247 719 HG22 ILE 89 HG22 ILE 89 7.615 5.544 -3.871 720 HG23 ILE 89 HG23 ILE 89 6.644 6.211 -2.552 721 HD11 ILE 89 HD11 ILE 89 7.819 6.305 -6.182 722 HD12 ILE 89 HD12 ILE 89 8.857 7.504 -6.978 723 HD13 ILE 89 HD13 ILE 89 9.469 6.570 -5.602 724 H TYR 90 H TYR 90 7.317 10.906 -4.159 725 HA TYR 90 HA TYR 90 9.823 11.938 -3.037 726 HB2 TYR 90 HB2 TYR 90 7.885 12.862 -5.178 727 HB3 TYR 90 HB3 TYR 90 9.206 13.877 -4.625 728 HD1 TYR 90 HD1 TYR 90 8.368 10.800 -6.504 729 HD2 TYR 90 HD2 TYR 90 11.531 13.373 -5.080 730 HE1 TYR 90 HE1 TYR 90 9.962 9.629 -7.968 731 HE2 TYR 90 HE2 TYR 90 13.132 12.234 -6.599 732 HH TYR 90 HH TYR 90 12.190 9.485 -8.693 733 H GLY 91 H GLY 91 6.738 11.953 -1.763 734 HA2 GLY 91 HA2 GLY 91 5.899 13.120 0.013 735 HA3 GLY 91 HA3 GLY 91 7.327 14.153 0.010 736 H ASN 92 H ASN 92 5.957 14.097 -3.100 737 HA ASN 92 HA ASN 92 5.155 16.860 -3.062 738 HB2 ASN 92 HB2 ASN 92 3.862 14.956 -5.026 739 HB3 ASN 92 HB3 ASN 92 4.438 16.580 -5.283 740 HD21 ASN 92 HD21 ASN 92 4.815 13.742 -6.521 741 HD22 ASN 92 HD22 ASN 92 6.516 13.732 -6.894 742 H GLU 93 H GLU 93 3.146 17.819 -2.712 743 HA GLU 93 HA GLU 93 1.094 16.188 -1.455 744 HB2 GLU 93 HB2 GLU 93 1.669 19.105 -1.868 745 HB3 GLU 93 HB3 GLU 93 0.011 18.636 -1.876 746 HG2 GLU 93 HG2 GLU 93 0.506 17.363 0.324 747 HG3 GLU 93 HG3 GLU 93 2.067 18.198 0.331 748 H VAL 94 H VAL 94 -0.555 15.323 -2.436 749 HA VAL 94 HA VAL 94 -1.083 15.820 -5.308 750 HB VAL 94 HB VAL 94 -1.611 13.528 -5.592 751 HG11 VAL 94 HG11 VAL 94 0.848 14.285 -5.520 752 HG12 VAL 94 HG12 VAL 94 0.930 13.608 -3.895 753 HG13 VAL 94 HG13 VAL 94 0.597 12.560 -5.255 754 HG21 VAL 94 HG21 VAL 94 -1.442 11.831 -3.842 755 HG22 VAL 94 HG22 VAL 94 -1.059 13.078 -2.655 756 HG23 VAL 94 HG23 VAL 94 -2.662 13.024 -3.396 757 H ASP 95 H ASP 95 -3.698 14.640 -5.523 758 HA ASP 95 HA ASP 95 -5.214 16.741 -3.963 759 HB2 ASP 95 HB2 ASP 95 -5.775 14.816 -6.301 760 HB3 ASP 95 HB3 ASP 95 -7.127 15.414 -5.367 761 H VAL 96 H VAL 96 -7.390 15.804 -3.047 762 HA VAL 96 HA VAL 96 -6.472 13.623 -1.279 763 HB VAL 96 HB VAL 96 -8.153 14.413 0.201 764 HG11 VAL 96 HG11 VAL 96 -7.322 17.056 -0.875 765 HG12 VAL 96 HG12 VAL 96 -7.264 16.422 0.779 766 HG13 VAL 96 HG13 VAL 96 -6.052 15.959 -0.447 767 HG21 VAL 96 HG21 VAL 96 -9.627 16.432 -0.525 768 HG22 VAL 96 HG22 VAL 96 -9.292 15.944 -2.174 769 HG23 VAL 96 HG23 VAL 96 -10.124 14.829 -1.077 770 H VAL 97 H VAL 97 -8.116 12.189 -0.351 771 HA VAL 97 HA VAL 97 -9.450 10.626 -2.407 772 HB VAL 97 HB VAL 97 -9.842 10.329 0.605 773 HG11 VAL 97 HG11 VAL 97 -9.729 8.286 -1.659 774 HG12 VAL 97 HG12 VAL 97 -10.128 7.963 0.047 775 HG13 VAL 97 HG13 VAL 97 -11.217 8.938 -0.947 776 HG21 VAL 97 HG21 VAL 97 -7.444 9.359 -1.003 777 HG22 VAL 97 HG22 VAL 97 -7.437 10.423 0.423 778 HG23 VAL 97 HG23 VAL 97 -7.910 8.748 0.620 779 H THR 98 H THR 98 -11.584 11.079 -3.185 780 HA THR 98 HA THR 98 -13.033 13.267 -2.034 781 HB THR 98 HB THR 98 -14.782 12.271 -3.754 782 HG1 THR 98 HG1 THR 98 -14.016 10.893 -5.179 783 HG21 THR 98 HG21 THR 98 -12.091 13.379 -4.663 784 HG22 THR 98 HG22 THR 98 -13.581 13.352 -5.634 785 HG23 THR 98 HG23 THR 98 -13.506 14.329 -4.161 786 HA PRO 99 HA PRO 99 -15.360 11.205 0.994 787 HB2 PRO 99 HB2 PRO 99 -18.005 12.028 0.611 788 HB3 PRO 99 HB3 PRO 99 -16.705 12.957 1.417 789 HG2 PRO 99 HG2 PRO 99 -17.634 13.140 -1.457 790 HG3 PRO 99 HG3 PRO 99 -17.233 14.473 -0.323 791 HD2 PRO 99 HD2 PRO 99 -15.468 13.677 -2.182 792 HD3 PRO 99 HD3 PRO 99 -14.916 14.097 -0.535 793 H GLU 100 H GLU 100 -17.223 10.772 -2.137 794 HA GLU 100 HA GLU 100 -18.397 8.383 -1.117 795 HB2 GLU 100 HB2 GLU 100 -18.072 9.374 -3.953 796 HB3 GLU 100 HB3 GLU 100 -18.934 7.903 -3.505 797 HG2 GLU 100 HG2 GLU 100 -20.085 9.661 -1.730 798 HG3 GLU 100 HG3 GLU 100 -19.713 10.767 -3.059 799 H GLN 101 H GLN 101 -15.392 8.932 -2.968 800 HA GLN 101 HA GLN 101 -14.903 6.104 -3.334 801 HB2 GLN 101 HB2 GLN 101 -13.057 8.516 -3.507 802 HB3 GLN 101 HB3 GLN 101 -12.594 6.853 -3.920 803 HG2 GLN 101 HG2 GLN 101 -14.627 6.842 -5.516 804 HG3 GLN 101 HG3 GLN 101 -14.705 8.569 -5.263 805 HE21 GLN 101 HE21 GLN 101 -13.568 6.308 -7.417 806 HE22 GLN 101 HE22 GLN 101 -12.223 7.209 -8.088 807 H ALA 102 H ALA 102 -14.289 8.420 -0.724 808 HA ALA 102 HA ALA 102 -12.299 6.821 0.595 809 HB1 ALA 102 HB1 ALA 102 -14.164 8.984 1.722 810 HB2 ALA 102 HB2 ALA 102 -12.795 8.260 2.574 811 HB3 ALA 102 HB3 ALA 102 -12.513 9.215 1.117 812 H LYS 103 H LYS 103 -15.857 7.305 1.138 813 HA LYS 103 HA LYS 103 -16.026 5.233 3.066 814 HB2 LYS 103 HB2 LYS 103 -18.399 5.342 2.925 815 HB3 LYS 103 HB3 LYS 103 -17.764 6.985 2.807 816 HG2 LYS 103 HG2 LYS 103 -18.024 6.902 0.376 817 HG3 LYS 103 HG3 LYS 103 -18.697 5.266 0.444 818 HD2 LYS 103 HD2 LYS 103 -19.944 7.749 1.667 819 HD3 LYS 103 HD3 LYS 103 -20.339 7.038 0.090 820 HE2 LYS 103 HE2 LYS 103 -21.049 4.934 1.193 821 HE3 LYS 103 HE3 LYS 103 -20.730 5.660 2.781 822 HZ1 LYS 103 HZ1 LYS 103 -22.388 7.318 2.313 823 HZ2 LYS 103 HZ2 LYS 103 -22.627 6.771 0.800 824 HZ3 LYS 103 HZ3 LYS 103 -23.098 5.856 2.080 825 H TYR 104 H TYR 104 -16.082 5.028 -0.429 826 HA TYR 104 HA TYR 104 -17.249 2.567 -0.825 827 HB2 TYR 104 HB2 TYR 104 -16.432 4.243 -2.540 828 HB3 TYR 104 HB3 TYR 104 -14.825 3.593 -2.356 829 HD1 TYR 104 HD1 TYR 104 -18.367 2.614 -3.074 830 HD2 TYR 104 HD2 TYR 104 -14.205 1.771 -3.849 831 HE1 TYR 104 HE1 TYR 104 -19.021 1.100 -4.906 832 HE2 TYR 104 HE2 TYR 104 -14.862 0.230 -5.666 833 HH TYR 104 HH TYR 104 -18.232 -0.090 -6.763 834 H ALA 105 H ALA 105 -14.134 3.285 0.627 835 HA ALA 105 HA ALA 105 -12.666 0.920 0.280 836 HB1 ALA 105 HB1 ALA 105 -11.834 2.999 1.331 837 HB2 ALA 105 HB2 ALA 105 -12.917 2.727 2.724 838 HB3 ALA 105 HB3 ALA 105 -11.602 1.606 2.386 839 H TYR 106 H TYR 106 -15.514 1.564 2.342 840 HA TYR 106 HA TYR 106 -15.267 -0.593 4.079 841 HB2 TYR 106 HB2 TYR 106 -17.412 -0.074 4.783 842 HB3 TYR 106 HB3 TYR 106 -16.984 1.439 4.016 843 HD1 TYR 106 HD1 TYR 106 -17.551 1.164 1.183 844 HD2 TYR 106 HD2 TYR 106 -19.612 -0.777 4.429 845 HE1 TYR 106 HE1 TYR 106 -19.536 1.024 -0.189 846 HE2 TYR 106 HE2 TYR 106 -21.516 -1.208 2.947 847 HH TYR 106 HH TYR 106 -21.653 0.150 -0.419 848 H GLN 107 H GLN 107 -16.319 -0.664 0.714 849 HA GLN 107 HA GLN 107 -17.690 -3.185 0.834 850 HB2 GLN 107 HB2 GLN 107 -16.237 -1.813 -1.466 851 HB3 GLN 107 HB3 GLN 107 -17.196 -3.301 -1.602 852 HG2 GLN 107 HG2 GLN 107 -19.016 -1.744 -0.355 853 HG3 GLN 107 HG3 GLN 107 -18.091 -0.475 -1.188 854 HE21 GLN 107 HE21 GLN 107 -17.596 -1.344 -3.688 855 HE22 GLN 107 HE22 GLN 107 -18.992 -1.952 -4.497 856 H ARG 108 H ARG 108 -14.337 -2.248 0.033 857 HA ARG 108 HA ARG 108 -13.390 -4.906 -0.255 858 HB2 ARG 108 HB2 ARG 108 -11.706 -2.553 0.713 859 HB3 ARG 108 HB3 ARG 108 -11.168 -3.943 -0.224 860 HG2 ARG 108 HG2 ARG 108 -13.008 -1.711 -1.230 861 HG3 ARG 108 HG3 ARG 108 -11.265 -1.805 -1.487 862 HD2 ARG 108 HD2 ARG 108 -11.633 -4.092 -2.599 863 HD3 ARG 108 HD3 ARG 108 -13.353 -3.748 -2.565 864 HE ARG 108 HE ARG 108 -13.042 -1.897 -4.051 865 HH11 ARG 108 HH11 ARG 108 -10.116 -3.980 -3.828 866 HH12 ARG 108 HH12 ARG 108 -9.384 -3.240 -5.208 867 HH21 ARG 108 HH21 ARG 108 -12.012 -1.048 -5.952 868 HH22 ARG 108 HH22 ARG 108 -10.629 -1.848 -6.600 869 H TYR 109 H TYR 109 -13.943 -2.961 2.668 870 HA TYR 109 HA TYR 109 -12.316 -4.638 4.359 871 HB2 TYR 109 HB2 TYR 109 -13.130 -2.346 4.928 872 HB3 TYR 109 HB3 TYR 109 -14.757 -2.946 5.090 873 HD1 TYR 109 HD1 TYR 109 -15.032 -5.085 6.756 874 HD2 TYR 109 HD2 TYR 109 -11.858 -2.154 6.926 875 HE1 TYR 109 HE1 TYR 109 -14.536 -5.779 9.056 876 HE2 TYR 109 HE2 TYR 109 -11.449 -2.771 9.289 877 HH TYR 109 HH TYR 109 -13.060 -5.504 10.901 878 H GLN 110 H GLN 110 -15.857 -4.523 3.640 879 HA GLN 110 HA GLN 110 -16.397 -6.870 5.172 880 HB2 GLN 110 HB2 GLN 110 -18.619 -6.900 4.266 881 HB3 GLN 110 HB3 GLN 110 -18.193 -5.281 4.795 882 HG2 GLN 110 HG2 GLN 110 -17.814 -4.597 2.475 883 HG3 GLN 110 HG3 GLN 110 -18.149 -6.231 1.892 884 HE21 GLN 110 HE21 GLN 110 -19.561 -3.166 2.591 885 HE22 GLN 110 HE22 GLN 110 -21.197 -3.702 2.225 886 H GLU 111 H GLU 111 -15.304 -6.457 1.868 887 HA GLU 111 HA GLU 111 -16.232 -8.901 0.812 888 HB2 GLU 111 HB2 GLU 111 -14.939 -8.521 -0.905 889 HB3 GLU 111 HB3 GLU 111 -14.936 -6.862 -0.289 890 HG2 GLU 111 HG2 GLU 111 -12.639 -7.580 0.680 891 HG3 GLU 111 HG3 GLU 111 -12.760 -8.952 -0.411 892 H ARG 112 H ARG 112 -13.357 -8.198 2.434 893 HA ARG 112 HA ARG 112 -12.619 -11.106 2.811 894 HB2 ARG 112 HB2 ARG 112 -10.996 -8.589 3.224 895 HB3 ARG 112 HB3 ARG 112 -10.459 -10.181 3.718 896 HG2 ARG 112 HG2 ARG 112 -11.205 -10.559 1.006 897 HG3 ARG 112 HG3 ARG 112 -10.396 -8.983 1.045 898 HD2 ARG 112 HD2 ARG 112 -8.546 -10.168 2.422 899 HD3 ARG 112 HD3 ARG 112 -9.340 -11.675 1.981 900 HE ARG 112 HE ARG 112 -8.844 -10.139 -0.375 901 HH11 ARG 112 HH11 ARG 112 -7.222 -12.335 1.907 902 HH12 ARG 112 HH12 ARG 112 -5.740 -12.422 1.012 903 HH21 ARG 112 HH21 ARG 112 -6.888 -10.238 -1.550 904 HH22 ARG 112 HH22 ARG 112 -5.670 -11.427 -1.160 905 H TYR 113 H TYR 113 -13.508 -8.364 4.862 906 HA TYR 113 HA TYR 113 -13.073 -10.032 7.286 907 HB2 TYR 113 HB2 TYR 113 -13.220 -7.050 7.199 908 HB3 TYR 113 HB3 TYR 113 -12.582 -8.064 8.492 909 HD1 TYR 113 HD1 TYR 113 -11.560 -5.683 6.359 910 HD2 TYR 113 HD2 TYR 113 -10.643 -9.814 7.168 911 HE1 TYR 113 HE1 TYR 113 -9.343 -5.386 5.307 912 HE2 TYR 113 HE2 TYR 113 -8.437 -9.536 6.092 913 HH TYR 113 HH TYR 113 -7.367 -6.376 4.748 914 H GLY 114 H GLY 114 -15.350 -10.060 5.505 915 HA2 GLY 114 HA2 GLY 114 -17.515 -9.917 7.434 916 HA3 GLY 114 HA3 GLY 114 -17.672 -8.720 6.121 917 H ASN 115 H ASN 115 -19.692 -10.332 5.872 918 HA ASN 115 HA ASN 115 -19.099 -11.992 3.559 919 HB2 ASN 115 HB2 ASN 115 -18.715 -13.603 5.426 920 HB3 ASN 115 HB3 ASN 115 -20.359 -13.268 6.015 921 HD21 ASN 115 HD21 ASN 115 -21.141 -15.392 5.675 922 HD22 ASN 115 HD22 ASN 115 -21.308 -16.072 4.062 923 H LYS 116 H LYS 116 -20.680 -11.275 2.168 924 HA LYS 116 HA LYS 116 -23.429 -11.386 2.829 925 HB2 LYS 116 HB2 LYS 116 -22.114 -8.834 3.311 926 HB3 LYS 116 HB3 LYS 116 -23.131 -8.645 1.896 927 HG2 LYS 116 HG2 LYS 116 -24.091 -9.808 4.543 928 HG3 LYS 116 HG3 LYS 116 -24.236 -8.106 4.082 929 HD2 LYS 116 HD2 LYS 116 -25.719 -8.662 2.219 930 HD3 LYS 116 HD3 LYS 116 -25.471 -10.394 2.491 931 HE2 LYS 116 HE2 LYS 116 -27.593 -9.793 3.415 932 HE3 LYS 116 HE3 LYS 116 -26.484 -10.249 4.713 933 HZ1 LYS 116 HZ1 LYS 116 -26.193 -7.892 5.207 934 HZ2 LYS 116 HZ2 LYS 116 -27.187 -7.476 3.957 935 HZ3 LYS 116 HZ3 LYS 116 -27.782 -8.301 5.238 936 H LYS 117 H LYS 117 -24.696 -10.981 0.821 937 HA LYS 117 HA LYS 117 -23.354 -10.367 -1.653 938 HB2 LYS 117 HB2 LYS 117 -22.776 -12.843 -1.305 939 HB3 LYS 117 HB3 LYS 117 -24.506 -13.168 -1.254 940 HG2 LYS 117 HG2 LYS 117 -24.701 -12.122 -3.569 941 HG3 LYS 117 HG3 LYS 117 -22.939 -11.980 -3.583 942 HD2 LYS 117 HD2 LYS 117 -22.846 -14.528 -3.206 943 HD3 LYS 117 HD3 LYS 117 -24.603 -14.531 -3.382 944 HE2 LYS 117 HE2 LYS 117 -23.840 -15.118 -5.503 945 HE3 LYS 117 HE3 LYS 117 -24.255 -13.410 -5.673 946 HZ1 LYS 117 HZ1 LYS 117 -21.856 -12.933 -5.468 947 HZ2 LYS 117 HZ2 LYS 117 -21.563 -14.545 -5.245 948 HZ3 LYS 117 HZ3 LYS 117 -22.152 -14.028 -6.679 949 H SER 118 H SER 118 -24.915 -9.623 -3.036 950 HA SER 118 HA SER 118 -27.624 -10.488 -3.049 951 HB2 SER 118 HB2 SER 118 -27.436 -8.904 -0.969 952 HB3 SER 118 HB3 SER 118 -27.300 -7.627 -2.169 953 HG SER 118 HG SER 118 -29.373 -8.120 -2.899 954 H GLN 119 H GLN 119 -25.844 -7.399 -3.587 955 HA GLN 119 HA GLN 119 -25.125 -6.257 -5.293 956 HB2 GLN 119 HB2 GLN 119 -25.783 -8.545 -7.173 957 HB3 GLN 119 HB3 GLN 119 -24.828 -7.101 -7.505 958 HG2 GLN 119 HG2 GLN 119 -23.133 -7.844 -5.848 959 HG3 GLN 119 HG3 GLN 119 -24.067 -9.337 -5.593 960 HE21 GLN 119 HE21 GLN 119 -21.652 -10.007 -6.406 961 HE22 GLN 119 HE22 GLN 119 -21.538 -10.154 -8.155 962 H ASP 120 H ASP 120 -27.989 -8.147 -6.155 963 HA ASP 120 HA ASP 120 -30.036 -7.741 -6.788 964 HB2 ASP 120 HB2 ASP 120 -29.710 -4.796 -6.299 965 HB3 ASP 120 HB3 ASP 120 -31.187 -5.761 -6.293 966 H LEU 121 H LEU 121 -28.625 -4.809 -7.960 967 HA LEU 121 HA LEU 121 -28.064 -3.945 -9.981 968 HB2 LEU 121 HB2 LEU 121 -27.929 -6.743 -11.127 969 HB3 LEU 121 HB3 LEU 121 -27.190 -5.299 -11.771 970 HG LEU 121 HG LEU 121 -26.394 -6.694 -9.203 971 HD11 LEU 121 HD11 LEU 121 -24.312 -7.179 -10.428 972 HD12 LEU 121 HD12 LEU 121 -25.715 -7.861 -11.274 973 HD13 LEU 121 HD13 LEU 121 -24.956 -6.374 -11.870 974 HD21 LEU 121 HD21 LEU 121 -26.056 -4.272 -8.944 975 HD22 LEU 121 HD22 LEU 121 -24.502 -5.080 -9.176 976 HD23 LEU 121 HD23 LEU 121 -25.239 -4.199 -10.526 977 H LYS 122 H LYS 122 -28.660 -4.408 -12.563 978 HA LYS 122 HA LYS 122 -31.467 -4.765 -13.033 979 HB2 LYS 122 HB2 LYS 122 -31.234 -2.354 -12.181 980 HB3 LYS 122 HB3 LYS 122 -30.084 -2.078 -13.505 981 HG2 LYS 122 HG2 LYS 122 -31.999 -2.778 -15.096 982 HG3 LYS 122 HG3 LYS 122 -33.064 -2.736 -13.700 983 HD2 LYS 122 HD2 LYS 122 -33.252 -0.500 -13.841 984 HD3 LYS 122 HD3 LYS 122 -31.513 -0.254 -13.803 985 HE2 LYS 122 HE2 LYS 122 -33.159 -0.904 -16.288 986 HE3 LYS 122 HE3 LYS 122 -32.563 0.699 -15.836 987 HZ1 LYS 122 HZ1 LYS 122 -30.896 -1.637 -16.571 988 HZ2 LYS 122 HZ2 LYS 122 -31.132 -0.334 -17.469 989 HZ3 LYS 122 HZ3 LYS 122 -30.281 -0.184 -16.076 Start of MODEL 14 1 H1 GLY 1 H GLY 1 21.120 -15.327 16.128 2 HA2 GLY 1 HA2 GLY 1 23.501 -15.304 15.600 3 HA3 GLY 1 HA3 GLY 1 22.550 -14.762 14.200 4 H SER 2 H SER 2 23.097 -12.788 13.344 5 HA SER 2 HA SER 2 24.389 -10.711 15.011 6 HB2 SER 2 HB2 SER 2 25.468 -10.239 12.578 7 HB3 SER 2 HB3 SER 2 26.275 -11.163 13.851 8 HG SER 2 HG SER 2 24.805 -12.236 11.667 9 H ASN 3 H ASN 3 24.016 -8.472 13.809 10 HA ASN 3 HA ASN 3 21.315 -8.529 12.514 11 HB2 ASN 3 HB2 ASN 3 22.192 -6.131 14.075 12 HB3 ASN 3 HB3 ASN 3 20.585 -6.742 13.764 13 HD21 ASN 3 HD21 ASN 3 23.389 -6.753 15.745 14 HD22 ASN 3 HD22 ASN 3 22.714 -7.692 17.103 15 H GLN 4 H GLN 4 22.262 -8.706 10.571 16 HA GLN 4 HA GLN 4 24.127 -6.542 9.704 17 HB2 GLN 4 HB2 GLN 4 23.646 -9.327 8.604 18 HB3 GLN 4 HB3 GLN 4 24.644 -8.085 7.842 19 HG2 GLN 4 HG2 GLN 4 26.153 -8.206 9.954 20 HG3 GLN 4 HG3 GLN 4 25.245 -9.681 10.324 21 HE21 GLN 4 HE21 GLN 4 28.229 -9.326 9.307 22 HE22 GLN 4 HE22 GLN 4 28.185 -10.403 7.927 23 H GLN 5 H GLN 5 21.939 -8.668 7.796 24 HA GLN 5 HA GLN 5 20.653 -6.234 6.690 25 HB2 GLN 5 HB2 GLN 5 21.320 -8.985 5.664 26 HB3 GLN 5 HB3 GLN 5 19.831 -8.255 5.086 27 HG2 GLN 5 HG2 GLN 5 21.283 -7.574 3.474 28 HG3 GLN 5 HG3 GLN 5 21.304 -6.163 4.537 29 HE21 GLN 5 HE21 GLN 5 23.271 -6.257 2.806 30 HE22 GLN 5 HE22 GLN 5 24.784 -6.738 3.504 31 H LEU 6 H LEU 6 18.511 -5.991 6.611 32 HA LEU 6 HA LEU 6 16.861 -6.945 8.690 33 HB2 LEU 6 HB2 LEU 6 16.044 -5.665 6.039 34 HB3 LEU 6 HB3 LEU 6 15.067 -5.720 7.496 35 HG LEU 6 HG LEU 6 17.685 -4.205 7.118 36 HD11 LEU 6 HD11 LEU 6 16.253 -2.219 7.021 37 HD12 LEU 6 HD12 LEU 6 15.812 -3.369 5.758 38 HD13 LEU 6 HD13 LEU 6 14.802 -3.226 7.213 39 HD21 LEU 6 HD21 LEU 6 17.017 -3.000 9.225 40 HD22 LEU 6 HD22 LEU 6 15.788 -4.236 9.505 41 HD23 LEU 6 HD23 LEU 6 17.505 -4.689 9.482 42 H ASN 7 H ASN 7 16.442 -7.424 5.185 43 HA ASN 7 HA ASN 7 15.467 -8.994 3.908 44 HB2 ASN 7 HB2 ASN 7 17.336 -10.363 5.142 45 HB3 ASN 7 HB3 ASN 7 15.983 -11.120 5.970 46 HD21 ASN 7 HD21 ASN 7 17.938 -11.155 3.088 47 HD22 ASN 7 HD22 ASN 7 17.033 -12.361 2.270 48 H ALA 8 H ALA 8 13.744 -11.100 4.302 49 HA ALA 8 HA ALA 8 11.328 -9.730 4.816 50 HB1 ALA 8 HB1 ALA 8 12.031 -11.994 3.476 51 HB2 ALA 8 HB2 ALA 8 11.559 -12.741 4.981 52 HB3 ALA 8 HB3 ALA 8 10.385 -11.738 4.101 53 H THR 9 H THR 9 10.363 -9.333 6.747 54 HA THR 9 HA THR 9 11.524 -10.305 9.220 55 HB THR 9 HB THR 9 9.177 -9.505 10.094 56 HG1 THR 9 HG1 THR 9 9.251 -8.090 7.603 57 HG21 THR 9 HG21 THR 9 11.111 -8.393 10.751 58 HG22 THR 9 HG22 THR 9 11.341 -7.621 9.183 59 HG23 THR 9 HG23 THR 9 9.949 -7.170 10.217 60 H LYS 10 H LYS 10 8.332 -10.897 7.625 61 HA LYS 10 HA LYS 10 8.461 -13.720 8.625 62 HB2 LYS 10 HB2 LYS 10 7.162 -11.945 10.088 63 HB3 LYS 10 HB3 LYS 10 5.919 -12.099 8.839 64 HG2 LYS 10 HG2 LYS 10 6.242 -14.698 9.285 65 HG3 LYS 10 HG3 LYS 10 7.034 -14.134 10.761 66 HD2 LYS 10 HD2 LYS 10 4.910 -12.825 11.287 67 HD3 LYS 10 HD3 LYS 10 4.180 -13.573 9.864 68 HE2 LYS 10 HE2 LYS 10 3.655 -15.376 11.158 69 HE3 LYS 10 HE3 LYS 10 5.395 -15.727 11.151 70 HZ1 LYS 10 HZ1 LYS 10 5.477 -14.113 13.091 71 HZ2 LYS 10 HZ2 LYS 10 3.844 -14.348 13.206 72 HZ3 LYS 10 HZ3 LYS 10 4.859 -15.595 13.392 73 H LYS 11 H LYS 11 6.608 -11.532 6.351 74 HA LYS 11 HA LYS 11 5.910 -13.979 4.791 75 HB2 LYS 11 HB2 LYS 11 4.365 -11.541 5.560 76 HB3 LYS 11 HB3 LYS 11 4.062 -12.246 3.962 77 HG2 LYS 11 HG2 LYS 11 2.459 -13.098 5.349 78 HG3 LYS 11 HG3 LYS 11 3.636 -14.425 5.220 79 HD2 LYS 11 HD2 LYS 11 4.561 -13.852 7.407 80 HD3 LYS 11 HD3 LYS 11 3.500 -12.433 7.539 81 HE2 LYS 11 HE2 LYS 11 2.739 -15.364 7.466 82 HE3 LYS 11 HE3 LYS 11 2.654 -14.273 8.847 83 HZ1 LYS 11 HZ1 LYS 11 0.951 -14.244 6.441 84 HZ2 LYS 11 HZ2 LYS 11 0.478 -14.406 8.007 85 HZ3 LYS 11 HZ3 LYS 11 1.007 -12.961 7.441 86 H ASP 12 H ASP 12 5.985 -13.838 2.637 87 HA ASP 12 HA ASP 12 8.098 -12.512 1.376 88 HB2 ASP 12 HB2 ASP 12 7.607 -13.844 -0.400 89 HB3 ASP 12 HB3 ASP 12 6.882 -14.775 0.876 90 H LYS 13 H LYS 13 4.609 -12.075 1.290 91 HA LYS 13 HA LYS 13 4.618 -9.857 -0.451 92 HB2 LYS 13 HB2 LYS 13 2.687 -10.412 1.818 93 HB3 LYS 13 HB3 LYS 13 2.353 -9.370 0.438 94 HG2 LYS 13 HG2 LYS 13 2.649 -12.391 0.470 95 HG3 LYS 13 HG3 LYS 13 1.206 -11.477 0.173 96 HD2 LYS 13 HD2 LYS 13 2.682 -10.543 -1.920 97 HD3 LYS 13 HD3 LYS 13 3.421 -12.147 -1.723 98 HE2 LYS 13 HE2 LYS 13 0.980 -13.034 -1.689 99 HE3 LYS 13 HE3 LYS 13 0.522 -11.410 -2.233 100 HZ1 LYS 13 HZ1 LYS 13 2.239 -13.337 -3.708 101 HZ2 LYS 13 HZ2 LYS 13 0.728 -12.978 -4.081 102 HZ3 LYS 13 HZ3 LYS 13 1.859 -11.819 -4.251 103 H LEU 14 H LEU 14 4.860 -9.815 3.203 104 HA LEU 14 HA LEU 14 4.843 -6.938 3.211 105 HB2 LEU 14 HB2 LEU 14 6.124 -8.564 5.394 106 HB3 LEU 14 HB3 LEU 14 5.316 -7.005 5.505 107 HG LEU 14 HG LEU 14 4.092 -9.692 4.972 108 HD11 LEU 14 HD11 LEU 14 3.100 -9.616 7.145 109 HD12 LEU 14 HD12 LEU 14 4.833 -9.277 7.304 110 HD13 LEU 14 HD13 LEU 14 3.663 -7.945 7.389 111 HD21 LEU 14 HD21 LEU 14 1.885 -8.227 5.434 112 HD22 LEU 14 HD22 LEU 14 2.896 -7.116 4.457 113 HD23 LEU 14 HD23 LEU 14 2.537 -8.733 3.859 114 H GLN 15 H GLN 15 7.394 -9.257 2.638 115 HA GLN 15 HA GLN 15 9.629 -7.640 3.375 116 HB2 GLN 15 HB2 GLN 15 9.723 -10.104 2.766 117 HB3 GLN 15 HB3 GLN 15 9.387 -9.717 1.125 118 HG2 GLN 15 HG2 GLN 15 11.493 -8.115 1.225 119 HG3 GLN 15 HG3 GLN 15 11.909 -9.025 2.659 120 HE21 GLN 15 HE21 GLN 15 12.061 -8.897 -0.790 121 HE22 GLN 15 HE22 GLN 15 12.630 -10.548 -1.025 122 H VAL 16 H VAL 16 8.024 -7.792 0.161 123 HA VAL 16 HA VAL 16 9.746 -5.837 -0.995 124 HB VAL 16 HB VAL 16 8.286 -5.904 -2.898 125 HG11 VAL 16 HG11 VAL 16 7.964 -8.689 -1.651 126 HG12 VAL 16 HG12 VAL 16 7.964 -8.257 -3.356 127 HG13 VAL 16 HG13 VAL 16 9.460 -8.101 -2.414 128 HG21 VAL 16 HG21 VAL 16 6.071 -5.571 -1.897 129 HG22 VAL 16 HG22 VAL 16 6.080 -7.077 -2.837 130 HG23 VAL 16 HG23 VAL 16 6.206 -7.153 -1.095 131 H ILE 17 H ILE 17 6.807 -5.491 0.980 132 HA ILE 17 HA ILE 17 6.421 -2.715 0.325 133 HB ILE 17 HB ILE 17 5.374 -4.290 2.709 134 HG12 ILE 17 HG12 ILE 17 3.926 -3.724 0.066 135 HG13 ILE 17 HG13 ILE 17 4.627 -5.283 0.483 136 HG21 ILE 17 HG21 ILE 17 5.277 -1.824 3.073 137 HG22 ILE 17 HG22 ILE 17 4.798 -1.570 1.412 138 HG23 ILE 17 HG23 ILE 17 3.667 -2.347 2.506 139 HD11 ILE 17 HD11 ILE 17 2.505 -5.687 1.342 140 HD12 ILE 17 HD12 ILE 17 3.216 -4.894 2.750 141 HD13 ILE 17 HD13 ILE 17 2.210 -3.972 1.619 142 H ASP 18 H ASP 18 8.078 -4.465 2.897 143 HA ASP 18 HA ASP 18 8.710 -2.265 4.625 144 HB2 ASP 18 HB2 ASP 18 8.944 -4.714 5.096 145 HB3 ASP 18 HB3 ASP 18 10.301 -4.713 3.962 146 H TRP 19 H TRP 19 10.193 -3.482 1.630 147 HA TRP 19 HA TRP 19 12.725 -2.021 1.747 148 HB2 TRP 19 HB2 TRP 19 12.218 -3.830 0.021 149 HB3 TRP 19 HB3 TRP 19 11.032 -2.798 -0.711 150 HD1 TRP 19 HD1 TRP 19 11.865 -0.785 -2.228 151 HE1 TRP 19 HE1 TRP 19 13.895 -0.640 -3.745 152 HE3 TRP 19 HE3 TRP 19 14.930 -3.919 0.350 153 HZ2 TRP 19 HZ2 TRP 19 16.639 -1.697 -3.808 154 HZ3 TRP 19 HZ3 TRP 19 17.223 -4.414 -0.490 155 HH2 TRP 19 HH2 TRP 19 18.087 -3.283 -2.477 156 H LEU 20 H LEU 20 9.826 -0.924 -0.039 157 HA LEU 20 HA LEU 20 11.040 1.727 -0.302 158 HB2 LEU 20 HB2 LEU 20 8.849 1.977 -1.666 159 HB3 LEU 20 HB3 LEU 20 9.528 0.397 -1.913 160 HG LEU 20 HG LEU 20 7.894 -0.249 0.190 161 HD11 LEU 20 HD11 LEU 20 5.774 0.668 0.011 162 HD12 LEU 20 HD12 LEU 20 6.824 2.079 0.007 163 HD13 LEU 20 HD13 LEU 20 6.142 1.486 -1.513 164 HD21 LEU 20 HD21 LEU 20 6.283 -1.256 -1.451 165 HD22 LEU 20 HD22 LEU 20 7.066 -0.283 -2.648 166 HD23 LEU 20 HD23 LEU 20 7.999 -1.584 -1.955 167 H ILE 21 H ILE 21 9.340 0.885 2.078 168 HA ILE 21 HA ILE 21 8.416 3.395 2.792 169 HB ILE 21 HB ILE 21 9.424 0.949 4.197 170 HG12 ILE 21 HG12 ILE 21 6.579 2.100 3.880 171 HG13 ILE 21 HG13 ILE 21 7.246 0.973 2.772 172 HG21 ILE 21 HG21 ILE 21 8.563 1.597 6.226 173 HG22 ILE 21 HG22 ILE 21 9.674 2.942 5.771 174 HG23 ILE 21 HG23 ILE 21 7.856 3.041 5.602 175 HD11 ILE 21 HD11 ILE 21 5.768 -0.114 4.360 176 HD12 ILE 21 HD12 ILE 21 7.415 -0.662 4.685 177 HD13 ILE 21 HD13 ILE 21 6.686 0.570 5.721 178 H GLU 22 H GLU 22 11.655 2.238 3.352 179 HA GLU 22 HA GLU 22 12.913 4.306 4.737 180 HB2 GLU 22 HB2 GLU 22 12.856 1.509 3.898 181 HB3 GLU 22 HB3 GLU 22 13.862 2.092 2.761 182 HG2 GLU 22 HG2 GLU 22 14.832 0.828 4.613 183 HG3 GLU 22 HG3 GLU 22 15.485 2.435 4.892 184 H ASN 23 H ASN 23 12.814 4.889 2.032 185 HA ASN 23 HA ASN 23 15.074 4.516 0.047 186 HB2 ASN 23 HB2 ASN 23 12.595 2.783 0.080 187 HB3 ASN 23 HB3 ASN 23 13.034 3.461 -1.319 188 HD21 ASN 23 HD21 ASN 23 14.703 2.422 1.163 189 HD22 ASN 23 HD22 ASN 23 14.868 0.723 0.937 190 H PHE 24 H PHE 24 11.904 5.382 0.732 191 HA PHE 24 HA PHE 24 12.077 7.783 -0.861 192 HB2 PHE 24 HB2 PHE 24 10.219 5.516 -1.443 193 HB3 PHE 24 HB3 PHE 24 9.453 7.067 -1.234 194 HD1 PHE 24 HD1 PHE 24 10.868 9.122 -2.457 195 HD2 PHE 24 HD2 PHE 24 10.848 4.989 -3.759 196 HE1 PHE 24 HE1 PHE 24 11.218 9.853 -4.797 197 HE2 PHE 24 HE2 PHE 24 11.240 5.748 -6.068 198 HZ PHE 24 HZ PHE 24 11.491 8.153 -6.594 199 HA PRO 25 HA PRO 25 11.239 7.453 3.825 200 HB2 PRO 25 HB2 PRO 25 13.359 8.902 4.742 201 HB3 PRO 25 HB3 PRO 25 13.595 7.209 4.177 202 HG2 PRO 25 HG2 PRO 25 13.954 9.767 2.609 203 HG3 PRO 25 HG3 PRO 25 15.158 8.440 2.908 204 HD2 PRO 25 HD2 PRO 25 13.744 8.335 0.649 205 HD3 PRO 25 HD3 PRO 25 13.979 6.937 1.652 206 H ASN 26 H ASN 26 10.206 9.035 1.486 207 HA ASN 26 HA ASN 26 10.084 11.852 2.264 208 HB2 ASN 26 HB2 ASN 26 8.938 10.347 -0.146 209 HB3 ASN 26 HB3 ASN 26 8.801 12.061 0.137 210 HD21 ASN 26 HD21 ASN 26 11.898 10.588 0.858 211 HD22 ASN 26 HD22 ASN 26 12.727 11.088 -0.602 212 H ALA 27 H ALA 27 8.195 8.866 2.450 213 HA ALA 27 HA ALA 27 6.176 9.763 4.257 214 HB1 ALA 27 HB1 ALA 27 4.300 9.593 2.404 215 HB2 ALA 27 HB2 ALA 27 5.198 11.112 2.593 216 HB3 ALA 27 HB3 ALA 27 5.641 9.996 1.284 217 H PHE 28 H PHE 28 5.931 7.504 5.152 218 HA PHE 28 HA PHE 28 4.450 5.669 3.592 219 HB2 PHE 28 HB2 PHE 28 7.304 5.519 3.113 220 HB3 PHE 28 HB3 PHE 28 6.786 4.100 3.933 221 HD1 PHE 28 HD1 PHE 28 4.342 3.126 2.880 222 HD2 PHE 28 HD2 PHE 28 7.386 5.317 0.771 223 HE1 PHE 28 HE1 PHE 28 3.205 2.625 0.742 224 HE2 PHE 28 HE2 PHE 28 6.186 4.901 -1.365 225 HZ PHE 28 HZ PHE 28 4.041 3.566 -1.375 226 H PHE 29 H PHE 29 4.253 3.400 4.783 227 HA PHE 29 HA PHE 29 5.123 3.420 7.576 228 HB2 PHE 29 HB2 PHE 29 2.216 3.553 6.704 229 HB3 PHE 29 HB3 PHE 29 2.715 3.002 8.300 230 HD1 PHE 29 HD1 PHE 29 2.135 5.898 6.154 231 HD2 PHE 29 HD2 PHE 29 4.091 4.541 9.684 232 HE1 PHE 29 HE1 PHE 29 2.337 8.255 6.921 233 HE2 PHE 29 HE2 PHE 29 4.042 6.888 10.637 234 HZ PHE 29 HZ PHE 29 3.185 8.745 9.201 235 H LYS 30 H LYS 30 5.493 1.541 8.254 236 HA LYS 30 HA LYS 30 4.983 -0.304 7.026 237 HB2 LYS 30 HB2 LYS 30 6.300 -2.425 8.484 238 HB3 LYS 30 HB3 LYS 30 7.273 -1.068 8.081 239 HG2 LYS 30 HG2 LYS 30 5.770 0.420 9.466 240 HG3 LYS 30 HG3 LYS 30 8.521 -3.264 11.615 241 HD2 LYS 30 HD2 LYS 30 7.956 0.548 9.979 242 HD3 LYS 30 HD3 LYS 30 8.406 -0.215 11.509 243 HE2 LYS 30 HE2 LYS 30 9.254 -2.140 9.665 244 HE3 LYS 30 HE3 LYS 30 9.641 -0.631 8.817 245 HZ1 LYS 30 HZ1 LYS 30 10.432 -1.121 11.601 246 HZ2 LYS 30 HZ2 LYS 30 11.411 -1.488 10.327 247 HZ3 LYS 30 HZ3 LYS 30 10.946 0.071 10.592 248 H LYS 31 H LYS 31 4.278 0.087 10.152 249 HA LYS 31 HA LYS 31 2.544 -2.017 10.923 250 HB2 LYS 31 HB2 LYS 31 2.679 0.789 12.036 251 HB3 LYS 31 HB3 LYS 31 2.177 -0.661 12.883 252 HG2 LYS 31 HG2 LYS 31 4.221 -0.950 13.689 253 HG3 LYS 31 HG3 LYS 31 4.978 -0.912 12.090 254 HD2 LYS 31 HD2 LYS 31 5.087 1.541 12.164 255 HD3 LYS 31 HD3 LYS 31 4.126 1.535 13.672 256 HE2 LYS 31 HE2 LYS 31 5.914 0.106 14.684 257 HE3 LYS 31 HE3 LYS 31 6.952 0.496 13.313 258 HZ1 LYS 31 HZ1 LYS 31 7.211 1.911 15.335 259 HZ2 LYS 31 HZ2 LYS 31 6.999 2.751 13.990 260 HZ3 LYS 31 HZ3 LYS 31 5.743 2.602 15.037 261 H GLY 32 H GLY 32 0.342 -2.274 10.419 262 HA2 GLY 32 HA2 GLY 32 -1.101 -0.482 8.842 263 HA3 GLY 32 HA3 GLY 32 -1.807 -1.760 9.829 264 H ASN 33 H ASN 33 -0.837 -0.497 12.413 265 HA ASN 33 HA ASN 33 -3.089 1.119 12.897 266 HB2 ASN 33 HB2 ASN 33 -2.259 1.571 15.052 267 HB3 ASN 33 HB3 ASN 33 -1.703 -0.039 14.679 268 HD21 ASN 33 HD21 ASN 33 0.631 0.851 13.007 269 HD22 ASN 33 HD22 ASN 33 1.660 1.794 14.090 270 H GLN 34 H GLN 34 -0.062 2.267 11.578 271 HA GLN 34 HA GLN 34 -1.049 5.056 11.831 272 HB2 GLN 34 HB2 GLN 34 1.326 5.728 11.745 273 HB3 GLN 34 HB3 GLN 34 0.857 4.814 13.192 274 HG2 GLN 34 HG2 GLN 34 1.800 2.745 12.008 275 HG3 GLN 34 HG3 GLN 34 2.410 3.803 10.789 276 HE21 GLN 34 HE21 GLN 34 4.646 4.332 11.209 277 HE22 GLN 34 HE22 GLN 34 5.366 4.264 12.755 278 H VAL 35 H VAL 35 -0.972 2.588 9.633 279 HA VAL 35 HA VAL 35 0.287 3.774 7.416 280 HB VAL 35 HB VAL 35 -0.588 1.400 7.785 281 HG11 VAL 35 HG11 VAL 35 -3.070 2.321 6.321 282 HG12 VAL 35 HG12 VAL 35 -2.705 0.718 6.988 283 HG13 VAL 35 HG13 VAL 35 -3.039 2.060 8.073 284 HG21 VAL 35 HG21 VAL 35 -0.822 2.645 5.038 285 HG22 VAL 35 HG22 VAL 35 0.615 1.933 5.804 286 HG23 VAL 35 HG23 VAL 35 -0.758 0.905 5.395 287 H LYS 36 H LYS 36 -0.371 5.211 5.789 288 HA LYS 36 HA LYS 36 -2.907 6.654 6.218 289 HB2 LYS 36 HB2 LYS 36 -0.134 7.800 6.277 290 HB3 LYS 36 HB3 LYS 36 -1.190 8.524 5.075 291 HG2 LYS 36 HG2 LYS 36 -2.886 8.547 7.168 292 HG3 LYS 36 HG3 LYS 36 -1.386 8.662 8.056 293 HD2 LYS 36 HD2 LYS 36 -1.728 10.594 5.769 294 HD3 LYS 36 HD3 LYS 36 -2.902 10.729 7.071 295 HE2 LYS 36 HE2 LYS 36 -0.908 10.823 8.693 296 HE3 LYS 36 HE3 LYS 36 0.102 11.064 7.264 297 HZ1 LYS 36 HZ1 LYS 36 -1.316 13.079 6.799 298 HZ2 LYS 36 HZ2 LYS 36 -2.010 12.890 8.278 299 HZ3 LYS 36 HZ3 LYS 36 -0.421 13.180 8.143 300 HA PRO 37 HA PRO 37 -3.182 5.659 1.954 301 HB2 PRO 37 HB2 PRO 37 -4.640 7.764 0.878 302 HB3 PRO 37 HB3 PRO 37 -5.345 6.509 1.915 303 HG2 PRO 37 HG2 PRO 37 -4.483 9.289 2.704 304 HG3 PRO 37 HG3 PRO 37 -5.926 8.365 3.208 305 HD2 PRO 37 HD2 PRO 37 -3.640 8.610 4.721 306 HD3 PRO 37 HD3 PRO 37 -4.732 7.197 4.819 307 H LEU 38 H LEU 38 -2.226 6.154 -0.137 308 HA LEU 38 HA LEU 38 -0.108 8.203 -0.140 309 HB2 LEU 38 HB2 LEU 38 -0.310 5.418 -1.380 310 HB3 LEU 38 HB3 LEU 38 0.869 6.601 -1.830 311 HG LEU 38 HG LEU 38 2.014 5.206 -0.508 312 HD11 LEU 38 HD11 LEU 38 1.326 7.459 1.400 313 HD12 LEU 38 HD12 LEU 38 2.809 6.456 1.401 314 HD13 LEU 38 HD13 LEU 38 2.470 7.536 0.056 315 HD21 LEU 38 HD21 LEU 38 1.446 4.205 1.523 316 HD22 LEU 38 HD22 LEU 38 -0.045 5.172 1.665 317 HD23 LEU 38 HD23 LEU 38 0.121 3.959 0.393 318 H LYS 39 H LYS 39 0.527 8.665 -2.473 319 HA LYS 39 HA LYS 39 -1.528 10.010 -3.857 320 HB2 LYS 39 HB2 LYS 39 0.791 10.537 -4.170 321 HB3 LYS 39 HB3 LYS 39 1.203 8.892 -4.595 322 HG2 LYS 39 HG2 LYS 39 -0.702 10.026 -6.546 323 HG3 LYS 39 HG3 LYS 39 0.705 11.023 -6.367 324 HD2 LYS 39 HD2 LYS 39 2.220 9.127 -6.802 325 HD3 LYS 39 HD3 LYS 39 0.834 8.046 -6.904 326 HE2 LYS 39 HE2 LYS 39 1.451 8.558 -9.147 327 HE3 LYS 39 HE3 LYS 39 -0.052 9.434 -8.820 328 HZ1 LYS 39 HZ1 LYS 39 2.699 10.491 -8.928 329 HZ2 LYS 39 HZ2 LYS 39 1.501 10.850 -9.939 330 HZ3 LYS 39 HZ3 LYS 39 1.415 11.420 -8.403 331 H ILE 40 H ILE 40 -2.707 9.436 -5.707 332 HA ILE 40 HA ILE 40 -3.545 6.719 -5.815 333 HB ILE 40 HB ILE 40 -5.057 8.508 -6.429 334 HG12 ILE 40 HG12 ILE 40 -5.952 7.761 -8.551 335 HG13 ILE 40 HG13 ILE 40 -4.444 6.931 -8.959 336 HG21 ILE 40 HG21 ILE 40 -4.793 9.920 -8.421 337 HG22 ILE 40 HG22 ILE 40 -3.410 10.151 -7.350 338 HG23 ILE 40 HG23 ILE 40 -3.248 9.139 -8.788 339 HD11 ILE 40 HD11 ILE 40 -6.217 5.402 -8.094 340 HD12 ILE 40 HD12 ILE 40 -4.788 5.364 -7.069 341 HD13 ILE 40 HD13 ILE 40 -6.206 6.309 -6.565 342 H GLY 41 H GLY 41 -2.831 5.060 -7.068 343 HA2 GLY 41 HA2 GLY 41 -1.641 3.915 -8.651 344 HA3 GLY 41 HA3 GLY 41 -1.383 5.426 -9.504 345 H ILE 42 H ILE 42 -0.209 5.429 -6.259 346 HA ILE 42 HA ILE 42 2.370 6.100 -6.876 347 HB ILE 42 HB ILE 42 1.182 6.385 -4.703 348 HG12 ILE 42 HG12 ILE 42 3.970 5.282 -4.421 349 HG13 ILE 42 HG13 ILE 42 3.564 6.862 -5.118 350 HG21 ILE 42 HG21 ILE 42 0.375 4.096 -4.309 351 HG22 ILE 42 HG22 ILE 42 2.049 3.510 -4.142 352 HG23 ILE 42 HG23 ILE 42 1.377 4.622 -2.961 353 HD11 ILE 42 HD11 ILE 42 3.066 6.000 -2.259 354 HD12 ILE 42 HD12 ILE 42 4.246 7.167 -2.819 355 HD13 ILE 42 HD13 ILE 42 2.536 7.551 -2.972 356 H PHE 43 H PHE 43 1.185 2.747 -6.884 357 HA PHE 43 HA PHE 43 3.803 1.572 -6.535 358 HB2 PHE 43 HB2 PHE 43 2.351 -0.185 -6.423 359 HB3 PHE 43 HB3 PHE 43 1.143 0.590 -7.427 360 HD1 PHE 43 HD1 PHE 43 0.889 0.057 -9.747 361 HD2 PHE 43 HD2 PHE 43 4.346 -1.328 -7.628 362 HE1 PHE 43 HE1 PHE 43 1.506 -1.303 -11.668 363 HE2 PHE 43 HE2 PHE 43 4.954 -2.772 -9.553 364 HZ PHE 43 HZ PHE 43 3.586 -2.673 -11.645 365 H ASP 44 H ASP 44 2.059 2.936 -9.295 366 HA ASP 44 HA ASP 44 3.978 1.941 -11.290 367 HB2 ASP 44 HB2 ASP 44 1.405 3.258 -11.332 368 HB3 ASP 44 HB3 ASP 44 2.513 4.309 -12.193 369 H ASP 45 H ASP 45 3.727 4.882 -9.276 370 HA ASP 45 HA ASP 45 5.740 6.330 -10.792 371 HB2 ASP 45 HB2 ASP 45 4.607 6.614 -7.987 372 HB3 ASP 45 HB3 ASP 45 5.957 7.586 -8.561 373 H LEU 46 H LEU 46 5.743 4.173 -8.061 374 HA LEU 46 HA LEU 46 8.536 4.336 -7.399 375 HB2 LEU 46 HB2 LEU 46 6.723 4.045 -5.776 376 HB3 LEU 46 HB3 LEU 46 6.271 2.552 -6.555 377 HG LEU 46 HG LEU 46 9.082 2.262 -5.955 378 HD11 LEU 46 HD11 LEU 46 8.938 4.272 -4.617 379 HD12 LEU 46 HD12 LEU 46 7.789 3.488 -3.509 380 HD13 LEU 46 HD13 LEU 46 9.428 2.833 -3.726 381 HD21 LEU 46 HD21 LEU 46 8.260 0.341 -5.427 382 HD22 LEU 46 HD22 LEU 46 7.643 1.088 -3.949 383 HD23 LEU 46 HD23 LEU 46 6.600 0.918 -5.399 384 H ILE 47 H ILE 47 6.566 2.135 -9.359 385 HA ILE 47 HA ILE 47 8.206 -0.111 -9.372 386 HB ILE 47 HB ILE 47 5.908 0.444 -10.582 387 HG12 ILE 47 HG12 ILE 47 6.741 -1.758 -10.353 388 HG13 ILE 47 HG13 ILE 47 6.020 -1.510 -11.951 389 HG21 ILE 47 HG21 ILE 47 7.614 0.757 -13.065 390 HG22 ILE 47 HG22 ILE 47 5.841 0.689 -12.943 391 HG23 ILE 47 HG23 ILE 47 6.761 2.048 -12.303 392 HD11 ILE 47 HD11 ILE 47 8.009 -2.787 -12.249 393 HD12 ILE 47 HD12 ILE 47 8.395 -1.185 -12.838 394 HD13 ILE 47 HD13 ILE 47 8.944 -1.717 -11.225 395 H ASP 48 H ASP 48 8.487 3.054 -11.074 396 HA ASP 48 HA ASP 48 10.446 2.574 -13.021 397 HB2 ASP 48 HB2 ASP 48 9.917 5.019 -11.250 398 HB3 ASP 48 HB3 ASP 48 11.087 4.996 -12.553 399 H PHE 49 H PHE 49 10.692 3.314 -9.595 400 HA PHE 49 HA PHE 49 13.554 3.616 -9.552 401 HB2 PHE 49 HB2 PHE 49 11.942 4.795 -8.053 402 HB3 PHE 49 HB3 PHE 49 11.496 3.255 -7.337 403 HD1 PHE 49 HD1 PHE 49 12.120 3.427 -5.099 404 HD2 PHE 49 HD2 PHE 49 14.985 4.364 -8.213 405 HE1 PHE 49 HE1 PHE 49 14.007 3.106 -3.500 406 HE2 PHE 49 HE2 PHE 49 16.818 4.084 -6.612 407 HZ PHE 49 HZ PHE 49 16.291 3.443 -4.254 408 H TYR 50 H TYR 50 11.270 1.000 -8.819 409 HA TYR 50 HA TYR 50 13.089 -0.849 -7.603 410 HB2 TYR 50 HB2 TYR 50 10.803 -1.336 -7.405 411 HB3 TYR 50 HB3 TYR 50 10.490 -1.056 -9.108 412 HD1 TYR 50 HD1 TYR 50 11.997 -3.482 -6.723 413 HD2 TYR 50 HD2 TYR 50 10.828 -2.697 -10.797 414 HE1 TYR 50 HE1 TYR 50 12.506 -5.831 -7.336 415 HE2 TYR 50 HE2 TYR 50 11.164 -5.072 -11.365 416 HH TYR 50 HH TYR 50 12.974 -7.167 -9.228 417 H GLU 51 H GLU 51 12.465 -0.008 -10.995 418 HA GLU 51 HA GLU 51 14.075 -2.139 -12.129 419 HB2 GLU 51 HB2 GLU 51 13.057 0.533 -13.166 420 HB3 GLU 51 HB3 GLU 51 14.054 -0.518 -14.148 421 HG2 GLU 51 HG2 GLU 51 11.650 -1.812 -12.901 422 HG3 GLU 51 HG3 GLU 51 11.330 -0.568 -14.103 423 H ARG 52 H ARG 52 14.882 1.007 -10.761 424 HA ARG 52 HA ARG 52 17.354 1.384 -12.173 425 HB2 ARG 52 HB2 ARG 52 15.887 3.127 -10.934 426 HB3 ARG 52 HB3 ARG 52 16.593 2.538 -9.441 427 HG2 ARG 52 HG2 ARG 52 17.828 4.448 -10.015 428 HG3 ARG 52 HG3 ARG 52 18.903 3.124 -10.371 429 HD2 ARG 52 HD2 ARG 52 18.346 3.291 -12.790 430 HD3 ARG 52 HD3 ARG 52 17.158 4.544 -12.409 431 HE ARG 52 HE ARG 52 18.784 6.099 -11.994 432 HH11 ARG 52 HH11 ARG 52 20.395 3.059 -12.801 433 HH12 ARG 52 HH12 ARG 52 21.958 3.753 -12.968 434 HH21 ARG 52 HH21 ARG 52 20.766 6.979 -11.911 435 HH22 ARG 52 HH22 ARG 52 22.239 6.108 -12.191 436 H LEU 53 H LEU 53 16.642 -0.509 -9.265 437 HA LEU 53 HA LEU 53 19.184 -0.419 -8.082 438 HB2 LEU 53 HB2 LEU 53 17.421 -2.875 -8.174 439 HB3 LEU 53 HB3 LEU 53 18.351 -2.226 -6.844 440 HG LEU 53 HG LEU 53 15.770 -0.948 -7.889 441 HD11 LEU 53 HD11 LEU 53 16.235 -2.952 -5.695 442 HD12 LEU 53 HD12 LEU 53 14.695 -2.103 -5.999 443 HD13 LEU 53 HD13 LEU 53 15.358 -3.210 -7.209 444 HD21 LEU 53 HD21 LEU 53 17.436 -0.462 -5.432 445 HD22 LEU 53 HD22 LEU 53 16.946 0.702 -6.699 446 HD23 LEU 53 HD23 LEU 53 15.744 0.054 -5.588 447 H ASP 54 H ASP 54 20.991 -1.324 -8.430 448 HA ASP 54 HA ASP 54 21.609 -2.853 -10.836 449 HB2 ASP 54 HB2 ASP 54 23.242 -1.401 -10.110 450 HB3 ASP 54 HB3 ASP 54 23.215 -1.983 -8.444 451 H THR 55 H THR 55 20.324 -3.615 -7.789 452 HA THR 55 HA THR 55 20.247 -6.499 -8.524 453 HB THR 55 HB THR 55 20.588 -6.627 -5.765 454 HG1 THR 55 HG1 THR 55 22.512 -4.853 -6.774 455 HG21 THR 55 HG21 THR 55 21.389 -8.366 -7.058 456 HG22 THR 55 HG22 THR 55 22.557 -7.357 -7.914 457 HG23 THR 55 HG23 THR 55 22.757 -7.672 -6.175 458 HA PRO 56 HA PRO 56 16.026 -5.696 -7.148 459 HB2 PRO 56 HB2 PRO 56 14.718 -6.644 -9.273 460 HB3 PRO 56 HB3 PRO 56 15.418 -4.999 -9.236 461 HG2 PRO 56 HG2 PRO 56 16.555 -7.559 -10.440 462 HG3 PRO 56 HG3 PRO 56 16.405 -5.944 -11.183 463 HD2 PRO 56 HD2 PRO 56 18.711 -6.779 -9.993 464 HD3 PRO 56 HD3 PRO 56 18.149 -5.072 -9.890 465 HA PRO 57 HA PRO 57 15.524 -10.117 -6.066 466 HB2 PRO 57 HB2 PRO 57 14.112 -9.783 -3.772 467 HB3 PRO 57 HB3 PRO 57 15.785 -9.198 -3.949 468 HG2 PRO 57 HG2 PRO 57 13.229 -7.576 -4.152 469 HG3 PRO 57 HG3 PRO 57 14.739 -7.187 -3.296 470 HD2 PRO 57 HD2 PRO 57 14.090 -6.359 -5.905 471 HD3 PRO 57 HD3 PRO 57 15.740 -6.433 -5.210 472 H PHE 58 H PHE 58 12.441 -8.956 -4.902 473 HA PHE 58 HA PHE 58 10.913 -10.821 -6.403 474 HB2 PHE 58 HB2 PHE 58 10.673 -8.942 -4.154 475 HB3 PHE 58 HB3 PHE 58 9.255 -8.886 -5.159 476 HD1 PHE 58 HD1 PHE 58 8.567 -11.473 -6.007 477 HD2 PHE 58 HD2 PHE 58 10.416 -10.321 -2.289 478 HE1 PHE 58 HE1 PHE 58 7.400 -13.314 -4.848 479 HE2 PHE 58 HE2 PHE 58 9.313 -12.214 -1.149 480 HZ PHE 58 HZ PHE 58 7.767 -13.715 -2.476 481 H SER 59 H SER 59 9.732 -10.594 -8.142 482 HA SER 59 HA SER 59 10.050 -8.654 -10.047 483 HB2 SER 59 HB2 SER 59 9.178 -11.084 -10.147 484 HB3 SER 59 HB3 SER 59 7.583 -10.413 -9.796 485 HG SER 59 HG SER 59 8.905 -10.591 -12.076 486 H LYS 60 H LYS 60 8.672 -7.143 -11.053 487 HA LYS 60 HA LYS 60 7.438 -5.212 -9.512 488 HB2 LYS 60 HB2 LYS 60 6.579 -4.317 -11.599 489 HB3 LYS 60 HB3 LYS 60 8.238 -4.924 -11.786 490 HG2 LYS 60 HG2 LYS 60 6.985 -7.111 -12.662 491 HG3 LYS 60 HG3 LYS 60 5.645 -5.998 -12.913 492 HD2 LYS 60 HD2 LYS 60 8.374 -6.045 -14.219 493 HD3 LYS 60 HD3 LYS 60 6.802 -6.258 -14.965 494 HE2 LYS 60 HE2 LYS 60 6.349 -3.773 -14.269 495 HE3 LYS 60 HE3 LYS 60 8.103 -3.690 -13.997 496 HZ1 LYS 60 HZ1 LYS 60 7.641 -2.989 -16.240 497 HZ2 LYS 60 HZ2 LYS 60 8.354 -4.447 -16.340 498 HZ3 LYS 60 HZ3 LYS 60 6.717 -4.308 -16.525 499 H LYS 61 H LYS 61 5.893 -8.025 -10.966 500 HA LYS 61 HA LYS 61 3.141 -7.321 -10.518 501 HB2 LYS 61 HB2 LYS 61 4.703 -9.625 -11.420 502 HB3 LYS 61 HB3 LYS 61 3.488 -10.160 -10.267 503 HG2 LYS 61 HG2 LYS 61 1.688 -9.308 -11.601 504 HG3 LYS 61 HG3 LYS 61 2.812 -8.436 -12.672 505 HD2 LYS 61 HD2 LYS 61 3.791 -10.599 -13.384 506 HD3 LYS 61 HD3 LYS 61 2.632 -11.477 -12.384 507 HE2 LYS 61 HE2 LYS 61 1.835 -9.505 -14.560 508 HE3 LYS 61 HE3 LYS 61 2.094 -11.218 -14.870 509 HZ1 LYS 61 HZ1 LYS 61 0.064 -10.268 -12.923 510 HZ2 LYS 61 HZ2 LYS 61 -0.258 -10.639 -14.459 511 HZ3 LYS 61 HZ3 LYS 61 0.314 -11.798 -13.472 512 H SER 62 H SER 62 5.547 -9.126 -8.533 513 HA SER 62 HA SER 62 3.725 -9.591 -6.402 514 HB2 SER 62 HB2 SER 62 5.634 -10.323 -5.123 515 HB3 SER 62 HB3 SER 62 5.657 -10.999 -6.741 516 HG SER 62 HG SER 62 7.095 -8.900 -7.083 517 H LEU 63 H LEU 63 6.166 -6.984 -6.913 518 HA LEU 63 HA LEU 63 6.081 -5.613 -4.435 519 HB2 LEU 63 HB2 LEU 63 7.574 -5.235 -6.436 520 HB3 LEU 63 HB3 LEU 63 6.265 -4.352 -7.207 521 HG LEU 63 HG LEU 63 6.600 -3.501 -4.423 522 HD11 LEU 63 HD11 LEU 63 8.745 -2.523 -4.434 523 HD12 LEU 63 HD12 LEU 63 8.936 -4.253 -4.767 524 HD13 LEU 63 HD13 LEU 63 9.086 -3.075 -6.095 525 HD21 LEU 63 HD21 LEU 63 5.525 -2.169 -6.205 526 HD22 LEU 63 HD22 LEU 63 6.688 -1.350 -5.166 527 HD23 LEU 63 HD23 LEU 63 7.150 -1.727 -6.869 528 H ARG 64 H ARG 64 3.934 -5.293 -7.293 529 HA ARG 64 HA ARG 64 2.112 -3.479 -6.075 530 HB2 ARG 64 HB2 ARG 64 2.336 -3.837 -8.498 531 HB3 ARG 64 HB3 ARG 64 1.843 -5.514 -8.346 532 HG2 ARG 64 HG2 ARG 64 0.041 -4.122 -9.255 533 HG3 ARG 64 HG3 ARG 64 -0.493 -4.779 -7.741 534 HD2 ARG 64 HD2 ARG 64 -0.316 -2.797 -6.548 535 HD3 ARG 64 HD3 ARG 64 0.912 -2.138 -7.587 536 HE ARG 64 HE ARG 64 -1.015 -2.108 -9.341 537 HH11 ARG 64 HH11 ARG 64 -1.327 -1.192 -5.929 538 HH12 ARG 64 HH12 ARG 64 -2.138 0.302 -6.240 539 HH21 ARG 64 HH21 ARG 64 -2.415 -0.363 -9.731 540 HH22 ARG 64 HH22 ARG 64 -2.936 0.703 -8.478 541 H GLU 65 H GLU 65 1.784 -7.061 -6.586 542 HA GLU 65 HA GLU 65 -0.787 -7.364 -5.521 543 HB2 GLU 65 HB2 GLU 65 0.685 -8.940 -6.867 544 HB3 GLU 65 HB3 GLU 65 1.490 -9.379 -5.359 545 HG2 GLU 65 HG2 GLU 65 -0.380 -10.530 -4.553 546 HG3 GLU 65 HG3 GLU 65 -1.524 -9.546 -5.483 547 H ALA 66 H ALA 66 2.343 -7.280 -3.913 548 HA ALA 66 HA ALA 66 1.430 -8.104 -1.293 549 HB1 ALA 66 HB1 ALA 66 3.664 -6.962 -0.762 550 HB2 ALA 66 HB2 ALA 66 3.731 -8.387 -1.848 551 HB3 ALA 66 HB3 ALA 66 3.850 -6.722 -2.485 552 H LEU 67 H LEU 67 2.417 -4.930 -2.769 553 HA LEU 67 HA LEU 67 1.832 -3.246 -0.661 554 HB2 LEU 67 HB2 LEU 67 2.802 -2.854 -3.055 555 HB3 LEU 67 HB3 LEU 67 1.151 -2.337 -3.422 556 HG LEU 67 HG LEU 67 2.862 -1.283 -1.095 557 HD11 LEU 67 HD11 LEU 67 4.020 -0.756 -3.146 558 HD12 LEU 67 HD12 LEU 67 2.512 -0.209 -3.911 559 HD13 LEU 67 HD13 LEU 67 3.226 0.712 -2.566 560 HD21 LEU 67 HD21 LEU 67 1.320 0.729 -1.341 561 HD22 LEU 67 HD22 LEU 67 0.286 -0.313 -2.371 562 HD23 LEU 67 HD23 LEU 67 0.563 -0.730 -0.677 563 H SER 68 H SER 68 -0.300 -4.643 -3.159 564 HA SER 68 HA SER 68 -2.729 -3.366 -2.893 565 HB2 SER 68 HB2 SER 68 -1.986 -5.350 -4.434 566 HB3 SER 68 HB3 SER 68 -2.524 -6.390 -3.122 567 HG SER 68 HG SER 68 -4.534 -5.993 -3.553 568 H TYR 69 H TYR 69 -1.482 -6.167 -0.978 569 HA TYR 69 HA TYR 69 -3.799 -6.427 0.638 570 HB2 TYR 69 HB2 TYR 69 -1.048 -7.540 0.669 571 HB3 TYR 69 HB3 TYR 69 -1.858 -7.324 2.208 572 HD1 TYR 69 HD1 TYR 69 -2.736 -9.171 3.042 573 HD2 TYR 69 HD2 TYR 69 -3.119 -8.554 -1.197 574 HE1 TYR 69 HE1 TYR 69 -3.967 -11.321 2.846 575 HE2 TYR 69 HE2 TYR 69 -4.470 -10.632 -1.375 576 HH TYR 69 HH TYR 69 -5.331 -12.712 -0.109 577 H TYR 70 H TYR 70 -0.725 -4.518 1.197 578 HA TYR 70 HA TYR 70 -1.590 -3.591 3.793 579 HB2 TYR 70 HB2 TYR 70 0.448 -2.600 1.782 580 HB3 TYR 70 HB3 TYR 70 -0.097 -1.509 3.042 581 HD1 TYR 70 HD1 TYR 70 0.064 -5.123 3.842 582 HD2 TYR 70 HD2 TYR 70 2.125 -1.312 4.012 583 HE1 TYR 70 HE1 TYR 70 1.494 -5.945 5.624 584 HE2 TYR 70 HE2 TYR 70 3.736 -2.267 5.601 585 HH TYR 70 HH TYR 70 4.481 -4.442 6.529 586 H SER 71 H SER 71 -1.972 -2.260 0.465 587 HA SER 71 HA SER 71 -3.370 0.028 1.473 588 HB2 SER 71 HB2 SER 71 -4.210 0.244 -0.779 589 HB3 SER 71 HB3 SER 71 -2.437 0.285 -0.631 590 HG SER 71 HG SER 71 -3.746 -2.110 -1.357 591 H ALA 72 H ALA 72 -4.368 -3.302 1.359 592 HA ALA 72 HA ALA 72 -7.243 -2.567 1.313 593 HB1 ALA 72 HB1 ALA 72 -7.569 -4.958 0.748 594 HB2 ALA 72 HB2 ALA 72 -6.432 -4.248 -0.403 595 HB3 ALA 72 HB3 ALA 72 -5.830 -5.242 0.925 596 H SER 73 H SER 73 -4.909 -2.699 3.441 597 HA SER 73 HA SER 73 -5.652 -4.645 5.378 598 HB2 SER 73 HB2 SER 73 -4.133 -2.053 5.572 599 HB3 SER 73 HB3 SER 73 -4.640 -2.838 7.061 600 HG SER 73 HG SER 73 -2.559 -3.457 6.321 601 HA PRO 74 HA PRO 74 -9.377 -3.330 7.217 602 HB2 PRO 74 HB2 PRO 74 -8.954 -3.841 9.939 603 HB3 PRO 74 HB3 PRO 74 -9.390 -5.050 8.697 604 HG2 PRO 74 HG2 PRO 74 -6.691 -4.335 9.823 605 HG3 PRO 74 HG3 PRO 74 -7.349 -5.970 9.498 606 HD2 PRO 74 HD2 PRO 74 -5.615 -4.728 7.815 607 HD3 PRO 74 HD3 PRO 74 -6.949 -5.741 7.159 608 H ALA 75 H ALA 75 -6.545 -2.335 9.160 609 HA ALA 75 HA ALA 75 -7.736 -0.066 10.322 610 HB1 ALA 75 HB1 ALA 75 -5.456 0.649 10.824 611 HB2 ALA 75 HB2 ALA 75 -5.664 -1.097 11.090 612 HB3 ALA 75 HB3 ALA 75 -4.797 -0.506 9.647 613 H TYR 76 H TYR 76 -5.894 -0.285 7.210 614 HA TYR 76 HA TYR 76 -5.884 2.466 6.599 615 HB2 TYR 76 HB2 TYR 76 -4.600 0.980 5.197 616 HB3 TYR 76 HB3 TYR 76 -5.987 -0.023 4.847 617 HD1 TYR 76 HD1 TYR 76 -4.082 2.916 3.754 618 HD2 TYR 76 HD2 TYR 76 -7.781 0.776 3.308 619 HE1 TYR 76 HE1 TYR 76 -4.670 4.291 1.784 620 HE2 TYR 76 HE2 TYR 76 -8.361 2.148 1.323 621 HH TYR 76 HH TYR 76 -6.239 4.760 0.099 622 H LEU 77 H LEU 77 -8.361 0.009 5.888 623 HA LEU 77 HA LEU 77 -10.165 1.817 4.572 624 HB2 LEU 77 HB2 LEU 77 -10.749 -0.855 5.910 625 HB3 LEU 77 HB3 LEU 77 -11.804 -0.040 4.773 626 HG LEU 77 HG LEU 77 -8.967 -0.873 4.037 627 HD11 LEU 77 HD11 LEU 77 -11.480 -2.473 3.788 628 HD12 LEU 77 HD12 LEU 77 -9.906 -2.907 3.075 629 HD13 LEU 77 HD13 LEU 77 -10.093 -2.806 4.837 630 HD21 LEU 77 HD21 LEU 77 -9.955 0.792 2.555 631 HD22 LEU 77 HD22 LEU 77 -9.694 -0.752 1.752 632 HD23 LEU 77 HD23 LEU 77 -11.335 -0.265 2.254 633 H SER 78 H SER 78 -10.088 0.450 7.850 634 HA SER 78 HA SER 78 -12.404 1.679 8.885 635 HB2 SER 78 HB2 SER 78 -10.895 -0.197 9.841 636 HB3 SER 78 HB3 SER 78 -9.893 1.100 10.513 637 HG SER 78 HG SER 78 -12.560 0.315 11.035 638 H CYS 79 H CYS 79 -9.042 2.883 8.629 639 HA CYS 79 HA CYS 79 -9.510 5.313 10.027 640 HB2 CYS 79 HB2 CYS 79 -7.378 3.938 9.796 641 HB3 CYS 79 HB3 CYS 79 -7.174 4.698 8.202 642 HG CYS 79 HG CYS 79 -7.650 6.038 11.178 643 H GLN 80 H GLN 80 -10.960 4.596 7.198 644 HA GLN 80 HA GLN 80 -10.471 6.317 5.159 645 HB2 GLN 80 HB2 GLN 80 -12.912 6.425 4.864 646 HB3 GLN 80 HB3 GLN 80 -12.308 4.806 4.981 647 HG2 GLN 80 HG2 GLN 80 -13.492 4.321 6.856 648 HG3 GLN 80 HG3 GLN 80 -13.137 5.847 7.634 649 HE21 GLN 80 HE21 GLN 80 -14.155 7.729 6.079 650 HE22 GLN 80 HE22 GLN 80 -15.900 7.652 6.190 651 H LYS 81 H LYS 81 -9.446 8.236 6.050 652 HA LYS 81 HA LYS 81 -11.360 10.288 7.108 653 HB2 LYS 81 HB2 LYS 81 -8.430 9.842 7.665 654 HB3 LYS 81 HB3 LYS 81 -9.184 11.429 7.872 655 HG2 LYS 81 HG2 LYS 81 -10.770 10.584 9.451 656 HG3 LYS 81 HG3 LYS 81 -10.306 8.905 9.147 657 HD2 LYS 81 HD2 LYS 81 -8.036 9.389 10.076 658 HD3 LYS 81 HD3 LYS 81 -8.576 11.052 10.447 659 HE2 LYS 81 HE2 LYS 81 -10.527 10.020 11.713 660 HE3 LYS 81 HE3 LYS 81 -9.770 8.434 11.490 661 HZ1 LYS 81 HZ1 LYS 81 -8.575 10.725 12.935 662 HZ2 LYS 81 HZ2 LYS 81 -9.328 9.445 13.623 663 HZ3 LYS 81 HZ3 LYS 81 -7.909 9.211 12.810 664 HA PRO 82 HA PRO 82 -10.439 11.641 2.847 665 HB2 PRO 82 HB2 PRO 82 -12.632 13.241 2.502 666 HB3 PRO 82 HB3 PRO 82 -12.769 11.471 2.469 667 HG2 PRO 82 HG2 PRO 82 -13.270 13.319 4.808 668 HG3 PRO 82 HG3 PRO 82 -14.348 12.032 4.177 669 HD2 PRO 82 HD2 PRO 82 -12.678 11.642 6.282 670 HD3 PRO 82 HD3 PRO 82 -12.989 10.339 5.094 671 H ASP 83 H ASP 83 -10.600 14.135 2.086 672 HA ASP 83 HA ASP 83 -9.362 16.102 2.216 673 HB2 ASP 83 HB2 ASP 83 -11.029 16.388 4.723 674 HB3 ASP 83 HB3 ASP 83 -10.460 17.668 3.643 675 H THR 84 H THR 84 -7.702 14.320 2.824 676 HA THR 84 HA THR 84 -6.212 15.073 5.287 677 HB THR 84 HB THR 84 -7.326 12.836 5.315 678 HG1 THR 84 HG1 THR 84 -5.584 11.562 5.874 679 HG21 THR 84 HG21 THR 84 -6.414 11.023 3.806 680 HG22 THR 84 HG22 THR 84 -7.341 12.262 2.962 681 HG23 THR 84 HG23 THR 84 -5.565 12.257 2.882 682 H ALA 85 H ALA 85 -5.968 15.080 1.877 683 HA ALA 85 HA ALA 85 -4.262 15.326 0.435 684 HB1 ALA 85 HB1 ALA 85 -2.967 16.849 2.699 685 HB2 ALA 85 HB2 ALA 85 -2.655 17.019 0.951 686 HB3 ALA 85 HB3 ALA 85 -4.231 17.485 1.629 687 H ARG 86 H ARG 86 -3.467 13.589 -0.201 688 HA ARG 86 HA ARG 86 -1.512 12.078 1.503 689 HB2 ARG 86 HB2 ARG 86 -2.254 11.315 -1.324 690 HB3 ARG 86 HB3 ARG 86 -1.404 10.363 -0.130 691 HG2 ARG 86 HG2 ARG 86 -3.396 9.393 0.146 692 HG3 ARG 86 HG3 ARG 86 -3.708 10.770 1.220 693 HD2 ARG 86 HD2 ARG 86 -5.568 10.540 -0.288 694 HD3 ARG 86 HD3 ARG 86 -4.671 11.965 -0.817 695 HE ARG 86 HE ARG 86 -3.925 9.401 -2.066 696 HH11 ARG 86 HH11 ARG 86 -5.566 12.543 -2.558 697 HH12 ARG 86 HH12 ARG 86 -6.215 12.077 -4.095 698 HH21 ARG 86 HH21 ARG 86 -4.802 8.865 -4.094 699 HH22 ARG 86 HH22 ARG 86 -5.508 10.140 -5.067 700 H VAL 87 H VAL 87 0.497 11.283 0.028 701 HA VAL 87 HA VAL 87 1.643 13.539 -1.441 702 HB VAL 87 HB VAL 87 3.816 12.996 -0.225 703 HG11 VAL 87 HG11 VAL 87 1.746 14.306 1.566 704 HG12 VAL 87 HG12 VAL 87 3.491 14.635 1.451 705 HG13 VAL 87 HG13 VAL 87 2.418 15.104 0.139 706 HG21 VAL 87 HG21 VAL 87 3.124 10.971 0.971 707 HG22 VAL 87 HG22 VAL 87 3.522 12.277 2.140 708 HG23 VAL 87 HG23 VAL 87 1.853 11.860 1.838 709 H ASP 88 H ASP 88 3.439 12.737 -2.783 710 HA ASP 88 HA ASP 88 3.003 9.931 -3.668 711 HB2 ASP 88 HB2 ASP 88 3.969 10.574 -5.798 712 HB3 ASP 88 HB3 ASP 88 2.561 11.535 -5.426 713 H ILE 89 H ILE 89 5.261 9.189 -4.708 714 HA ILE 89 HA ILE 89 6.892 8.707 -2.407 715 HB ILE 89 HB ILE 89 8.487 7.612 -3.966 716 HG12 ILE 89 HG12 ILE 89 6.711 8.725 -6.160 717 HG13 ILE 89 HG13 ILE 89 8.432 9.010 -5.861 718 HG21 ILE 89 HG21 ILE 89 7.258 5.732 -4.386 719 HG22 ILE 89 HG22 ILE 89 6.396 6.496 -3.057 720 HG23 ILE 89 HG23 ILE 89 5.789 6.604 -4.752 721 HD11 ILE 89 HD11 ILE 89 8.195 7.526 -7.717 722 HD12 ILE 89 HD12 ILE 89 8.888 6.623 -6.364 723 HD13 ILE 89 HD13 ILE 89 7.189 6.413 -6.753 724 H TYR 90 H TYR 90 7.080 11.262 -4.934 725 HA TYR 90 HA TYR 90 9.779 11.977 -4.185 726 HB2 TYR 90 HB2 TYR 90 7.569 13.048 -5.946 727 HB3 TYR 90 HB3 TYR 90 8.948 14.064 -5.594 728 HD1 TYR 90 HD1 TYR 90 7.909 10.855 -7.202 729 HD2 TYR 90 HD2 TYR 90 11.090 13.641 -6.486 730 HE1 TYR 90 HE1 TYR 90 9.236 9.771 -8.993 731 HE2 TYR 90 HE2 TYR 90 12.441 12.566 -8.222 732 HH TYR 90 HH TYR 90 12.631 10.775 -9.579 733 H GLY 91 H GLY 91 6.957 12.242 -2.421 734 HA2 GLY 91 HA2 GLY 91 6.613 13.284 -0.413 735 HA3 GLY 91 HA3 GLY 91 8.085 14.249 -0.627 736 H ASN 92 H ASN 92 6.042 14.332 -3.445 737 HA ASN 92 HA ASN 92 5.476 17.143 -2.914 738 HB2 ASN 92 HB2 ASN 92 4.153 15.610 -5.128 739 HB3 ASN 92 HB3 ASN 92 4.549 17.295 -5.034 740 HD21 ASN 92 HD21 ASN 92 5.350 14.533 -6.538 741 HD22 ASN 92 HD22 ASN 92 6.966 14.928 -7.100 742 H GLU 93 H GLU 93 3.363 17.968 -2.816 743 HA GLU 93 HA GLU 93 1.481 16.316 -1.356 744 HB2 GLU 93 HB2 GLU 93 1.996 19.183 -1.929 745 HB3 GLU 93 HB3 GLU 93 0.274 18.778 -1.941 746 HG2 GLU 93 HG2 GLU 93 0.258 18.079 0.269 747 HG3 GLU 93 HG3 GLU 93 1.963 17.636 0.287 748 H VAL 94 H VAL 94 -0.461 15.605 -1.984 749 HA VAL 94 HA VAL 94 -1.127 15.830 -4.830 750 HB VAL 94 HB VAL 94 -1.465 13.646 -5.217 751 HG11 VAL 94 HG11 VAL 94 0.976 14.267 -4.807 752 HG12 VAL 94 HG12 VAL 94 0.842 13.363 -3.319 753 HG13 VAL 94 HG13 VAL 94 0.567 12.561 -4.868 754 HG21 VAL 94 HG21 VAL 94 -2.113 13.332 -2.394 755 HG22 VAL 94 HG22 VAL 94 -2.640 12.404 -3.800 756 HG23 VAL 94 HG23 VAL 94 -1.094 12.016 -3.021 757 H ASP 95 H ASP 95 -3.534 14.840 -4.964 758 HA ASP 95 HA ASP 95 -4.998 16.878 -3.484 759 HB2 ASP 95 HB2 ASP 95 -5.263 15.935 -5.937 760 HB3 ASP 95 HB3 ASP 95 -6.252 14.696 -5.170 761 H VAL 96 H VAL 96 -7.376 15.813 -2.742 762 HA VAL 96 HA VAL 96 -6.557 13.868 -0.615 763 HB VAL 96 HB VAL 96 -7.995 14.962 0.822 764 HG11 VAL 96 HG11 VAL 96 -6.989 17.034 1.091 765 HG12 VAL 96 HG12 VAL 96 -5.885 16.389 -0.144 766 HG13 VAL 96 HG13 VAL 96 -7.171 17.476 -0.603 767 HG21 VAL 96 HG21 VAL 96 -9.162 16.424 -1.582 768 HG22 VAL 96 HG22 VAL 96 -10.008 15.311 -0.467 769 HG23 VAL 96 HG23 VAL 96 -9.468 16.891 0.095 770 H VAL 97 H VAL 97 -8.041 12.472 0.229 771 HA VAL 97 HA VAL 97 -9.528 11.054 -1.900 772 HB VAL 97 HB VAL 97 -9.745 10.388 1.057 773 HG11 VAL 97 HG11 VAL 97 -9.990 8.550 -1.376 774 HG12 VAL 97 HG12 VAL 97 -10.303 8.156 0.323 775 HG13 VAL 97 HG13 VAL 97 -11.379 9.261 -0.538 776 HG21 VAL 97 HG21 VAL 97 -7.431 10.382 0.616 777 HG22 VAL 97 HG22 VAL 97 -7.906 8.694 0.461 778 HG23 VAL 97 HG23 VAL 97 -7.641 9.658 -1.014 779 H THR 98 H THR 98 -11.569 11.409 -2.470 780 HA THR 98 HA THR 98 -13.039 13.585 -1.364 781 HB THR 98 HB THR 98 -14.852 12.019 -2.867 782 HG1 THR 98 HG1 THR 98 -13.549 11.697 -4.806 783 HG21 THR 98 HG21 THR 98 -14.835 13.800 -4.334 784 HG22 THR 98 HG22 THR 98 -14.107 14.579 -2.948 785 HG23 THR 98 HG23 THR 98 -13.087 14.015 -4.283 786 HA PRO 99 HA PRO 99 -15.118 11.744 1.962 787 HB2 PRO 99 HB2 PRO 99 -17.752 12.595 1.714 788 HB3 PRO 99 HB3 PRO 99 -16.401 13.562 2.381 789 HG2 PRO 99 HG2 PRO 99 -17.585 13.611 -0.396 790 HG3 PRO 99 HG3 PRO 99 -17.047 14.995 0.605 791 HD2 PRO 99 HD2 PRO 99 -15.527 13.976 -1.384 792 HD3 PRO 99 HD3 PRO 99 -14.754 14.545 0.125 793 H GLU 100 H GLU 100 -17.079 11.452 -0.991 794 HA GLU 100 HA GLU 100 -18.570 9.157 -0.213 795 HB2 GLU 100 HB2 GLU 100 -17.876 10.395 -2.906 796 HB3 GLU 100 HB3 GLU 100 -18.887 8.963 -2.705 797 HG2 GLU 100 HG2 GLU 100 -20.096 10.613 -0.882 798 HG3 GLU 100 HG3 GLU 100 -19.445 11.841 -1.953 799 H GLN 101 H GLN 101 -15.405 9.485 -1.840 800 HA GLN 101 HA GLN 101 -15.256 6.599 -2.351 801 HB2 GLN 101 HB2 GLN 101 -13.268 8.864 -2.670 802 HB3 GLN 101 HB3 GLN 101 -12.854 7.154 -2.915 803 HG2 GLN 101 HG2 GLN 101 -14.967 7.102 -4.474 804 HG3 GLN 101 HG3 GLN 101 -14.775 8.862 -4.519 805 HE21 GLN 101 HE21 GLN 101 -14.383 6.726 -6.729 806 HE22 GLN 101 HE22 GLN 101 -12.761 7.042 -7.268 807 H ALA 102 H ALA 102 -13.896 8.895 0.087 808 HA ALA 102 HA ALA 102 -12.239 6.991 1.353 809 HB1 ALA 102 HB1 ALA 102 -12.142 9.404 1.885 810 HB2 ALA 102 HB2 ALA 102 -13.757 9.318 2.630 811 HB3 ALA 102 HB3 ALA 102 -12.393 8.438 3.348 812 H LYS 103 H LYS 103 -15.697 7.861 2.056 813 HA LYS 103 HA LYS 103 -15.878 5.829 4.051 814 HB2 LYS 103 HB2 LYS 103 -18.190 6.248 4.160 815 HB3 LYS 103 HB3 LYS 103 -17.420 7.800 3.837 816 HG2 LYS 103 HG2 LYS 103 -18.083 7.614 1.437 817 HG3 LYS 103 HG3 LYS 103 -18.815 6.039 1.757 818 HD2 LYS 103 HD2 LYS 103 -20.614 7.547 1.780 819 HD3 LYS 103 HD3 LYS 103 -20.295 7.189 3.482 820 HE2 LYS 103 HE2 LYS 103 -18.855 9.326 3.514 821 HE3 LYS 103 HE3 LYS 103 -19.476 9.669 1.896 822 HZ1 LYS 103 HZ1 LYS 103 -21.143 9.356 4.321 823 HZ2 LYS 103 HZ2 LYS 103 -20.765 10.777 3.612 824 HZ3 LYS 103 HZ3 LYS 103 -21.706 9.687 2.825 825 H TYR 104 H TYR 104 -16.164 5.541 0.621 826 HA TYR 104 HA TYR 104 -17.577 3.136 0.378 827 HB2 TYR 104 HB2 TYR 104 -16.605 4.777 -1.414 828 HB3 TYR 104 HB3 TYR 104 -15.171 3.773 -1.366 829 HD1 TYR 104 HD1 TYR 104 -18.886 3.461 -1.542 830 HD2 TYR 104 HD2 TYR 104 -15.110 2.019 -3.027 831 HE1 TYR 104 HE1 TYR 104 -20.090 1.964 -3.074 832 HE2 TYR 104 HE2 TYR 104 -16.293 0.539 -4.613 833 HH TYR 104 HH TYR 104 -18.375 -0.396 -5.184 834 H ALA 105 H ALA 105 -14.310 3.698 1.559 835 HA ALA 105 HA ALA 105 -13.152 1.164 1.146 836 HB1 ALA 105 HB1 ALA 105 -11.552 2.553 1.981 837 HB2 ALA 105 HB2 ALA 105 -12.685 3.449 3.011 838 HB3 ALA 105 HB3 ALA 105 -12.085 1.907 3.543 839 H TYR 106 H TYR 106 -15.611 2.114 3.535 840 HA TYR 106 HA TYR 106 -15.323 0.015 5.353 841 HB2 TYR 106 HB2 TYR 106 -17.295 0.748 6.198 842 HB3 TYR 106 HB3 TYR 106 -17.034 2.106 5.119 843 HD1 TYR 106 HD1 TYR 106 -18.101 1.910 2.691 844 HD2 TYR 106 HD2 TYR 106 -19.169 -0.759 5.909 845 HE1 TYR 106 HE1 TYR 106 -20.291 1.557 1.672 846 HE2 TYR 106 HE2 TYR 106 -21.364 -1.148 4.864 847 HH TYR 106 HH TYR 106 -22.836 -0.504 3.053 848 H GLN 107 H GLN 107 -16.900 0.008 2.142 849 HA GLN 107 HA GLN 107 -18.231 -2.462 2.367 850 HB2 GLN 107 HB2 GLN 107 -17.147 -0.922 -0.005 851 HB3 GLN 107 HB3 GLN 107 -17.733 -2.558 -0.203 852 HG2 GLN 107 HG2 GLN 107 -19.866 -1.551 1.152 853 HG3 GLN 107 HG3 GLN 107 -19.282 -0.083 0.349 854 HE21 GLN 107 HE21 GLN 107 -18.699 -0.360 -1.997 855 HE22 GLN 107 HE22 GLN 107 -19.700 -1.367 -3.009 856 H ARG 108 H ARG 108 -14.868 -1.719 1.635 857 HA ARG 108 HA ARG 108 -14.176 -4.446 0.825 858 HB2 ARG 108 HB2 ARG 108 -12.378 -2.154 1.709 859 HB3 ARG 108 HB3 ARG 108 -11.946 -3.503 0.675 860 HG2 ARG 108 HG2 ARG 108 -13.801 -1.156 -0.055 861 HG3 ARG 108 HG3 ARG 108 -12.115 -1.340 -0.494 862 HD2 ARG 108 HD2 ARG 108 -13.710 -3.680 -1.325 863 HD3 ARG 108 HD3 ARG 108 -14.318 -2.160 -1.993 864 HE ARG 108 HE ARG 108 -11.517 -2.150 -2.338 865 HH11 ARG 108 HH11 ARG 108 -14.344 -3.936 -3.667 866 HH12 ARG 108 HH12 ARG 108 -13.628 -4.080 -5.218 867 HH21 ARG 108 HH21 ARG 108 -10.492 -2.687 -4.294 868 HH22 ARG 108 HH22 ARG 108 -11.338 -3.610 -5.498 869 H TYR 109 H TYR 109 -14.129 -2.542 3.862 870 HA TYR 109 HA TYR 109 -12.451 -4.374 5.312 871 HB2 TYR 109 HB2 TYR 109 -12.901 -2.066 6.041 872 HB3 TYR 109 HB3 TYR 109 -14.581 -2.419 6.327 873 HD1 TYR 109 HD1 TYR 109 -15.066 -4.433 8.106 874 HD2 TYR 109 HD2 TYR 109 -11.385 -2.187 7.828 875 HE1 TYR 109 HE1 TYR 109 -14.460 -5.124 10.388 876 HE2 TYR 109 HE2 TYR 109 -10.838 -2.821 10.157 877 HH TYR 109 HH TYR 109 -12.699 -5.217 11.968 878 H GLN 110 H GLN 110 -16.016 -3.871 5.109 879 HA GLN 110 HA GLN 110 -16.600 -6.159 6.560 880 HB2 GLN 110 HB2 GLN 110 -18.890 -5.892 6.035 881 HB3 GLN 110 HB3 GLN 110 -18.158 -4.305 6.292 882 HG2 GLN 110 HG2 GLN 110 -18.038 -3.943 3.891 883 HG3 GLN 110 HG3 GLN 110 -18.711 -5.546 3.565 884 HE21 GLN 110 HE21 GLN 110 -20.131 -4.056 2.270 885 HE22 GLN 110 HE22 GLN 110 -21.512 -3.289 3.063 886 H GLU 111 H GLU 111 -15.627 -6.047 3.278 887 HA GLU 111 HA GLU 111 -17.019 -8.391 2.277 888 HB2 GLU 111 HB2 GLU 111 -14.555 -6.855 1.350 889 HB3 GLU 111 HB3 GLU 111 -14.898 -8.452 0.699 890 HG2 GLU 111 HG2 GLU 111 -17.301 -6.795 0.592 891 HG3 GLU 111 HG3 GLU 111 -15.946 -5.913 -0.074 892 H ARG 112 H ARG 112 -13.955 -7.844 4.057 893 HA ARG 112 HA ARG 112 -13.767 -10.846 4.270 894 HB2 ARG 112 HB2 ARG 112 -11.763 -8.675 4.095 895 HB3 ARG 112 HB3 ARG 112 -11.303 -10.173 4.908 896 HG2 ARG 112 HG2 ARG 112 -11.801 -11.563 3.044 897 HG3 ARG 112 HG3 ARG 112 -12.568 -10.232 2.139 898 HD2 ARG 112 HD2 ARG 112 -9.723 -10.305 3.202 899 HD3 ARG 112 HD3 ARG 112 -10.068 -10.760 1.537 900 HE ARG 112 HE ARG 112 -10.237 -8.093 2.819 901 HH11 ARG 112 HH11 ARG 112 -11.830 -6.449 1.841 902 HH12 ARG 112 HH12 ARG 112 -12.496 -6.992 0.373 903 HH21 ARG 112 HH21 ARG 112 -10.494 -9.712 -0.206 904 HH22 ARG 112 HH22 ARG 112 -11.651 -8.667 -0.966 905 H TYR 113 H TYR 113 -13.198 -7.899 6.144 906 HA TYR 113 HA TYR 113 -13.324 -9.339 8.626 907 HB2 TYR 113 HB2 TYR 113 -13.056 -6.378 8.150 908 HB3 TYR 113 HB3 TYR 113 -12.465 -7.319 9.510 909 HD1 TYR 113 HD1 TYR 113 -11.313 -5.496 6.832 910 HD2 TYR 113 HD2 TYR 113 -10.979 -9.470 8.442 911 HE1 TYR 113 HE1 TYR 113 -9.087 -5.771 5.661 912 HE2 TYR 113 HE2 TYR 113 -8.865 -9.803 7.254 913 HH TYR 113 HH TYR 113 -7.156 -8.713 6.091 914 H GLY 114 H GLY 114 -15.805 -9.288 6.988 915 HA2 GLY 114 HA2 GLY 114 -17.637 -8.403 9.054 916 HA3 GLY 114 HA3 GLY 114 -17.847 -7.586 7.498 917 H ASN 115 H ASN 115 -19.953 -8.644 7.234 918 HA ASN 115 HA ASN 115 -19.804 -11.408 6.218 919 HB2 ASN 115 HB2 ASN 115 -20.420 -11.724 8.560 920 HB3 ASN 115 HB3 ASN 115 -21.675 -10.481 8.444 921 HD21 ASN 115 HD21 ASN 115 -23.757 -11.185 7.965 922 HD22 ASN 115 HD22 ASN 115 -24.088 -12.858 7.511 923 H LYS 116 H LYS 116 -20.223 -10.584 4.085 924 HA LYS 116 HA LYS 116 -22.908 -9.399 3.776 925 HB2 LYS 116 HB2 LYS 116 -20.677 -7.812 3.549 926 HB3 LYS 116 HB3 LYS 116 -20.800 -8.378 1.887 927 HG2 LYS 116 HG2 LYS 116 -23.229 -7.319 3.330 928 HG3 LYS 116 HG3 LYS 116 -22.027 -6.170 2.781 929 HD2 LYS 116 HD2 LYS 116 -22.460 -6.574 0.503 930 HD3 LYS 116 HD3 LYS 116 -23.243 -8.126 0.825 931 HE2 LYS 116 HE2 LYS 116 -24.906 -6.544 2.251 932 HE3 LYS 116 HE3 LYS 116 -24.336 -5.322 1.106 933 HZ1 LYS 116 HZ1 LYS 116 -25.110 -6.689 -0.693 934 HZ2 LYS 116 HZ2 LYS 116 -25.522 -7.911 0.316 935 HZ3 LYS 116 HZ3 LYS 116 -26.351 -6.526 0.393 936 H LYS 117 H LYS 117 -23.973 -10.086 2.026 937 HA LYS 117 HA LYS 117 -23.307 -12.634 0.994 938 HB2 LYS 117 HB2 LYS 117 -25.595 -11.581 1.371 939 HB3 LYS 117 HB3 LYS 117 -25.355 -10.644 -0.098 940 HG2 LYS 117 HG2 LYS 117 -25.690 -12.468 -1.481 941 HG3 LYS 117 HG3 LYS 117 -24.845 -13.563 -0.403 942 HD2 LYS 117 HD2 LYS 117 -26.909 -13.397 1.151 943 HD3 LYS 117 HD3 LYS 117 -27.757 -12.733 -0.265 944 HE2 LYS 117 HE2 LYS 117 -27.173 -14.760 -1.533 945 HE3 LYS 117 HE3 LYS 117 -26.236 -15.386 -0.180 946 HZ1 LYS 117 HZ1 LYS 117 -28.242 -15.583 1.108 947 HZ2 LYS 117 HZ2 LYS 117 -29.157 -14.941 -0.111 948 HZ3 LYS 117 HZ3 LYS 117 -28.405 -16.376 -0.318 949 H SER 118 H SER 118 -22.815 -13.317 -1.142 950 HA SER 118 HA SER 118 -21.121 -11.428 -2.604 951 HB2 SER 118 HB2 SER 118 -20.583 -13.954 -2.115 952 HB3 SER 118 HB3 SER 118 -21.647 -14.261 -3.505 953 HG SER 118 HG SER 118 -19.654 -14.012 -4.324 954 H GLN 119 H GLN 119 -21.796 -10.401 -4.306 955 HA GLN 119 HA GLN 119 -24.579 -10.493 -5.162 956 HB2 GLN 119 HB2 GLN 119 -22.910 -8.498 -4.787 957 HB3 GLN 119 HB3 GLN 119 -22.284 -8.938 -6.379 958 HG2 GLN 119 HG2 GLN 119 -24.531 -8.523 -7.367 959 HG3 GLN 119 HG3 GLN 119 -25.182 -8.210 -5.752 960 HE21 GLN 119 HE21 GLN 119 -25.123 -6.263 -8.025 961 HE22 GLN 119 HE22 GLN 119 -24.055 -4.987 -7.505 962 H ASP 120 H ASP 120 -24.949 -10.482 -7.487 963 HA ASP 120 HA ASP 120 -24.078 -12.816 -8.905 964 HB2 ASP 120 HB2 ASP 120 -25.633 -10.287 -9.647 965 HB3 ASP 120 HB3 ASP 120 -25.408 -11.682 -10.684 966 H LEU 121 H LEU 121 -23.536 -12.064 -11.397 967 HA LEU 121 HA LEU 121 -20.844 -10.988 -11.298 968 HB2 LEU 121 HB2 LEU 121 -20.944 -11.135 -13.752 969 HB3 LEU 121 HB3 LEU 121 -21.483 -12.627 -13.001 970 HG LEU 121 HG LEU 121 -23.728 -10.715 -13.477 971 HD11 LEU 121 HD11 LEU 121 -22.562 -10.059 -15.449 972 HD12 LEU 121 HD12 LEU 121 -22.168 -11.760 -15.840 973 HD13 LEU 121 HD13 LEU 121 -23.849 -11.183 -15.910 974 HD21 LEU 121 HD21 LEU 121 -23.936 -13.138 -12.816 975 HD22 LEU 121 HD22 LEU 121 -24.854 -12.682 -14.251 976 HD23 LEU 121 HD23 LEU 121 -23.329 -13.572 -14.416 977 H LYS 122 H LYS 122 -20.397 -9.265 -13.043 978 HA LYS 122 HA LYS 122 -20.937 -6.712 -12.068 979 HB2 LYS 122 HB2 LYS 122 -20.065 -5.921 -14.281 980 HB3 LYS 122 HB3 LYS 122 -19.060 -7.128 -13.468 981 HG2 LYS 122 HG2 LYS 122 -20.659 -8.732 -15.101 982 HG3 LYS 122 HG3 LYS 122 -20.575 -7.274 -16.032 983 HD2 LYS 122 HD2 LYS 122 -18.250 -8.995 -15.101 984 HD3 LYS 122 HD3 LYS 122 -18.922 -8.889 -16.722 985 HE2 LYS 122 HE2 LYS 122 -17.137 -7.473 -16.994 986 HE3 LYS 122 HE3 LYS 122 -18.361 -6.307 -16.471 987 HZ1 LYS 122 HZ1 LYS 122 -17.422 -6.859 -14.137 988 HZ2 LYS 122 HZ2 LYS 122 -16.174 -7.521 -14.916 989 HZ3 LYS 122 HZ3 LYS 122 -16.479 -5.917 -15.126 Start of MODEL 15 1 H1 GLY 1 H GLY 1 30.385 -12.672 13.841 2 HA2 GLY 1 HA2 GLY 1 31.501 -10.997 12.457 3 HA3 GLY 1 HA3 GLY 1 32.310 -12.336 11.601 4 H SER 2 H SER 2 30.008 -10.119 10.977 5 HA SER 2 HA SER 2 28.293 -11.989 9.444 6 HB2 SER 2 HB2 SER 2 27.534 -9.423 10.913 7 HB3 SER 2 HB3 SER 2 26.483 -10.302 9.796 8 HG SER 2 HG SER 2 27.571 -11.386 12.207 9 H ASN 3 H ASN 3 27.751 -11.243 7.453 10 HA ASN 3 HA ASN 3 28.818 -8.671 6.390 11 HB2 ASN 3 HB2 ASN 3 29.456 -11.483 5.441 12 HB3 ASN 3 HB3 ASN 3 29.442 -10.144 4.309 13 HD21 ASN 3 HD21 ASN 3 31.027 -8.467 4.414 14 HD22 ASN 3 HD22 ASN 3 32.433 -8.675 5.458 15 H GLN 4 H GLN 4 26.199 -10.612 6.884 16 HA GLN 4 HA GLN 4 24.784 -10.351 4.358 17 HB2 GLN 4 HB2 GLN 4 23.755 -11.313 7.052 18 HB3 GLN 4 HB3 GLN 4 23.116 -11.678 5.461 19 HG2 GLN 4 HG2 GLN 4 24.181 -13.633 5.740 20 HG3 GLN 4 HG3 GLN 4 25.596 -12.760 5.160 21 HE21 GLN 4 HE21 GLN 4 24.874 -15.006 7.358 22 HE22 GLN 4 HE22 GLN 4 25.899 -14.515 8.706 23 H GLN 5 H GLN 5 22.179 -9.904 5.476 24 HA GLN 5 HA GLN 5 22.204 -7.138 6.520 25 HB2 GLN 5 HB2 GLN 5 21.029 -8.200 3.955 26 HB3 GLN 5 HB3 GLN 5 20.082 -7.019 4.858 27 HG2 GLN 5 HG2 GLN 5 21.656 -5.322 4.659 28 HG3 GLN 5 HG3 GLN 5 23.002 -6.433 4.423 29 HE21 GLN 5 HE21 GLN 5 23.886 -5.915 2.466 30 HE22 GLN 5 HE22 GLN 5 22.976 -5.699 0.991 31 H LEU 6 H LEU 6 19.746 -6.642 7.142 32 HA LEU 6 HA LEU 6 19.089 -8.788 9.047 33 HB2 LEU 6 HB2 LEU 6 17.688 -7.158 10.162 34 HB3 LEU 6 HB3 LEU 6 19.381 -6.748 10.125 35 HG LEU 6 HG LEU 6 17.720 -5.558 7.920 36 HD11 LEU 6 HD11 LEU 6 16.149 -5.360 9.774 37 HD12 LEU 6 HD12 LEU 6 17.415 -4.685 10.826 38 HD13 LEU 6 HD13 LEU 6 16.842 -3.778 9.407 39 HD21 LEU 6 HD21 LEU 6 20.182 -5.115 8.327 40 HD22 LEU 6 HD22 LEU 6 19.181 -3.658 8.336 41 HD23 LEU 6 HD23 LEU 6 19.745 -4.363 9.865 42 H ASN 7 H ASN 7 17.523 -7.211 6.256 43 HA ASN 7 HA ASN 7 15.551 -7.520 5.226 44 HB2 ASN 7 HB2 ASN 7 16.108 -10.256 6.325 45 HB3 ASN 7 HB3 ASN 7 14.731 -9.984 5.271 46 HD21 ASN 7 HD21 ASN 7 15.091 -9.886 3.000 47 HD22 ASN 7 HD22 ASN 7 16.711 -9.961 2.335 48 H ALA 8 H ALA 8 13.176 -8.836 5.698 49 HA ALA 8 HA ALA 8 12.141 -7.405 8.080 50 HB1 ALA 8 HB1 ALA 8 10.604 -8.687 5.782 51 HB2 ALA 8 HB2 ALA 8 9.970 -7.605 7.040 52 HB3 ALA 8 HB3 ALA 8 11.099 -6.973 5.839 53 H THR 9 H THR 9 9.814 -9.244 8.383 54 HA THR 9 HA THR 9 11.138 -11.193 10.018 55 HB THR 9 HB THR 9 8.383 -11.862 9.763 56 HG1 THR 9 HG1 THR 9 7.972 -9.422 10.588 57 HG21 THR 9 HG21 THR 9 8.267 -11.209 12.057 58 HG22 THR 9 HG22 THR 9 9.808 -12.025 11.764 59 HG23 THR 9 HG23 THR 9 9.771 -10.255 11.917 60 H LYS 10 H LYS 10 8.669 -11.880 7.434 61 HA LYS 10 HA LYS 10 10.456 -13.845 6.243 62 HB2 LYS 10 HB2 LYS 10 9.482 -14.902 8.419 63 HB3 LYS 10 HB3 LYS 10 7.924 -14.876 7.612 64 HG2 LYS 10 HG2 LYS 10 8.794 -17.047 7.360 65 HG3 LYS 10 HG3 LYS 10 8.968 -16.304 5.772 66 HD2 LYS 10 HD2 LYS 10 11.379 -15.783 6.363 67 HD3 LYS 10 HD3 LYS 10 11.148 -16.650 7.893 68 HE2 LYS 10 HE2 LYS 10 10.555 -18.710 6.585 69 HE3 LYS 10 HE3 LYS 10 10.828 -17.805 5.087 70 HZ1 LYS 10 HZ1 LYS 10 12.768 -19.055 5.601 71 HZ2 LYS 10 HZ2 LYS 10 13.132 -17.459 5.881 72 HZ3 LYS 10 HZ3 LYS 10 12.850 -18.454 7.136 73 H LYS 11 H LYS 11 7.091 -12.624 6.453 74 HA LYS 11 HA LYS 11 6.154 -13.885 4.031 75 HB2 LYS 11 HB2 LYS 11 5.237 -11.512 5.678 76 HB3 LYS 11 HB3 LYS 11 4.661 -11.650 4.039 77 HG2 LYS 11 HG2 LYS 11 3.036 -12.934 4.690 78 HG3 LYS 11 HG3 LYS 11 4.176 -14.218 5.039 79 HD2 LYS 11 HD2 LYS 11 3.416 -12.047 7.047 80 HD3 LYS 11 HD3 LYS 11 2.490 -13.521 6.867 81 HE2 LYS 11 HE2 LYS 11 5.481 -13.546 7.455 82 HE3 LYS 11 HE3 LYS 11 4.237 -13.500 8.715 83 HZ1 LYS 11 HZ1 LYS 11 4.600 -15.661 6.718 84 HZ2 LYS 11 HZ2 LYS 11 4.842 -15.705 8.348 85 HZ3 LYS 11 HZ3 LYS 11 3.319 -15.537 7.782 86 H ASP 12 H ASP 12 6.584 -13.401 1.903 87 HA ASP 12 HA ASP 12 8.605 -11.412 1.319 88 HB2 ASP 12 HB2 ASP 12 8.131 -11.838 -1.044 89 HB3 ASP 12 HB3 ASP 12 8.439 -13.331 -0.170 90 H LYS 13 H LYS 13 5.072 -11.492 1.401 91 HA LYS 13 HA LYS 13 4.686 -9.076 -0.108 92 HB2 LYS 13 HB2 LYS 13 2.969 -10.418 2.014 93 HB3 LYS 13 HB3 LYS 13 2.473 -9.002 1.072 94 HG2 LYS 13 HG2 LYS 13 3.070 -10.417 -1.035 95 HG3 LYS 13 HG3 LYS 13 3.053 -11.816 0.047 96 HD2 LYS 13 HD2 LYS 13 0.667 -11.417 0.551 97 HD3 LYS 13 HD3 LYS 13 0.735 -9.815 -0.174 98 HE2 LYS 13 HE2 LYS 13 -0.450 -11.209 -1.670 99 HE3 LYS 13 HE3 LYS 13 1.097 -10.820 -2.418 100 HZ1 LYS 13 HZ1 LYS 13 0.281 -13.190 -2.512 101 HZ2 LYS 13 HZ2 LYS 13 1.856 -13.030 -2.003 102 HZ3 LYS 13 HZ3 LYS 13 0.626 -13.358 -0.959 103 H LEU 14 H LEU 14 4.933 -9.676 3.446 104 HA LEU 14 HA LEU 14 4.831 -6.870 4.033 105 HB2 LEU 14 HB2 LEU 14 6.035 -9.151 5.645 106 HB3 LEU 14 HB3 LEU 14 5.687 -7.530 6.259 107 HG LEU 14 HG LEU 14 3.615 -9.519 5.208 108 HD11 LEU 14 HD11 LEU 14 4.576 -10.114 7.416 109 HD12 LEU 14 HD12 LEU 14 4.131 -8.512 8.021 110 HD13 LEU 14 HD13 LEU 14 2.868 -9.654 7.532 111 HD21 LEU 14 HD21 LEU 14 2.824 -7.253 4.756 112 HD22 LEU 14 HD22 LEU 14 1.949 -7.910 6.127 113 HD23 LEU 14 HD23 LEU 14 3.255 -6.739 6.407 114 H GLN 15 H GLN 15 7.537 -9.049 3.192 115 HA GLN 15 HA GLN 15 9.552 -7.188 3.950 116 HB2 GLN 15 HB2 GLN 15 9.835 -9.648 3.559 117 HB3 GLN 15 HB3 GLN 15 9.814 -9.352 1.818 118 HG2 GLN 15 HG2 GLN 15 11.912 -8.239 1.875 119 HG3 GLN 15 HG3 GLN 15 11.740 -7.786 3.562 120 HE21 GLN 15 HE21 GLN 15 13.425 -10.086 1.555 121 HE22 GLN 15 HE22 GLN 15 13.583 -11.297 2.820 122 H VAL 16 H VAL 16 7.930 -7.649 0.700 123 HA VAL 16 HA VAL 16 9.624 -5.661 -0.496 124 HB VAL 16 HB VAL 16 7.970 -5.542 -2.295 125 HG11 VAL 16 HG11 VAL 16 8.187 -7.834 -3.095 126 HG12 VAL 16 HG12 VAL 16 9.680 -7.234 -2.341 127 HG13 VAL 16 HG13 VAL 16 8.638 -8.370 -1.464 128 HG21 VAL 16 HG21 VAL 16 5.862 -5.809 -1.165 129 HG22 VAL 16 HG22 VAL 16 6.043 -7.088 -2.374 130 HG23 VAL 16 HG23 VAL 16 6.294 -7.462 -0.680 131 H ILE 17 H ILE 17 6.520 -5.402 1.258 132 HA ILE 17 HA ILE 17 6.240 -2.605 0.611 133 HB ILE 17 HB ILE 17 4.959 -4.044 2.945 134 HG12 ILE 17 HG12 ILE 17 3.659 -3.643 0.201 135 HG13 ILE 17 HG13 ILE 17 4.494 -5.116 0.604 136 HG21 ILE 17 HG21 ILE 17 4.766 -1.598 3.010 137 HG22 ILE 17 HG22 ILE 17 4.188 -1.548 1.336 138 HG23 ILE 17 HG23 ILE 17 3.186 -2.274 2.603 139 HD11 ILE 17 HD11 ILE 17 1.953 -4.060 1.802 140 HD12 ILE 17 HD12 ILE 17 2.335 -5.683 1.212 141 HD13 ILE 17 HD13 ILE 17 2.983 -5.166 2.756 142 H ASP 18 H ASP 18 7.750 -4.411 3.290 143 HA ASP 18 HA ASP 18 8.332 -2.060 4.869 144 HB2 ASP 18 HB2 ASP 18 8.467 -4.574 5.592 145 HB3 ASP 18 HB3 ASP 18 10.126 -4.479 4.995 146 H TRP 19 H TRP 19 9.993 -3.698 2.214 147 HA TRP 19 HA TRP 19 12.444 -2.257 2.364 148 HB2 TRP 19 HB2 TRP 19 12.125 -4.349 1.093 149 HB3 TRP 19 HB3 TRP 19 11.035 -3.545 -0.020 150 HD1 TRP 19 HD1 TRP 19 12.371 -1.288 -1.314 151 HE1 TRP 19 HE1 TRP 19 14.689 -1.246 -2.346 152 HE3 TRP 19 HE3 TRP 19 14.323 -5.506 0.872 153 HZ2 TRP 19 HZ2 TRP 19 16.954 -3.043 -2.586 154 HZ3 TRP 19 HZ3 TRP 19 16.563 -6.320 0.197 155 HH2 TRP 19 HH2 TRP 19 17.880 -5.109 -1.496 156 H LEU 20 H LEU 20 9.506 -1.685 0.254 157 HA LEU 20 HA LEU 20 10.571 0.784 -0.668 158 HB2 LEU 20 HB2 LEU 20 8.500 1.226 -1.687 159 HB3 LEU 20 HB3 LEU 20 8.915 -0.461 -1.878 160 HG LEU 20 HG LEU 20 7.325 -0.636 0.302 161 HD11 LEU 20 HD11 LEU 20 6.141 1.653 -1.292 162 HD12 LEU 20 HD12 LEU 20 5.340 0.779 0.037 163 HD13 LEU 20 HD13 LEU 20 6.768 1.768 0.359 164 HD21 LEU 20 HD21 LEU 20 7.069 -1.991 -1.656 165 HD22 LEU 20 HD22 LEU 20 5.504 -1.336 -1.177 166 HD23 LEU 20 HD23 LEU 20 6.377 -0.620 -2.564 167 H ILE 21 H ILE 21 8.685 0.092 2.288 168 HA ILE 21 HA ILE 21 8.073 2.815 2.916 169 HB ILE 21 HB ILE 21 8.483 0.330 4.632 170 HG12 ILE 21 HG12 ILE 21 5.882 1.872 4.335 171 HG13 ILE 21 HG13 ILE 21 6.351 0.706 3.125 172 HG21 ILE 21 HG21 ILE 21 7.666 3.104 5.614 173 HG22 ILE 21 HG22 ILE 21 7.505 1.617 6.559 174 HG23 ILE 21 HG23 ILE 21 9.095 2.163 6.103 175 HD11 ILE 21 HD11 ILE 21 6.465 -1.055 4.920 176 HD12 ILE 21 HD12 ILE 21 5.960 0.159 6.101 177 HD13 ILE 21 HD13 ILE 21 4.873 -0.306 4.806 178 H GLU 22 H GLU 22 10.943 0.760 3.668 179 HA GLU 22 HA GLU 22 12.230 2.903 5.147 180 HB2 GLU 22 HB2 GLU 22 12.354 0.431 5.591 181 HB3 GLU 22 HB3 GLU 22 13.381 0.269 4.163 182 HG2 GLU 22 HG2 GLU 22 15.109 1.640 5.176 183 HG3 GLU 22 HG3 GLU 22 14.008 2.169 6.473 184 H ASN 23 H ASN 23 12.237 1.848 1.802 185 HA ASN 23 HA ASN 23 14.785 3.035 1.093 186 HB2 ASN 23 HB2 ASN 23 12.449 2.030 -0.543 187 HB3 ASN 23 HB3 ASN 23 13.687 3.032 -1.284 188 HD21 ASN 23 HD21 ASN 23 13.873 0.362 1.132 189 HD22 ASN 23 HD22 ASN 23 15.112 -0.534 0.264 190 H PHE 24 H PHE 24 11.391 4.258 0.891 191 HA PHE 24 HA PHE 24 12.581 6.977 0.555 192 HB2 PHE 24 HB2 PHE 24 10.082 5.849 -0.636 193 HB3 PHE 24 HB3 PHE 24 10.213 7.565 -0.285 194 HD1 PHE 24 HD1 PHE 24 12.822 8.499 -0.998 195 HD2 PHE 24 HD2 PHE 24 10.363 5.539 -2.946 196 HE1 PHE 24 HE1 PHE 24 13.931 8.984 -3.135 197 HE2 PHE 24 HE2 PHE 24 11.494 6.031 -5.102 198 HZ PHE 24 HZ PHE 24 13.274 7.755 -5.196 199 HA PRO 25 HA PRO 25 10.696 6.901 4.710 200 HB2 PRO 25 HB2 PRO 25 12.665 8.036 6.122 201 HB3 PRO 25 HB3 PRO 25 12.835 6.384 5.487 202 HG2 PRO 25 HG2 PRO 25 13.834 8.949 4.165 203 HG3 PRO 25 HG3 PRO 25 14.759 7.470 4.582 204 HD2 PRO 25 HD2 PRO 25 13.711 7.827 2.121 205 HD3 PRO 25 HD3 PRO 25 13.766 6.211 2.905 206 H ASN 26 H ASN 26 10.148 8.806 2.434 207 HA ASN 26 HA ASN 26 10.196 11.459 3.838 208 HB2 ASN 26 HB2 ASN 26 9.527 10.788 0.969 209 HB3 ASN 26 HB3 ASN 26 9.470 12.378 1.698 210 HD21 ASN 26 HD21 ASN 26 12.192 11.207 3.185 211 HD22 ASN 26 HD22 ASN 26 13.352 11.715 1.978 212 H ALA 27 H ALA 27 8.146 8.807 3.055 213 HA ALA 27 HA ALA 27 5.975 9.479 4.706 214 HB1 ALA 27 HB1 ALA 27 5.607 10.195 1.740 215 HB2 ALA 27 HB2 ALA 27 4.270 9.863 2.872 216 HB3 ALA 27 HB3 ALA 27 5.326 11.245 3.156 217 H PHE 28 H PHE 28 5.443 7.435 5.130 218 HA PHE 28 HA PHE 28 4.070 5.698 3.543 219 HB2 PHE 28 HB2 PHE 28 6.971 5.299 3.241 220 HB3 PHE 28 HB3 PHE 28 6.173 3.888 3.876 221 HD1 PHE 28 HD1 PHE 28 3.885 3.240 2.626 222 HD2 PHE 28 HD2 PHE 28 7.011 5.652 0.892 223 HE1 PHE 28 HE1 PHE 28 3.007 2.728 0.370 224 HE2 PHE 28 HE2 PHE 28 6.073 5.207 -1.368 225 HZ PHE 28 HZ PHE 28 4.105 3.724 -1.640 226 H PHE 29 H PHE 29 3.785 3.478 4.950 227 HA PHE 29 HA PHE 29 4.589 3.818 7.726 228 HB2 PHE 29 HB2 PHE 29 1.664 3.923 6.952 229 HB3 PHE 29 HB3 PHE 29 2.199 3.428 8.549 230 HD1 PHE 29 HD1 PHE 29 1.155 6.248 6.692 231 HD2 PHE 29 HD2 PHE 29 3.997 5.029 9.692 232 HE1 PHE 29 HE1 PHE 29 1.640 8.629 7.198 233 HE2 PHE 29 HE2 PHE 29 4.346 7.436 10.297 234 HZ PHE 29 HZ PHE 29 3.197 9.197 8.998 235 H LYS 30 H LYS 30 4.349 2.027 8.957 236 HA LYS 30 HA LYS 30 4.233 -0.531 7.504 237 HB2 LYS 30 HB2 LYS 30 5.017 0.233 10.347 238 HB3 LYS 30 HB3 LYS 30 5.064 -1.419 9.704 239 HG2 LYS 30 HG2 LYS 30 6.758 -0.897 8.131 240 HG3 LYS 30 HG3 LYS 30 6.538 0.854 8.337 241 HD2 LYS 30 HD2 LYS 30 7.416 0.847 10.533 242 HD3 LYS 30 HD3 LYS 30 7.521 -0.941 10.555 243 HE2 LYS 30 HE2 LYS 30 9.021 -0.796 8.493 244 HE3 LYS 30 HE3 LYS 30 9.061 0.961 8.712 245 HZ1 LYS 30 HZ1 LYS 30 10.963 0.049 9.675 246 HZ2 LYS 30 HZ2 LYS 30 10.043 0.510 10.936 247 HZ3 LYS 30 HZ3 LYS 30 10.140 -1.096 10.533 248 H LYS 31 H LYS 31 2.958 0.421 10.727 249 HA LYS 31 HA LYS 31 0.999 -1.679 10.629 250 HB2 LYS 31 HB2 LYS 31 1.246 0.710 12.491 251 HB3 LYS 31 HB3 LYS 31 0.047 -0.574 12.641 252 HG2 LYS 31 HG2 LYS 31 2.548 -1.924 12.435 253 HG3 LYS 31 HG3 LYS 31 2.831 -0.543 13.502 254 HD2 LYS 31 HD2 LYS 31 0.811 -1.243 14.847 255 HD3 LYS 31 HD3 LYS 31 0.663 -2.677 13.810 256 HE2 LYS 31 HE2 LYS 31 3.024 -3.296 14.472 257 HE3 LYS 31 HE3 LYS 31 3.030 -1.900 15.563 258 HZ1 LYS 31 HZ1 LYS 31 1.036 -2.970 16.644 259 HZ2 LYS 31 HZ2 LYS 31 1.411 -4.366 15.815 260 HZ3 LYS 31 HZ3 LYS 31 2.461 -3.681 16.869 261 H GLY 32 H GLY 32 -1.093 -1.723 9.989 262 HA2 GLY 32 HA2 GLY 32 -2.152 0.158 8.224 263 HA3 GLY 32 HA3 GLY 32 -3.077 -1.069 9.085 264 H ASN 33 H ASN 33 -2.408 0.009 11.783 265 HA ASN 33 HA ASN 33 -4.573 1.770 12.135 266 HB2 ASN 33 HB2 ASN 33 -3.602 2.178 14.389 267 HB3 ASN 33 HB3 ASN 33 -3.853 0.493 13.984 268 HD21 ASN 33 HD21 ASN 33 -1.080 2.905 13.637 269 HD22 ASN 33 HD22 ASN 33 0.065 1.751 14.305 270 H GLN 34 H GLN 34 -1.277 2.623 11.183 271 HA GLN 34 HA GLN 34 -2.015 5.500 11.538 272 HB2 GLN 34 HB2 GLN 34 0.382 5.999 11.723 273 HB3 GLN 34 HB3 GLN 34 -0.251 5.013 13.029 274 HG2 GLN 34 HG2 GLN 34 0.722 2.971 11.844 275 HG3 GLN 34 HG3 GLN 34 1.536 4.091 10.759 276 HE21 GLN 34 HE21 GLN 34 3.341 5.417 11.684 277 HE22 GLN 34 HE22 GLN 34 3.980 4.983 13.249 278 H VAL 35 H VAL 35 -1.864 3.156 9.255 279 HA VAL 35 HA VAL 35 -0.379 4.423 7.195 280 HB VAL 35 HB VAL 35 -1.242 1.999 7.368 281 HG11 VAL 35 HG11 VAL 35 -3.226 1.334 6.220 282 HG12 VAL 35 HG12 VAL 35 -3.736 2.611 7.308 283 HG13 VAL 35 HG13 VAL 35 -3.524 2.984 5.613 284 HG21 VAL 35 HG21 VAL 35 -1.250 3.375 4.661 285 HG22 VAL 35 HG22 VAL 35 0.174 2.794 5.548 286 HG23 VAL 35 HG23 VAL 35 -1.032 1.641 4.971 287 H LYS 36 H LYS 36 -0.987 5.660 5.378 288 HA LYS 36 HA LYS 36 -3.573 7.125 5.503 289 HB2 LYS 36 HB2 LYS 36 -0.726 8.197 5.465 290 HB3 LYS 36 HB3 LYS 36 -1.975 9.054 4.584 291 HG2 LYS 36 HG2 LYS 36 -3.312 9.334 6.635 292 HG3 LYS 36 HG3 LYS 36 -2.047 8.494 7.576 293 HD2 LYS 36 HD2 LYS 36 -0.395 10.178 6.903 294 HD3 LYS 36 HD3 LYS 36 -1.570 10.989 5.874 295 HE2 LYS 36 HE2 LYS 36 -1.950 10.751 8.877 296 HE3 LYS 36 HE3 LYS 36 -0.995 12.027 8.117 297 HZ1 LYS 36 HZ1 LYS 36 -2.879 12.766 6.920 298 HZ2 LYS 36 HZ2 LYS 36 -3.873 11.622 7.608 299 HZ3 LYS 36 HZ3 LYS 36 -3.158 12.776 8.527 300 HA PRO 37 HA PRO 37 -3.327 5.999 1.217 301 HB2 PRO 37 HB2 PRO 37 -4.738 7.944 -0.094 302 HB3 PRO 37 HB3 PRO 37 -5.518 6.753 0.995 303 HG2 PRO 37 HG2 PRO 37 -4.714 9.591 1.636 304 HG3 PRO 37 HG3 PRO 37 -6.246 8.740 2.011 305 HD2 PRO 37 HD2 PRO 37 -4.196 9.026 3.822 306 HD3 PRO 37 HD3 PRO 37 -5.278 7.600 3.817 307 H LEU 38 H LEU 38 -1.748 6.213 -0.268 308 HA LEU 38 HA LEU 38 0.058 8.584 -0.169 309 HB2 LEU 38 HB2 LEU 38 0.309 5.826 -1.455 310 HB3 LEU 38 HB3 LEU 38 1.419 7.136 -1.752 311 HG LEU 38 HG LEU 38 2.486 5.734 -0.264 312 HD11 LEU 38 HD11 LEU 38 3.025 7.127 1.615 313 HD12 LEU 38 HD12 LEU 38 2.740 8.168 0.222 314 HD13 LEU 38 HD13 LEU 38 1.487 8.020 1.478 315 HD21 LEU 38 HD21 LEU 38 0.147 5.867 1.619 316 HD22 LEU 38 HD22 LEU 38 0.550 4.490 0.574 317 HD23 LEU 38 HD23 LEU 38 1.663 4.975 1.863 318 H LYS 39 H LYS 39 0.955 9.298 -2.341 319 HA LYS 39 HA LYS 39 -0.991 10.442 -3.992 320 HB2 LYS 39 HB2 LYS 39 1.334 11.188 -3.858 321 HB3 LYS 39 HB3 LYS 39 1.919 9.648 -4.421 322 HG2 LYS 39 HG2 LYS 39 0.191 10.802 -6.490 323 HG3 LYS 39 HG3 LYS 39 1.338 11.999 -5.946 324 HD2 LYS 39 HD2 LYS 39 3.197 10.492 -6.304 325 HD3 LYS 39 HD3 LYS 39 2.119 9.176 -6.754 326 HE2 LYS 39 HE2 LYS 39 2.874 9.915 -8.798 327 HE3 LYS 39 HE3 LYS 39 1.334 10.761 -8.675 328 HZ1 LYS 39 HZ1 LYS 39 3.105 12.241 -9.404 329 HZ2 LYS 39 HZ2 LYS 39 2.646 12.734 -7.921 330 HZ3 LYS 39 HZ3 LYS 39 4.031 11.882 -8.114 331 H ILE 40 H ILE 40 -1.743 9.923 -6.114 332 HA ILE 40 HA ILE 40 -2.419 7.183 -6.539 333 HB ILE 40 HB ILE 40 -3.760 9.122 -7.354 334 HG12 ILE 40 HG12 ILE 40 -4.294 8.272 -9.621 335 HG13 ILE 40 HG13 ILE 40 -2.882 7.230 -9.590 336 HG21 ILE 40 HG21 ILE 40 -3.140 10.320 -9.392 337 HG22 ILE 40 HG22 ILE 40 -1.877 10.565 -8.176 338 HG23 ILE 40 HG23 ILE 40 -1.626 9.434 -9.510 339 HD11 ILE 40 HD11 ILE 40 -5.144 7.084 -7.540 340 HD12 ILE 40 HD12 ILE 40 -5.084 6.118 -9.023 341 HD13 ILE 40 HD13 ILE 40 -3.831 5.900 -7.793 342 H GLY 41 H GLY 41 -1.422 5.602 -7.850 343 HA2 GLY 41 HA2 GLY 41 0.238 4.592 -9.053 344 HA3 GLY 41 HA3 GLY 41 0.539 6.158 -9.800 345 H ILE 42 H ILE 42 1.032 6.125 -6.312 346 HA ILE 42 HA ILE 42 3.669 6.918 -6.512 347 HB ILE 42 HB ILE 42 2.267 7.172 -4.524 348 HG12 ILE 42 HG12 ILE 42 4.859 5.772 -3.795 349 HG13 ILE 42 HG13 ILE 42 4.786 7.338 -4.602 350 HG21 ILE 42 HG21 ILE 42 2.181 5.293 -2.837 351 HG22 ILE 42 HG22 ILE 42 1.226 4.988 -4.288 352 HG23 ILE 42 HG23 ILE 42 2.806 4.197 -4.052 353 HD11 ILE 42 HD11 ILE 42 3.727 6.701 -1.842 354 HD12 ILE 42 HD12 ILE 42 5.080 7.743 -2.257 355 HD13 ILE 42 HD13 ILE 42 3.437 8.244 -2.691 356 H PHE 43 H PHE 43 2.439 3.601 -6.689 357 HA PHE 43 HA PHE 43 4.905 2.227 -6.152 358 HB2 PHE 43 HB2 PHE 43 3.233 0.666 -6.193 359 HB3 PHE 43 HB3 PHE 43 2.269 1.559 -7.353 360 HD1 PHE 43 HD1 PHE 43 2.345 1.141 -9.709 361 HD2 PHE 43 HD2 PHE 43 5.152 -0.875 -7.100 362 HE1 PHE 43 HE1 PHE 43 3.103 -0.295 -11.583 363 HE2 PHE 43 HE2 PHE 43 5.908 -2.245 -8.991 364 HZ PHE 43 HZ PHE 43 4.904 -1.947 -11.231 365 H ASP 44 H ASP 44 3.571 3.733 -9.114 366 HA ASP 44 HA ASP 44 5.559 2.668 -10.902 367 HB2 ASP 44 HB2 ASP 44 3.143 3.833 -11.269 368 HB3 ASP 44 HB3 ASP 44 4.144 5.267 -11.482 369 H ASP 45 H ASP 45 5.363 5.392 -8.718 370 HA ASP 45 HA ASP 45 7.572 6.897 -9.864 371 HB2 ASP 45 HB2 ASP 45 5.463 7.289 -7.956 372 HB3 ASP 45 HB3 ASP 45 6.962 7.479 -7.077 373 H LEU 46 H LEU 46 7.019 4.714 -7.146 374 HA LEU 46 HA LEU 46 9.680 4.682 -6.050 375 HB2 LEU 46 HB2 LEU 46 7.797 4.298 -4.649 376 HB3 LEU 46 HB3 LEU 46 7.137 3.071 -5.696 377 HG LEU 46 HG LEU 46 7.949 2.268 -3.564 378 HD11 LEU 46 HD11 LEU 46 9.636 0.819 -5.575 379 HD12 LEU 46 HD12 LEU 46 8.637 0.214 -4.258 380 HD13 LEU 46 HD13 LEU 46 7.864 0.868 -5.721 381 HD21 LEU 46 HD21 LEU 46 9.920 3.502 -3.069 382 HD22 LEU 46 HD22 LEU 46 10.385 1.814 -3.184 383 HD23 LEU 46 HD23 LEU 46 10.768 2.929 -4.505 384 H ILE 47 H ILE 47 7.982 2.509 -8.418 385 HA ILE 47 HA ILE 47 9.767 0.380 -8.218 386 HB ILE 47 HB ILE 47 7.569 0.598 -9.524 387 HG12 ILE 47 HG12 ILE 47 9.165 -1.382 -9.367 388 HG13 ILE 47 HG13 ILE 47 7.856 -1.379 -10.531 389 HG21 ILE 47 HG21 ILE 47 8.157 2.417 -11.025 390 HG22 ILE 47 HG22 ILE 47 9.426 1.477 -11.784 391 HG23 ILE 47 HG23 ILE 47 7.725 0.977 -11.960 392 HD11 ILE 47 HD11 ILE 47 9.276 -1.089 -12.367 393 HD12 ILE 47 HD12 ILE 47 10.639 -0.536 -11.380 394 HD13 ILE 47 HD13 ILE 47 10.136 -2.214 -11.294 395 H ASP 48 H ASP 48 10.138 3.536 -9.700 396 HA ASP 48 HA ASP 48 12.239 3.147 -11.472 397 HB2 ASP 48 HB2 ASP 48 10.717 5.192 -10.850 398 HB3 ASP 48 HB3 ASP 48 11.973 5.602 -9.682 399 H PHE 49 H PHE 49 12.183 3.480 -7.984 400 HA PHE 49 HA PHE 49 15.076 3.726 -7.596 401 HB2 PHE 49 HB2 PHE 49 13.199 4.630 -6.076 402 HB3 PHE 49 HB3 PHE 49 13.030 2.990 -5.480 403 HD1 PHE 49 HD1 PHE 49 13.349 4.662 -3.415 404 HD2 PHE 49 HD2 PHE 49 16.568 3.432 -6.024 405 HE1 PHE 49 HE1 PHE 49 15.009 5.436 -1.766 406 HE2 PHE 49 HE2 PHE 49 18.191 4.110 -4.331 407 HZ PHE 49 HZ PHE 49 17.421 5.169 -2.201 408 H TYR 50 H TYR 50 12.612 1.154 -7.657 409 HA TYR 50 HA TYR 50 14.244 -0.922 -6.504 410 HB2 TYR 50 HB2 TYR 50 12.012 -1.488 -6.503 411 HB3 TYR 50 HB3 TYR 50 11.702 -0.861 -8.097 412 HD1 TYR 50 HD1 TYR 50 12.206 -3.891 -6.251 413 HD2 TYR 50 HD2 TYR 50 12.744 -2.093 -10.144 414 HE1 TYR 50 HE1 TYR 50 12.124 -6.125 -7.311 415 HE2 TYR 50 HE2 TYR 50 12.885 -4.311 -11.155 416 HH TYR 50 HH TYR 50 12.832 -6.622 -10.792 417 H GLU 51 H GLU 51 14.014 0.514 -9.714 418 HA GLU 51 HA GLU 51 15.517 -1.519 -11.098 419 HB2 GLU 51 HB2 GLU 51 14.882 1.385 -11.702 420 HB3 GLU 51 HB3 GLU 51 15.860 0.397 -12.787 421 HG2 GLU 51 HG2 GLU 51 13.175 -0.596 -11.808 422 HG3 GLU 51 HG3 GLU 51 13.279 0.541 -13.144 423 H ARG 52 H ARG 52 16.395 1.041 -8.900 424 HA ARG 52 HA ARG 52 19.137 1.305 -9.821 425 HB2 ARG 52 HB2 ARG 52 17.603 2.938 -8.296 426 HB3 ARG 52 HB3 ARG 52 18.409 2.035 -7.012 427 HG2 ARG 52 HG2 ARG 52 19.843 3.869 -7.361 428 HG3 ARG 52 HG3 ARG 52 20.627 2.586 -8.265 429 HD2 ARG 52 HD2 ARG 52 20.683 4.503 -9.691 430 HD3 ARG 52 HD3 ARG 52 19.368 3.514 -10.355 431 HE ARG 52 HE ARG 52 18.351 5.257 -8.360 432 HH11 ARG 52 HH11 ARG 52 19.784 5.768 -11.597 433 HH12 ARG 52 HH12 ARG 52 18.975 7.290 -11.795 434 HH21 ARG 52 HH21 ARG 52 17.353 7.106 -8.642 435 HH22 ARG 52 HH22 ARG 52 17.559 8.137 -10.022 436 H LEU 53 H LEU 53 17.380 -1.050 -7.781 437 HA LEU 53 HA LEU 53 19.693 -1.968 -6.350 438 HB2 LEU 53 HB2 LEU 53 17.226 -3.584 -7.068 439 HB3 LEU 53 HB3 LEU 53 18.249 -3.731 -5.646 440 HG LEU 53 HG LEU 53 16.336 -1.413 -6.224 441 HD11 LEU 53 HD11 LEU 53 15.106 -3.415 -5.895 442 HD12 LEU 53 HD12 LEU 53 16.059 -3.851 -4.471 443 HD13 LEU 53 HD13 LEU 53 14.972 -2.422 -4.436 444 HD21 LEU 53 HD21 LEU 53 18.208 -1.896 -3.921 445 HD22 LEU 53 HD22 LEU 53 18.033 -0.490 -4.974 446 HD23 LEU 53 HD23 LEU 53 16.758 -0.842 -3.816 447 H ASP 54 H ASP 54 21.288 -2.943 -7.434 448 HA ASP 54 HA ASP 54 21.119 -3.718 -10.205 449 HB2 ASP 54 HB2 ASP 54 23.128 -2.840 -9.320 450 HB3 ASP 54 HB3 ASP 54 23.224 -4.064 -8.064 451 H THR 55 H THR 55 20.418 -5.478 -7.298 452 HA THR 55 HA THR 55 19.939 -7.942 -8.900 453 HB THR 55 HB THR 55 20.692 -9.239 -6.867 454 HG1 THR 55 HG1 THR 55 21.854 -8.313 -5.388 455 HG21 THR 55 HG21 THR 55 22.024 -9.144 -8.958 456 HG22 THR 55 HG22 THR 55 22.861 -7.695 -8.358 457 HG23 THR 55 HG23 THR 55 23.050 -9.245 -7.517 458 HA PRO 56 HA PRO 56 16.204 -6.535 -6.694 459 HB2 PRO 56 HB2 PRO 56 14.411 -7.366 -8.562 460 HB3 PRO 56 HB3 PRO 56 15.266 -5.788 -8.622 461 HG2 PRO 56 HG2 PRO 56 15.856 -8.349 -10.124 462 HG3 PRO 56 HG3 PRO 56 15.903 -6.658 -10.728 463 HD2 PRO 56 HD2 PRO 56 18.130 -8.049 -9.939 464 HD3 PRO 56 HD3 PRO 56 17.998 -6.279 -9.767 465 HA PRO 57 HA PRO 57 15.841 -10.866 -5.294 466 HB2 PRO 57 HB2 PRO 57 14.515 -10.456 -2.924 467 HB3 PRO 57 HB3 PRO 57 16.264 -10.186 -3.156 468 HG2 PRO 57 HG2 PRO 57 14.032 -8.132 -3.180 469 HG3 PRO 57 HG3 PRO 57 15.639 -8.021 -2.399 470 HD2 PRO 57 HD2 PRO 57 15.083 -6.905 -4.855 471 HD3 PRO 57 HD3 PRO 57 16.692 -7.523 -4.417 472 H PHE 58 H PHE 58 12.920 -8.860 -4.523 473 HA PHE 58 HA PHE 58 11.209 -11.069 -5.483 474 HB2 PHE 58 HB2 PHE 58 10.551 -8.442 -4.123 475 HB3 PHE 58 HB3 PHE 58 9.378 -9.692 -4.543 476 HD1 PHE 58 HD1 PHE 58 9.995 -12.154 -3.691 477 HD2 PHE 58 HD2 PHE 58 11.471 -8.520 -1.909 478 HE1 PHE 58 HE1 PHE 58 10.532 -13.381 -1.600 479 HE2 PHE 58 HE2 PHE 58 11.892 -9.722 0.188 480 HZ PHE 58 HZ PHE 58 11.467 -12.173 0.355 481 H SER 59 H SER 59 9.233 -10.313 -6.875 482 HA SER 59 HA SER 59 10.424 -8.955 -9.178 483 HB2 SER 59 HB2 SER 59 8.620 -9.963 -10.414 484 HB3 SER 59 HB3 SER 59 9.298 -11.194 -9.342 485 HG SER 59 HG SER 59 7.089 -11.279 -9.129 486 H LYS 60 H LYS 60 9.217 -7.506 -10.471 487 HA LYS 60 HA LYS 60 8.247 -5.169 -9.082 488 HB2 LYS 60 HB2 LYS 60 7.787 -6.061 -11.979 489 HB3 LYS 60 HB3 LYS 60 7.576 -4.427 -11.343 490 HG2 LYS 60 HG2 LYS 60 10.000 -4.320 -10.819 491 HG3 LYS 60 HG3 LYS 60 10.242 -5.933 -11.499 492 HD2 LYS 60 HD2 LYS 60 9.633 -5.220 -13.705 493 HD3 LYS 60 HD3 LYS 60 9.027 -3.680 -13.111 494 HE2 LYS 60 HE2 LYS 60 10.992 -2.989 -14.031 495 HE3 LYS 60 HE3 LYS 60 11.488 -3.226 -12.369 496 HZ1 LYS 60 HZ1 LYS 60 13.077 -4.068 -13.765 497 HZ2 LYS 60 HZ2 LYS 60 12.423 -5.428 -13.123 498 HZ3 LYS 60 HZ3 LYS 60 12.077 -4.975 -14.680 499 H LYS 61 H LYS 61 6.699 -8.025 -10.418 500 HA LYS 61 HA LYS 61 3.994 -7.147 -10.116 501 HB2 LYS 61 HB2 LYS 61 5.003 -9.147 -11.504 502 HB3 LYS 61 HB3 LYS 61 4.871 -10.047 -9.997 503 HG2 LYS 61 HG2 LYS 61 2.751 -10.476 -10.554 504 HG3 LYS 61 HG3 LYS 61 2.354 -8.805 -10.205 505 HD2 LYS 61 HD2 LYS 61 3.156 -9.941 -12.923 506 HD3 LYS 61 HD3 LYS 61 1.524 -9.544 -12.384 507 HE2 LYS 61 HE2 LYS 61 2.463 -7.121 -12.082 508 HE3 LYS 61 HE3 LYS 61 3.771 -7.668 -13.136 509 HZ1 LYS 61 HZ1 LYS 61 0.879 -7.701 -13.771 510 HZ2 LYS 61 HZ2 LYS 61 1.967 -6.671 -14.398 511 HZ3 LYS 61 HZ3 LYS 61 2.040 -8.284 -14.773 512 H SER 62 H SER 62 6.099 -9.280 -8.010 513 HA SER 62 HA SER 62 4.311 -9.579 -5.897 514 HB2 SER 62 HB2 SER 62 7.347 -9.472 -5.959 515 HB3 SER 62 HB3 SER 62 6.416 -9.898 -4.535 516 HG SER 62 HG SER 62 6.698 -11.800 -5.367 517 H LEU 63 H LEU 63 6.771 -6.966 -6.342 518 HA LEU 63 HA LEU 63 6.417 -5.618 -3.931 519 HB2 LEU 63 HB2 LEU 63 8.168 -5.131 -5.629 520 HB3 LEU 63 HB3 LEU 63 6.952 -4.455 -6.686 521 HG LEU 63 HG LEU 63 6.592 -3.039 -4.263 522 HD11 LEU 63 HD11 LEU 63 8.799 -2.137 -3.694 523 HD12 LEU 63 HD12 LEU 63 8.740 -3.863 -3.373 524 HD13 LEU 63 HD13 LEU 63 9.576 -3.262 -4.821 525 HD21 LEU 63 HD21 LEU 63 8.399 -1.800 -6.339 526 HD22 LEU 63 HD22 LEU 63 6.765 -2.274 -6.804 527 HD23 LEU 63 HD23 LEU 63 7.008 -1.165 -5.447 528 H ARG 64 H ARG 64 4.631 -5.027 -6.992 529 HA ARG 64 HA ARG 64 2.845 -3.151 -5.792 530 HB2 ARG 64 HB2 ARG 64 3.407 -3.294 -8.214 531 HB3 ARG 64 HB3 ARG 64 2.573 -4.837 -8.324 532 HG2 ARG 64 HG2 ARG 64 1.309 -2.883 -9.197 533 HG3 ARG 64 HG3 ARG 64 0.432 -3.805 -7.956 534 HD2 ARG 64 HD2 ARG 64 0.552 -2.132 -6.385 535 HD3 ARG 64 HD3 ARG 64 2.055 -1.462 -7.037 536 HE ARG 64 HE ARG 64 0.424 -0.912 -9.060 537 HH11 ARG 64 HH11 ARG 64 -0.176 -0.412 -5.600 538 HH12 ARG 64 HH12 ARG 64 -0.871 1.161 -5.811 539 HH21 ARG 64 HH21 ARG 64 -0.513 1.053 -9.357 540 HH22 ARG 64 HH22 ARG 64 -1.078 2.038 -8.041 541 H GLU 65 H GLU 65 2.480 -6.650 -6.466 542 HA GLU 65 HA GLU 65 -0.251 -6.943 -5.871 543 HB2 GLU 65 HB2 GLU 65 2.192 -8.738 -5.811 544 HB3 GLU 65 HB3 GLU 65 0.729 -9.332 -5.060 545 HG2 GLU 65 HG2 GLU 65 0.895 -8.358 -7.939 546 HG3 GLU 65 HG3 GLU 65 0.939 -10.051 -7.418 547 H ALA 66 H ALA 66 2.581 -7.140 -3.709 548 HA ALA 66 HA ALA 66 1.113 -7.776 -1.345 549 HB1 ALA 66 HB1 ALA 66 3.229 -7.151 -0.258 550 HB2 ALA 66 HB2 ALA 66 3.571 -8.095 -1.733 551 HB3 ALA 66 HB3 ALA 66 3.760 -6.330 -1.735 552 H LEU 67 H LEU 67 2.249 -4.670 -2.737 553 HA LEU 67 HA LEU 67 1.542 -2.973 -0.638 554 HB2 LEU 67 HB2 LEU 67 2.718 -2.645 -3.023 555 HB3 LEU 67 HB3 LEU 67 1.135 -2.048 -3.483 556 HG LEU 67 HG LEU 67 2.851 -1.019 -1.160 557 HD11 LEU 67 HD11 LEU 67 3.896 -0.616 -3.363 558 HD12 LEU 67 HD12 LEU 67 2.412 0.165 -3.947 559 HD13 LEU 67 HD13 LEU 67 3.360 0.890 -2.629 560 HD21 LEU 67 HD21 LEU 67 0.550 -0.461 -0.709 561 HD22 LEU 67 HD22 LEU 67 1.337 0.990 -1.298 562 HD23 LEU 67 HD23 LEU 67 0.261 0.052 -2.379 563 H SER 68 H SER 68 -0.537 -4.304 -3.236 564 HA SER 68 HA SER 68 -2.847 -2.768 -2.760 565 HB2 SER 68 HB2 SER 68 -2.395 -4.375 -4.674 566 HB3 SER 68 HB3 SER 68 -2.738 -5.709 -3.560 567 HG SER 68 HG SER 68 -4.412 -3.900 -4.807 568 H TYR 69 H TYR 69 -1.580 -5.638 -1.017 569 HA TYR 69 HA TYR 69 -3.950 -6.119 0.464 570 HB2 TYR 69 HB2 TYR 69 -1.463 -7.396 0.160 571 HB3 TYR 69 HB3 TYR 69 -1.512 -6.953 1.861 572 HD1 TYR 69 HD1 TYR 69 -2.639 -8.467 3.332 573 HD2 TYR 69 HD2 TYR 69 -3.670 -8.399 -0.856 574 HE1 TYR 69 HE1 TYR 69 -4.257 -10.316 3.710 575 HE2 TYR 69 HE2 TYR 69 -5.293 -10.263 -0.482 576 HH TYR 69 HH TYR 69 -6.000 -11.946 1.090 577 H TYR 70 H TYR 70 -1.304 -3.814 0.973 578 HA TYR 70 HA TYR 70 -2.088 -3.202 3.744 579 HB2 TYR 70 HB2 TYR 70 -0.095 -2.110 1.778 580 HB3 TYR 70 HB3 TYR 70 -0.741 -1.002 2.972 581 HD1 TYR 70 HD1 TYR 70 -0.132 -4.649 3.706 582 HD2 TYR 70 HD2 TYR 70 1.268 -0.585 4.166 583 HE1 TYR 70 HE1 TYR 70 1.496 -5.392 5.367 584 HE2 TYR 70 HE2 TYR 70 2.994 -1.360 5.744 585 HH TYR 70 HH TYR 70 4.151 -3.436 6.605 586 H SER 71 H SER 71 -2.564 -1.770 0.485 587 HA SER 71 HA SER 71 -4.223 0.390 1.309 588 HB2 SER 71 HB2 SER 71 -4.221 -1.144 -1.327 589 HB3 SER 71 HB3 SER 71 -4.906 0.467 -1.057 590 HG SER 71 HG SER 71 -3.013 1.267 -1.298 591 H ALA 72 H ALA 72 -4.953 -3.024 1.035 592 HA ALA 72 HA ALA 72 -7.877 -2.542 1.238 593 HB1 ALA 72 HB1 ALA 72 -8.087 -4.883 0.608 594 HB2 ALA 72 HB2 ALA 72 -7.053 -4.043 -0.558 595 HB3 ALA 72 HB3 ALA 72 -6.322 -5.099 0.672 596 H SER 73 H SER 73 -5.528 -2.452 3.427 597 HA SER 73 HA SER 73 -6.189 -4.566 5.267 598 HB2 SER 73 HB2 SER 73 -4.993 -3.209 6.950 599 HB3 SER 73 HB3 SER 73 -4.081 -3.330 5.446 600 HG SER 73 HG SER 73 -4.562 -1.285 4.939 601 HA PRO 74 HA PRO 74 -10.037 -3.168 6.870 602 HB2 PRO 74 HB2 PRO 74 -9.787 -3.519 9.635 603 HB3 PRO 74 HB3 PRO 74 -10.203 -4.823 8.463 604 HG2 PRO 74 HG2 PRO 74 -7.559 -4.070 9.689 605 HG3 PRO 74 HG3 PRO 74 -8.234 -5.716 9.409 606 HD2 PRO 74 HD2 PRO 74 -6.368 -4.671 7.749 607 HD3 PRO 74 HD3 PRO 74 -7.713 -5.634 7.100 608 H ALA 75 H ALA 75 -7.125 -1.951 8.625 609 HA ALA 75 HA ALA 75 -8.495 0.250 9.809 610 HB1 ALA 75 HB1 ALA 75 -6.494 -0.702 10.705 611 HB2 ALA 75 HB2 ALA 75 -5.551 -0.246 9.249 612 HB3 ALA 75 HB3 ALA 75 -6.215 1.017 10.321 613 H TYR 76 H TYR 76 -6.495 -0.065 6.776 614 HA TYR 76 HA TYR 76 -6.542 2.645 6.089 615 HB2 TYR 76 HB2 TYR 76 -5.213 1.024 4.841 616 HB3 TYR 76 HB3 TYR 76 -6.654 0.205 4.275 617 HD1 TYR 76 HD1 TYR 76 -4.184 2.665 3.384 618 HD2 TYR 76 HD2 TYR 76 -8.349 1.633 2.834 619 HE1 TYR 76 HE1 TYR 76 -4.275 4.058 1.371 620 HE2 TYR 76 HE2 TYR 76 -8.463 3.093 0.874 621 HH TYR 76 HH TYR 76 -7.378 4.826 -0.238 622 H LEU 77 H LEU 77 -8.955 0.085 5.302 623 HA LEU 77 HA LEU 77 -10.691 1.862 3.886 624 HB2 LEU 77 HB2 LEU 77 -11.350 -0.814 5.176 625 HB3 LEU 77 HB3 LEU 77 -12.268 -0.019 3.922 626 HG LEU 77 HG LEU 77 -9.377 -0.830 3.440 627 HD11 LEU 77 HD11 LEU 77 -11.840 -2.521 3.065 628 HD12 LEU 77 HD12 LEU 77 -10.201 -2.955 2.543 629 HD13 LEU 77 HD13 LEU 77 -10.569 -2.776 4.272 630 HD21 LEU 77 HD21 LEU 77 -10.185 0.644 1.763 631 HD22 LEU 77 HD22 LEU 77 -10.113 -0.996 1.098 632 HD23 LEU 77 HD23 LEU 77 -11.671 -0.295 1.570 633 H SER 78 H SER 78 -10.951 0.473 7.213 634 HA SER 78 HA SER 78 -13.440 1.707 7.797 635 HB2 SER 78 HB2 SER 78 -12.025 -0.176 9.060 636 HB3 SER 78 HB3 SER 78 -11.377 1.194 9.957 637 HG SER 78 HG SER 78 -13.091 0.573 11.085 638 H CYS 79 H CYS 79 -10.093 2.922 8.145 639 HA CYS 79 HA CYS 79 -10.993 5.345 9.531 640 HB2 CYS 79 HB2 CYS 79 -8.948 3.982 10.139 641 HB3 CYS 79 HB3 CYS 79 -8.240 4.445 8.600 642 HG CYS 79 HG CYS 79 -8.384 7.032 9.064 643 H GLN 80 H GLN 80 -11.275 4.605 6.292 644 HA GLN 80 HA GLN 80 -9.903 6.622 5.006 645 HB2 GLN 80 HB2 GLN 80 -12.596 5.315 4.372 646 HB3 GLN 80 HB3 GLN 80 -12.038 6.678 3.446 647 HG2 GLN 80 HG2 GLN 80 -10.564 4.048 3.696 648 HG3 GLN 80 HG3 GLN 80 -11.351 4.730 2.281 649 HE21 GLN 80 HE21 GLN 80 -8.408 4.654 4.048 650 HE22 GLN 80 HE22 GLN 80 -7.547 5.881 3.137 651 H LYS 81 H LYS 81 -9.742 8.622 5.238 652 HA LYS 81 HA LYS 81 -12.117 10.281 5.712 653 HB2 LYS 81 HB2 LYS 81 -9.480 10.497 7.164 654 HB3 LYS 81 HB3 LYS 81 -10.598 11.851 7.016 655 HG2 LYS 81 HG2 LYS 81 -11.198 9.189 8.322 656 HG3 LYS 81 HG3 LYS 81 -10.937 10.744 9.139 657 HD2 LYS 81 HD2 LYS 81 -12.978 11.589 7.811 658 HD3 LYS 81 HD3 LYS 81 -13.263 9.871 7.411 659 HE2 LYS 81 HE2 LYS 81 -13.385 9.297 9.774 660 HE3 LYS 81 HE3 LYS 81 -13.172 11.012 10.199 661 HZ1 LYS 81 HZ1 LYS 81 -15.504 10.350 10.136 662 HZ2 LYS 81 HZ2 LYS 81 -15.207 11.502 8.981 663 HZ3 LYS 81 HZ3 LYS 81 -15.410 9.917 8.580 664 HA PRO 82 HA PRO 82 -10.237 11.786 1.919 665 HB2 PRO 82 HB2 PRO 82 -12.273 13.425 1.111 666 HB3 PRO 82 HB3 PRO 82 -12.412 11.647 1.099 667 HG2 PRO 82 HG2 PRO 82 -13.241 13.572 3.297 668 HG3 PRO 82 HG3 PRO 82 -14.299 12.347 2.550 669 HD2 PRO 82 HD2 PRO 82 -13.087 11.858 4.842 670 HD3 PRO 82 HD3 PRO 82 -13.186 10.572 3.590 671 H ASP 83 H ASP 83 -10.255 14.178 1.024 672 HA ASP 83 HA ASP 83 -9.149 16.232 1.202 673 HB2 ASP 83 HB2 ASP 83 -11.078 16.377 3.521 674 HB3 ASP 83 HB3 ASP 83 -9.960 17.691 3.176 675 H THR 84 H THR 84 -7.919 13.903 2.301 676 HA THR 84 HA THR 84 -6.370 14.646 4.637 677 HB THR 84 HB THR 84 -7.290 12.447 4.411 678 HG1 THR 84 HG1 THR 84 -5.488 12.206 5.498 679 HG21 THR 84 HG21 THR 84 -7.378 12.202 1.942 680 HG22 THR 84 HG22 THR 84 -5.598 12.045 1.913 681 HG23 THR 84 HG23 THR 84 -6.618 10.839 2.732 682 H ALA 85 H ALA 85 -5.835 14.967 1.198 683 HA ALA 85 HA ALA 85 -3.995 15.659 -0.004 684 HB1 ALA 85 HB1 ALA 85 -2.545 17.326 0.982 685 HB2 ALA 85 HB2 ALA 85 -4.247 17.660 1.372 686 HB3 ALA 85 HB3 ALA 85 -3.173 16.963 2.602 687 H ARG 86 H ARG 86 -3.269 13.744 -0.574 688 HA ARG 86 HA ARG 86 -1.552 12.166 1.191 689 HB2 ARG 86 HB2 ARG 86 -1.512 11.839 -1.815 690 HB3 ARG 86 HB3 ARG 86 -1.189 10.678 -0.572 691 HG2 ARG 86 HG2 ARG 86 -3.236 9.905 -1.195 692 HG3 ARG 86 HG3 ARG 86 -3.778 11.066 0.022 693 HD2 ARG 86 HD2 ARG 86 -4.913 12.200 -1.577 694 HD3 ARG 86 HD3 ARG 86 -3.405 12.490 -2.446 695 HE ARG 86 HE ARG 86 -4.335 9.871 -3.053 696 HH11 ARG 86 HH11 ARG 86 -4.809 13.321 -3.820 697 HH12 ARG 86 HH12 ARG 86 -5.802 12.996 -5.209 698 HH21 ARG 86 HH21 ARG 86 -5.524 9.480 -5.005 699 HH22 ARG 86 HH22 ARG 86 -6.095 10.844 -5.941 700 H VAL 87 H VAL 87 0.683 11.475 0.138 701 HA VAL 87 HA VAL 87 2.219 13.775 -0.829 702 HB VAL 87 HB VAL 87 4.041 12.928 0.832 703 HG11 VAL 87 HG11 VAL 87 1.655 14.613 1.694 704 HG12 VAL 87 HG12 VAL 87 3.183 14.503 2.603 705 HG13 VAL 87 HG13 VAL 87 3.177 15.165 0.975 706 HG21 VAL 87 HG21 VAL 87 1.552 12.132 2.405 707 HG22 VAL 87 HG22 VAL 87 2.705 10.982 1.679 708 HG23 VAL 87 HG23 VAL 87 3.228 12.101 2.960 709 H ASP 88 H ASP 88 4.152 13.150 -1.784 710 HA ASP 88 HA ASP 88 3.981 10.614 -3.282 711 HB2 ASP 88 HB2 ASP 88 4.530 11.912 -5.023 712 HB3 ASP 88 HB3 ASP 88 4.137 13.294 -4.039 713 H ILE 89 H ILE 89 6.355 9.880 -3.989 714 HA ILE 89 HA ILE 89 7.653 9.012 -1.588 715 HB ILE 89 HB ILE 89 9.557 8.375 -3.205 716 HG12 ILE 89 HG12 ILE 89 7.564 8.844 -5.405 717 HG13 ILE 89 HG13 ILE 89 8.740 10.079 -5.017 718 HG21 ILE 89 HG21 ILE 89 6.813 7.251 -3.783 719 HG22 ILE 89 HG22 ILE 89 8.355 6.423 -4.024 720 HG23 ILE 89 HG23 ILE 89 7.821 6.813 -2.382 721 HD11 ILE 89 HD11 ILE 89 9.356 7.231 -5.909 722 HD12 ILE 89 HD12 ILE 89 9.449 8.692 -6.905 723 HD13 ILE 89 HD13 ILE 89 10.551 8.498 -5.536 724 H TYR 90 H TYR 90 8.119 11.968 -3.481 725 HA TYR 90 HA TYR 90 10.757 12.437 -2.274 726 HB2 TYR 90 HB2 TYR 90 9.014 14.047 -4.151 727 HB3 TYR 90 HB3 TYR 90 10.526 14.625 -3.488 728 HD1 TYR 90 HD1 TYR 90 10.674 11.043 -4.374 729 HD2 TYR 90 HD2 TYR 90 11.011 15.072 -5.908 730 HE1 TYR 90 HE1 TYR 90 11.776 10.188 -6.379 731 HE2 TYR 90 HE2 TYR 90 12.204 14.220 -7.886 732 HH TYR 90 HH TYR 90 13.077 12.244 -8.992 733 H GLY 91 H GLY 91 7.623 12.491 -1.117 734 HA2 GLY 91 HA2 GLY 91 6.903 13.118 0.928 735 HA3 GLY 91 HA3 GLY 91 8.326 14.153 1.156 736 H ASN 92 H ASN 92 7.010 14.936 -1.842 737 HA ASN 92 HA ASN 92 6.116 17.516 -0.901 738 HB2 ASN 92 HB2 ASN 92 5.793 16.173 -3.626 739 HB3 ASN 92 HB3 ASN 92 5.586 17.888 -3.284 740 HD21 ASN 92 HD21 ASN 92 7.712 15.862 -4.703 741 HD22 ASN 92 HD22 ASN 92 9.175 16.808 -4.430 742 H GLU 93 H GLU 93 4.045 18.384 -0.909 743 HA GLU 93 HA GLU 93 1.928 16.537 -0.281 744 HB2 GLU 93 HB2 GLU 93 2.440 19.503 -0.270 745 HB3 GLU 93 HB3 GLU 93 0.773 18.996 -0.496 746 HG2 GLU 93 HG2 GLU 93 0.865 17.611 1.555 747 HG3 GLU 93 HG3 GLU 93 2.563 18.049 1.777 748 H VAL 94 H VAL 94 0.162 16.037 -1.466 749 HA VAL 94 HA VAL 94 -0.047 16.993 -4.225 750 HB VAL 94 HB VAL 94 -0.408 14.938 -5.184 751 HG11 VAL 94 HG11 VAL 94 2.003 14.547 -3.358 752 HG12 VAL 94 HG12 VAL 94 1.762 13.877 -4.979 753 HG13 VAL 94 HG13 VAL 94 1.973 15.610 -4.769 754 HG21 VAL 94 HG21 VAL 94 -1.582 13.816 -3.207 755 HG22 VAL 94 HG22 VAL 94 -0.522 12.818 -4.218 756 HG23 VAL 94 HG23 VAL 94 0.059 13.392 -2.654 757 H ASP 95 H ASP 95 -2.394 15.981 -5.052 758 HA ASP 95 HA ASP 95 -4.231 17.644 -3.501 759 HB2 ASP 95 HB2 ASP 95 -4.306 16.058 -6.067 760 HB3 ASP 95 HB3 ASP 95 -5.821 16.589 -5.375 761 H VAL 96 H VAL 96 -6.659 16.459 -3.369 762 HA VAL 96 HA VAL 96 -6.111 14.169 -1.539 763 HB VAL 96 HB VAL 96 -7.945 14.909 -0.286 764 HG11 VAL 96 HG11 VAL 96 -7.159 16.917 0.546 765 HG12 VAL 96 HG12 VAL 96 -5.779 16.446 -0.447 766 HG13 VAL 96 HG13 VAL 96 -6.899 17.623 -1.065 767 HG21 VAL 96 HG21 VAL 96 -8.663 16.735 -2.617 768 HG22 VAL 96 HG22 VAL 96 -9.644 15.425 -1.925 769 HG23 VAL 96 HG23 VAL 96 -9.344 16.903 -1.001 770 H VAL 97 H VAL 97 -7.873 12.801 -1.020 771 HA VAL 97 HA VAL 97 -8.896 11.409 -3.419 772 HB VAL 97 HB VAL 97 -9.099 10.688 -0.455 773 HG11 VAL 97 HG11 VAL 97 -9.488 8.941 -2.928 774 HG12 VAL 97 HG12 VAL 97 -9.562 8.399 -1.231 775 HG13 VAL 97 HG13 VAL 97 -10.780 9.508 -1.850 776 HG21 VAL 97 HG21 VAL 97 -7.275 9.060 -0.875 777 HG22 VAL 97 HG22 VAL 97 -7.082 9.715 -2.515 778 HG23 VAL 97 HG23 VAL 97 -6.727 10.721 -1.087 779 H THR 98 H THR 98 -11.138 11.385 -3.948 780 HA THR 98 HA THR 98 -12.727 13.476 -2.858 781 HB THR 98 HB THR 98 -13.033 12.920 -5.139 782 HG1 THR 98 HG1 THR 98 -15.091 13.138 -5.046 783 HG21 THR 98 HG21 THR 98 -13.897 10.792 -5.973 784 HG22 THR 98 HG22 THR 98 -12.359 10.518 -5.152 785 HG23 THR 98 HG23 THR 98 -13.882 10.124 -4.328 786 HA PRO 99 HA PRO 99 -14.456 11.469 0.658 787 HB2 PRO 99 HB2 PRO 99 -16.895 12.639 0.898 788 HB3 PRO 99 HB3 PRO 99 -15.409 13.547 1.221 789 HG2 PRO 99 HG2 PRO 99 -16.947 13.503 -1.392 790 HG3 PRO 99 HG3 PRO 99 -16.408 14.922 -0.444 791 HD2 PRO 99 HD2 PRO 99 -14.880 14.062 -2.440 792 HD3 PRO 99 HD3 PRO 99 -14.077 14.418 -0.882 793 H GLU 100 H GLU 100 -16.241 11.379 -2.360 794 HA GLU 100 HA GLU 100 -18.186 9.443 -1.466 795 HB2 GLU 100 HB2 GLU 100 -17.131 10.244 -4.211 796 HB3 GLU 100 HB3 GLU 100 -18.499 9.141 -3.951 797 HG2 GLU 100 HG2 GLU 100 -19.733 10.913 -2.762 798 HG3 GLU 100 HG3 GLU 100 -18.366 12.021 -2.925 799 H GLN 101 H GLN 101 -15.073 9.172 -3.321 800 HA GLN 101 HA GLN 101 -15.228 6.287 -3.303 801 HB2 GLN 101 HB2 GLN 101 -12.872 8.142 -3.845 802 HB3 GLN 101 HB3 GLN 101 -12.854 6.387 -4.028 803 HG2 GLN 101 HG2 GLN 101 -14.736 6.524 -5.659 804 HG3 GLN 101 HG3 GLN 101 -14.698 8.283 -5.560 805 HE21 GLN 101 HE21 GLN 101 -13.738 9.042 -7.518 806 HE22 GLN 101 HE22 GLN 101 -12.330 8.280 -8.223 807 H ALA 102 H ALA 102 -13.743 8.728 -1.129 808 HA ALA 102 HA ALA 102 -12.159 6.938 0.377 809 HB1 ALA 102 HB1 ALA 102 -13.583 9.477 1.327 810 HB2 ALA 102 HB2 ALA 102 -12.225 8.681 2.134 811 HB3 ALA 102 HB3 ALA 102 -11.988 9.426 0.550 812 H LYS 103 H LYS 103 -15.622 7.993 1.030 813 HA LYS 103 HA LYS 103 -15.778 6.042 3.177 814 HB2 LYS 103 HB2 LYS 103 -18.161 6.517 3.257 815 HB3 LYS 103 HB3 LYS 103 -17.282 8.035 3.048 816 HG2 LYS 103 HG2 LYS 103 -17.894 8.060 0.664 817 HG3 LYS 103 HG3 LYS 103 -18.735 6.528 0.829 818 HD2 LYS 103 HD2 LYS 103 -20.226 8.511 0.728 819 HD3 LYS 103 HD3 LYS 103 -20.437 7.510 2.165 820 HE2 LYS 103 HE2 LYS 103 -20.521 9.835 2.816 821 HE3 LYS 103 HE3 LYS 103 -19.085 9.045 3.486 822 HZ1 LYS 103 HZ1 LYS 103 -18.680 11.272 2.617 823 HZ2 LYS 103 HZ2 LYS 103 -17.695 10.152 1.976 824 HZ3 LYS 103 HZ3 LYS 103 -18.962 10.757 1.090 825 H TYR 104 H TYR 104 -16.306 5.766 -0.299 826 HA TYR 104 HA TYR 104 -17.850 3.456 -0.275 827 HB2 TYR 104 HB2 TYR 104 -16.878 4.952 -2.273 828 HB3 TYR 104 HB3 TYR 104 -15.739 3.634 -2.388 829 HD1 TYR 104 HD1 TYR 104 -17.303 4.305 -4.628 830 HD2 TYR 104 HD2 TYR 104 -18.548 1.826 -1.326 831 HE1 TYR 104 HE1 TYR 104 -19.035 3.186 -6.075 832 HE2 TYR 104 HE2 TYR 104 -20.144 0.666 -2.752 833 HH TYR 104 HH TYR 104 -21.018 0.435 -4.924 834 H ALA 105 H ALA 105 -14.463 3.804 0.591 835 HA ALA 105 HA ALA 105 -13.430 1.249 0.242 836 HB1 ALA 105 HB1 ALA 105 -13.156 3.178 2.583 837 HB2 ALA 105 HB2 ALA 105 -12.084 1.821 2.253 838 HB3 ALA 105 HB3 ALA 105 -12.184 3.136 1.076 839 H TYR 106 H TYR 106 -15.940 2.279 2.552 840 HA TYR 106 HA TYR 106 -15.781 0.206 4.400 841 HB2 TYR 106 HB2 TYR 106 -17.773 1.073 5.187 842 HB3 TYR 106 HB3 TYR 106 -17.308 2.425 4.172 843 HD1 TYR 106 HD1 TYR 106 -18.181 2.093 1.562 844 HD2 TYR 106 HD2 TYR 106 -19.891 0.137 4.995 845 HE1 TYR 106 HE1 TYR 106 -20.306 1.741 0.311 846 HE2 TYR 106 HE2 TYR 106 -21.944 -0.329 3.739 847 HH TYR 106 HH TYR 106 -22.910 -0.301 1.604 848 H GLN 107 H GLN 107 -17.085 0.044 1.148 849 HA GLN 107 HA GLN 107 -18.620 -2.303 1.456 850 HB2 GLN 107 HB2 GLN 107 -18.498 -2.587 -0.890 851 HB3 GLN 107 HB3 GLN 107 -18.949 -0.952 -0.301 852 HG2 GLN 107 HG2 GLN 107 -17.578 -0.068 -1.533 853 HG3 GLN 107 HG3 GLN 107 -16.185 -0.839 -0.825 854 HE21 GLN 107 HE21 GLN 107 -17.170 -0.011 -3.714 855 HE22 GLN 107 HE22 GLN 107 -16.642 -1.416 -4.645 856 H ARG 108 H ARG 108 -15.385 -1.746 0.430 857 HA ARG 108 HA ARG 108 -14.442 -4.420 0.051 858 HB2 ARG 108 HB2 ARG 108 -12.786 -2.029 0.959 859 HB3 ARG 108 HB3 ARG 108 -12.194 -3.440 0.115 860 HG2 ARG 108 HG2 ARG 108 -14.119 -1.389 -1.054 861 HG3 ARG 108 HG3 ARG 108 -12.383 -1.406 -1.300 862 HD2 ARG 108 HD2 ARG 108 -12.491 -3.723 -2.263 863 HD3 ARG 108 HD3 ARG 108 -14.231 -3.718 -2.075 864 HE ARG 108 HE ARG 108 -14.484 -2.407 -3.920 865 HH11 ARG 108 HH11 ARG 108 -11.033 -2.648 -3.171 866 HH12 ARG 108 HH12 ARG 108 -10.487 -1.781 -4.556 867 HH21 ARG 108 HH21 ARG 108 -13.824 -1.331 -5.782 868 HH22 ARG 108 HH22 ARG 108 -12.196 -0.721 -5.961 869 H TYR 109 H TYR 109 -14.710 -2.390 2.998 870 HA TYR 109 HA TYR 109 -13.115 -4.165 4.594 871 HB2 TYR 109 HB2 TYR 109 -13.703 -1.849 5.210 872 HB3 TYR 109 HB3 TYR 109 -15.374 -2.313 5.472 873 HD1 TYR 109 HD1 TYR 109 -15.727 -4.419 7.170 874 HD2 TYR 109 HD2 TYR 109 -12.319 -1.761 7.150 875 HE1 TYR 109 HE1 TYR 109 -15.182 -5.103 9.457 876 HE2 TYR 109 HE2 TYR 109 -11.848 -2.380 9.504 877 HH TYR 109 HH TYR 109 -13.405 -3.358 11.535 878 H GLN 110 H GLN 110 -16.678 -3.885 3.997 879 HA GLN 110 HA GLN 110 -17.184 -6.201 5.636 880 HB2 GLN 110 HB2 GLN 110 -19.487 -6.193 4.813 881 HB3 GLN 110 HB3 GLN 110 -18.953 -4.679 5.514 882 HG2 GLN 110 HG2 GLN 110 -18.630 -3.759 3.204 883 HG3 GLN 110 HG3 GLN 110 -19.293 -5.259 2.546 884 HE21 GLN 110 HE21 GLN 110 -20.149 -2.938 5.230 885 HE22 GLN 110 HE22 GLN 110 -21.823 -2.792 4.823 886 H GLU 111 H GLU 111 -16.288 -5.826 2.281 887 HA GLU 111 HA GLU 111 -17.248 -8.365 1.393 888 HB2 GLU 111 HB2 GLU 111 -16.225 -7.933 -0.481 889 HB3 GLU 111 HB3 GLU 111 -16.091 -6.280 0.111 890 HG2 GLU 111 HG2 GLU 111 -13.711 -6.989 0.775 891 HG3 GLU 111 HG3 GLU 111 -13.996 -8.460 -0.152 892 H ARG 112 H ARG 112 -14.260 -7.451 2.627 893 HA ARG 112 HA ARG 112 -13.156 -10.226 2.876 894 HB2 ARG 112 HB2 ARG 112 -12.032 -7.415 3.146 895 HB3 ARG 112 HB3 ARG 112 -11.099 -8.749 3.802 896 HG2 ARG 112 HG2 ARG 112 -12.016 -8.771 0.919 897 HG3 ARG 112 HG3 ARG 112 -10.512 -8.023 1.447 898 HD2 ARG 112 HD2 ARG 112 -9.705 -10.132 2.370 899 HD3 ARG 112 HD3 ARG 112 -11.245 -10.925 1.928 900 HE ARG 112 HE ARG 112 -10.111 -9.617 -0.332 901 HH11 ARG 112 HH11 ARG 112 -9.661 -12.536 1.628 902 HH12 ARG 112 HH12 ARG 112 -9.410 -13.591 0.283 903 HH21 ARG 112 HH21 ARG 112 -9.651 -10.923 -2.082 904 HH22 ARG 112 HH22 ARG 112 -9.271 -12.594 -1.932 905 H TYR 113 H TYR 113 -14.349 -7.819 5.136 906 HA TYR 113 HA TYR 113 -13.469 -9.520 7.419 907 HB2 TYR 113 HB2 TYR 113 -13.679 -6.512 7.417 908 HB3 TYR 113 HB3 TYR 113 -12.925 -7.523 8.643 909 HD1 TYR 113 HD1 TYR 113 -12.196 -5.181 6.246 910 HD2 TYR 113 HD2 TYR 113 -10.995 -9.141 7.352 911 HE1 TYR 113 HE1 TYR 113 -10.099 -4.893 4.934 912 HE2 TYR 113 HE2 TYR 113 -8.854 -8.863 6.095 913 HH TYR 113 HH TYR 113 -8.148 -5.902 4.180 914 H GLY 114 H GLY 114 -16.000 -9.193 5.712 915 HA2 GLY 114 HA2 GLY 114 -17.921 -9.076 7.934 916 HA3 GLY 114 HA3 GLY 114 -18.184 -7.957 6.577 917 H ASN 115 H ASN 115 -20.222 -9.289 6.484 918 HA ASN 115 HA ASN 115 -19.887 -11.883 5.115 919 HB2 ASN 115 HB2 ASN 115 -22.113 -12.348 5.837 920 HB3 ASN 115 HB3 ASN 115 -21.183 -11.813 7.228 921 HD21 ASN 115 HD21 ASN 115 -23.800 -11.881 7.549 922 HD22 ASN 115 HD22 ASN 115 -24.574 -10.305 7.446 923 H LYS 116 H LYS 116 -21.758 -12.311 3.544 924 HA LYS 116 HA LYS 116 -22.580 -9.997 1.966 925 HB2 LYS 116 HB2 LYS 116 -20.305 -11.548 1.291 926 HB3 LYS 116 HB3 LYS 116 -21.552 -12.104 0.206 927 HG2 LYS 116 HG2 LYS 116 -21.111 -9.111 0.629 928 HG3 LYS 116 HG3 LYS 116 -19.944 -10.026 -0.293 929 HD2 LYS 116 HD2 LYS 116 -22.056 -10.945 -1.605 930 HD3 LYS 116 HD3 LYS 116 -22.824 -9.466 -1.012 931 HE2 LYS 116 HE2 LYS 116 -21.077 -8.112 -2.135 932 HE3 LYS 116 HE3 LYS 116 -20.168 -9.584 -2.512 933 HZ1 LYS 116 HZ1 LYS 116 -22.226 -10.258 -3.823 934 HZ2 LYS 116 HZ2 LYS 116 -22.695 -8.689 -3.709 935 HZ3 LYS 116 HZ3 LYS 116 -21.304 -9.062 -4.474 936 H LYS 117 H LYS 117 -23.999 -11.209 -0.015 937 HA LYS 117 HA LYS 117 -25.486 -13.498 0.823 938 HB2 LYS 117 HB2 LYS 117 -27.575 -12.274 1.280 939 HB3 LYS 117 HB3 LYS 117 -26.321 -11.680 2.347 940 HG2 LYS 117 HG2 LYS 117 -25.946 -9.826 0.539 941 HG3 LYS 117 HG3 LYS 117 -27.497 -10.348 -0.110 942 HD2 LYS 117 HD2 LYS 117 -28.660 -9.645 1.864 943 HD3 LYS 117 HD3 LYS 117 -27.153 -9.578 2.812 944 HE2 LYS 117 HE2 LYS 117 -26.299 -7.757 1.401 945 HE3 LYS 117 HE3 LYS 117 -27.783 -7.773 0.439 946 HZ1 LYS 117 HZ1 LYS 117 -28.796 -6.568 1.961 947 HZ2 LYS 117 HZ2 LYS 117 -28.266 -7.493 3.244 948 HZ3 LYS 117 HZ3 LYS 117 -27.335 -6.281 2.654 949 H SER 118 H SER 118 -27.610 -13.446 -0.695 950 HA SER 118 HA SER 118 -26.797 -13.333 -3.395 951 HB2 SER 118 HB2 SER 118 -29.557 -13.354 -2.108 952 HB3 SER 118 HB3 SER 118 -29.197 -13.722 -3.799 953 HG SER 118 HG SER 118 -29.260 -15.663 -2.596 954 H GLN 119 H GLN 119 -26.782 -11.621 -4.827 955 HA GLN 119 HA GLN 119 -27.921 -9.024 -3.896 956 HB2 GLN 119 HB2 GLN 119 -25.413 -9.435 -4.204 957 HB3 GLN 119 HB3 GLN 119 -25.724 -9.394 -5.938 958 HG2 GLN 119 HG2 GLN 119 -26.444 -7.094 -5.837 959 HG3 GLN 119 HG3 GLN 119 -26.610 -7.155 -4.070 960 HE21 GLN 119 HE21 GLN 119 -24.633 -5.859 -6.382 961 HE22 GLN 119 HE22 GLN 119 -23.131 -5.849 -5.468 962 H ASP 120 H ASP 120 -28.654 -11.509 -6.014 963 HA ASP 120 HA ASP 120 -30.549 -9.911 -7.525 964 HB2 ASP 120 HB2 ASP 120 -29.758 -10.622 -9.701 965 HB3 ASP 120 HB3 ASP 120 -28.397 -9.846 -8.891 966 H LEU 121 H LEU 121 -31.727 -11.615 -9.040 967 HA LEU 121 HA LEU 121 -31.637 -14.332 -8.288 968 HB2 LEU 121 HB2 LEU 121 -33.763 -14.602 -7.295 969 HB3 LEU 121 HB3 LEU 121 -32.968 -13.357 -6.358 970 HG LEU 121 HG LEU 121 -35.128 -12.887 -8.491 971 HD11 LEU 121 HD11 LEU 121 -35.962 -14.052 -6.495 972 HD12 LEU 121 HD12 LEU 121 -35.268 -12.798 -5.442 973 HD13 LEU 121 HD13 LEU 121 -36.588 -12.406 -6.573 974 HD21 LEU 121 HD21 LEU 121 -35.273 -10.598 -7.474 975 HD22 LEU 121 HD22 LEU 121 -33.782 -10.937 -6.562 976 HD23 LEU 121 HD23 LEU 121 -33.775 -10.881 -8.345 977 H LYS 122 H LYS 122 -33.905 -15.334 -9.415 978 HA LYS 122 HA LYS 122 -34.909 -14.102 -11.696 979 HB2 LYS 122 HB2 LYS 122 -34.085 -15.865 -13.260 980 HB3 LYS 122 HB3 LYS 122 -32.896 -14.633 -12.873 981 HG2 LYS 122 HG2 LYS 122 -32.779 -17.066 -11.118 982 HG3 LYS 122 HG3 LYS 122 -32.487 -17.391 -12.821 983 HD2 LYS 122 HD2 LYS 122 -31.018 -15.213 -11.289 984 HD3 LYS 122 HD3 LYS 122 -30.419 -16.871 -11.433 985 HE2 LYS 122 HE2 LYS 122 -30.222 -16.741 -13.811 986 HE3 LYS 122 HE3 LYS 122 -31.180 -15.254 -13.890 987 HZ1 LYS 122 HZ1 LYS 122 -28.856 -14.810 -14.171 988 HZ2 LYS 122 HZ2 LYS 122 -29.414 -14.083 -12.795 989 HZ3 LYS 122 HZ3 LYS 122 -28.480 -15.429 -12.702 Start of MODEL 16 1 H1 GLY 1 H GLY 1 17.398 -7.294 18.827 2 HA2 GLY 1 HA2 GLY 1 17.465 -8.762 16.894 3 HA3 GLY 1 HA3 GLY 1 18.939 -8.913 17.862 4 H SER 2 H SER 2 19.567 -10.957 18.080 5 HA SER 2 HA SER 2 19.672 -13.152 18.316 6 HB2 SER 2 HB2 SER 2 16.995 -12.939 19.730 7 HB3 SER 2 HB3 SER 2 18.082 -14.342 19.710 8 HG SER 2 HG SER 2 19.695 -13.035 20.658 9 H ASN 3 H ASN 3 16.186 -13.817 17.972 10 HA ASN 3 HA ASN 3 16.709 -15.456 15.697 11 HB2 ASN 3 HB2 ASN 3 14.780 -16.075 16.725 12 HB3 ASN 3 HB3 ASN 3 14.202 -14.431 16.989 13 HD21 ASN 3 HD21 ASN 3 14.843 -16.842 14.333 14 HD22 ASN 3 HD22 ASN 3 13.497 -16.332 13.362 15 H GLN 4 H GLN 4 16.948 -15.040 13.601 16 HA GLN 4 HA GLN 4 15.781 -12.772 12.349 17 HB2 GLN 4 HB2 GLN 4 17.928 -11.828 11.549 18 HB3 GLN 4 HB3 GLN 4 17.791 -11.759 13.315 19 HG2 GLN 4 HG2 GLN 4 19.019 -13.959 13.392 20 HG3 GLN 4 HG3 GLN 4 19.344 -13.785 11.683 21 HE21 GLN 4 HE21 GLN 4 21.270 -13.959 13.916 22 HE22 GLN 4 HE22 GLN 4 22.281 -12.520 13.737 23 H GLN 5 H GLN 5 16.144 -12.992 9.932 24 HA GLN 5 HA GLN 5 17.236 -15.564 8.993 25 HB2 GLN 5 HB2 GLN 5 14.300 -14.872 8.763 26 HB3 GLN 5 HB3 GLN 5 15.136 -16.084 7.780 27 HG2 GLN 5 HG2 GLN 5 15.676 -17.404 9.768 28 HG3 GLN 5 HG3 GLN 5 14.804 -16.241 10.788 29 HE21 GLN 5 HE21 GLN 5 14.357 -18.660 8.232 30 HE22 GLN 5 HE22 GLN 5 12.630 -18.832 8.398 31 H LEU 6 H LEU 6 18.343 -13.472 8.454 32 HA LEU 6 HA LEU 6 18.922 -11.667 7.015 33 HB2 LEU 6 HB2 LEU 6 18.742 -14.109 5.223 34 HB3 LEU 6 HB3 LEU 6 19.696 -12.672 4.868 35 HG LEU 6 HG LEU 6 20.142 -14.383 7.357 36 HD11 LEU 6 HD11 LEU 6 21.630 -14.473 4.710 37 HD12 LEU 6 HD12 LEU 6 22.009 -15.419 6.166 38 HD13 LEU 6 HD13 LEU 6 20.493 -15.731 5.315 39 HD21 LEU 6 HD21 LEU 6 22.343 -13.276 7.406 40 HD22 LEU 6 HD22 LEU 6 21.984 -12.418 5.888 41 HD23 LEU 6 HD23 LEU 6 21.102 -12.014 7.353 42 H ASN 7 H ASN 7 16.515 -10.861 7.349 43 HA ASN 7 HA ASN 7 15.562 -10.059 4.716 44 HB2 ASN 7 HB2 ASN 7 13.331 -10.707 4.960 45 HB3 ASN 7 HB3 ASN 7 14.295 -12.155 5.196 46 HD21 ASN 7 HD21 ASN 7 14.636 -12.849 7.473 47 HD22 ASN 7 HD22 ASN 7 13.432 -12.453 8.711 48 H ALA 8 H ALA 8 14.181 -8.253 4.830 49 HA ALA 8 HA ALA 8 14.841 -6.172 6.325 50 HB1 ALA 8 HB1 ALA 8 13.483 -6.051 4.296 51 HB2 ALA 8 HB2 ALA 8 12.058 -6.615 5.185 52 HB3 ALA 8 HB3 ALA 8 12.820 -5.067 5.606 53 H THR 9 H THR 9 11.632 -7.628 7.027 54 HA THR 9 HA THR 9 12.178 -7.107 9.899 55 HB THR 9 HB THR 9 10.006 -6.089 10.253 56 HG1 THR 9 HG1 THR 9 9.650 -5.559 7.509 57 HG21 THR 9 HG21 THR 9 10.471 -3.861 9.397 58 HG22 THR 9 HG22 THR 9 11.992 -4.628 9.893 59 HG23 THR 9 HG23 THR 9 11.574 -4.509 8.180 60 H LYS 10 H LYS 10 9.873 -8.596 7.609 61 HA LYS 10 HA LYS 10 9.941 -11.172 8.584 62 HB2 LYS 10 HB2 LYS 10 8.362 -9.602 10.396 63 HB3 LYS 10 HB3 LYS 10 7.193 -10.292 9.308 64 HG2 LYS 10 HG2 LYS 10 7.331 -11.932 10.944 65 HG3 LYS 10 HG3 LYS 10 8.341 -12.554 9.667 66 HD2 LYS 10 HD2 LYS 10 9.542 -12.994 11.588 67 HD3 LYS 10 HD3 LYS 10 10.358 -11.574 10.982 68 HE2 LYS 10 HE2 LYS 10 8.278 -11.707 13.237 69 HE3 LYS 10 HE3 LYS 10 10.032 -11.677 13.449 70 HZ1 LYS 10 HZ1 LYS 10 8.309 -9.488 12.539 71 HZ2 LYS 10 HZ2 LYS 10 9.356 -9.544 13.790 72 HZ3 LYS 10 HZ3 LYS 10 9.933 -9.483 12.237 73 H LYS 11 H LYS 11 8.531 -12.455 7.241 74 HA LYS 11 HA LYS 11 7.442 -13.085 5.435 75 HB2 LYS 11 HB2 LYS 11 5.841 -10.606 6.020 76 HB3 LYS 11 HB3 LYS 11 5.460 -11.649 4.646 77 HG2 LYS 11 HG2 LYS 11 5.203 -13.586 6.098 78 HG3 LYS 11 HG3 LYS 11 5.724 -12.644 7.509 79 HD2 LYS 11 HD2 LYS 11 3.797 -11.173 7.314 80 HD3 LYS 11 HD3 LYS 11 3.225 -12.021 5.868 81 HE2 LYS 11 HE2 LYS 11 3.747 -13.417 8.526 82 HE3 LYS 11 HE3 LYS 11 2.195 -12.670 8.145 83 HZ1 LYS 11 HZ1 LYS 11 2.091 -14.124 6.179 84 HZ2 LYS 11 HZ2 LYS 11 3.424 -14.925 6.663 85 HZ3 LYS 11 HZ3 LYS 11 2.078 -14.951 7.600 86 H ASP 12 H ASP 12 8.005 -13.356 3.479 87 HA ASP 12 HA ASP 12 9.831 -11.637 2.158 88 HB2 ASP 12 HB2 ASP 12 8.164 -13.991 1.228 89 HB3 ASP 12 HB3 ASP 12 9.311 -13.145 0.194 90 H LYS 13 H LYS 13 6.276 -11.833 2.063 91 HA LYS 13 HA LYS 13 5.990 -10.296 -0.373 92 HB2 LYS 13 HB2 LYS 13 4.083 -10.587 1.999 93 HB3 LYS 13 HB3 LYS 13 3.659 -9.991 0.401 94 HG2 LYS 13 HG2 LYS 13 4.718 -12.816 0.801 95 HG3 LYS 13 HG3 LYS 13 3.041 -12.392 1.116 96 HD2 LYS 13 HD2 LYS 13 2.897 -13.158 -1.026 97 HD3 LYS 13 HD3 LYS 13 2.993 -11.419 -1.309 98 HE2 LYS 13 HE2 LYS 13 5.369 -11.602 -1.886 99 HE3 LYS 13 HE3 LYS 13 5.404 -13.283 -1.332 100 HZ1 LYS 13 HZ1 LYS 13 5.257 -13.410 -3.633 101 HZ2 LYS 13 HZ2 LYS 13 3.746 -13.729 -3.126 102 HZ3 LYS 13 HZ3 LYS 13 4.116 -12.250 -3.778 103 H LEU 14 H LEU 14 5.752 -9.523 3.141 104 HA LEU 14 HA LEU 14 5.492 -6.731 2.777 105 HB2 LEU 14 HB2 LEU 14 6.646 -8.140 5.181 106 HB3 LEU 14 HB3 LEU 14 5.912 -6.546 5.138 107 HG LEU 14 HG LEU 14 4.491 -9.210 4.742 108 HD11 LEU 14 HD11 LEU 14 5.147 -8.643 7.051 109 HD12 LEU 14 HD12 LEU 14 4.303 -7.088 6.921 110 HD13 LEU 14 HD13 LEU 14 3.391 -8.613 6.851 111 HD21 LEU 14 HD21 LEU 14 2.386 -7.803 4.763 112 HD22 LEU 14 HD22 LEU 14 3.431 -6.387 4.486 113 HD23 LEU 14 HD23 LEU 14 3.363 -7.685 3.290 114 H GLN 15 H GLN 15 8.313 -8.788 2.759 115 HA GLN 15 HA GLN 15 10.358 -7.004 3.408 116 HB2 GLN 15 HB2 GLN 15 10.405 -9.566 2.882 117 HB3 GLN 15 HB3 GLN 15 10.558 -9.075 1.191 118 HG2 GLN 15 HG2 GLN 15 12.559 -7.653 2.011 119 HG3 GLN 15 HG3 GLN 15 12.476 -8.605 3.492 120 HE21 GLN 15 HE21 GLN 15 12.142 -11.253 2.745 121 HE22 GLN 15 HE22 GLN 15 13.374 -11.688 1.594 122 H VAL 16 H VAL 16 8.625 -7.456 0.257 123 HA VAL 16 HA VAL 16 10.425 -5.679 -1.045 124 HB VAL 16 HB VAL 16 9.104 -5.754 -2.976 125 HG11 VAL 16 HG11 VAL 16 8.739 -8.091 -3.417 126 HG12 VAL 16 HG12 VAL 16 10.157 -7.908 -2.373 127 HG13 VAL 16 HG13 VAL 16 8.629 -8.458 -1.672 128 HG21 VAL 16 HG21 VAL 16 6.754 -6.462 -1.264 129 HG22 VAL 16 HG22 VAL 16 6.952 -5.115 -2.376 130 HG23 VAL 16 HG23 VAL 16 6.785 -6.760 -3.011 131 H ILE 17 H ILE 17 7.428 -5.224 0.712 132 HA ILE 17 HA ILE 17 6.957 -2.498 -0.033 133 HB ILE 17 HB ILE 17 6.139 -3.680 2.634 134 HG12 ILE 17 HG12 ILE 17 4.668 -4.161 -0.002 135 HG13 ILE 17 HG13 ILE 17 5.487 -5.384 0.968 136 HG21 ILE 17 HG21 ILE 17 4.680 -1.760 0.772 137 HG22 ILE 17 HG22 ILE 17 4.312 -2.116 2.480 138 HG23 ILE 17 HG23 ILE 17 5.792 -1.258 2.057 139 HD11 ILE 17 HD11 ILE 17 2.938 -3.895 1.645 140 HD12 ILE 17 HD12 ILE 17 3.243 -5.640 1.581 141 HD13 ILE 17 HD13 ILE 17 3.912 -4.686 2.912 142 H ASP 18 H ASP 18 8.775 -4.136 2.481 143 HA ASP 18 HA ASP 18 9.594 -1.861 4.016 144 HB2 ASP 18 HB2 ASP 18 10.371 -4.704 3.822 145 HB3 ASP 18 HB3 ASP 18 11.726 -3.646 4.208 146 H TRP 19 H TRP 19 11.035 -3.409 1.102 147 HA TRP 19 HA TRP 19 13.399 -1.786 1.247 148 HB2 TRP 19 HB2 TRP 19 14.067 -3.209 -0.282 149 HB3 TRP 19 HB3 TRP 19 12.458 -3.857 -0.472 150 HD1 TRP 19 HD1 TRP 19 14.143 -0.583 -1.933 151 HE1 TRP 19 HE1 TRP 19 13.613 -0.390 -4.334 152 HE3 TRP 19 HE3 TRP 19 11.508 -4.911 -2.483 153 HZ2 TRP 19 HZ2 TRP 19 12.233 -1.796 -6.246 154 HZ3 TRP 19 HZ3 TRP 19 10.434 -5.408 -4.655 155 HH2 TRP 19 HH2 TRP 19 10.743 -3.854 -6.571 156 H LEU 20 H LEU 20 10.495 -1.412 -1.005 157 HA LEU 20 HA LEU 20 11.208 1.125 -1.857 158 HB2 LEU 20 HB2 LEU 20 8.919 1.413 -2.552 159 HB3 LEU 20 HB3 LEU 20 9.601 -0.147 -2.987 160 HG LEU 20 HG LEU 20 8.377 -0.867 -0.705 161 HD11 LEU 20 HD11 LEU 20 7.416 1.427 -0.288 162 HD12 LEU 20 HD12 LEU 20 6.541 1.283 -1.822 163 HD13 LEU 20 HD13 LEU 20 6.183 0.179 -0.470 164 HD21 LEU 20 HD21 LEU 20 7.018 -0.624 -3.366 165 HD22 LEU 20 HD22 LEU 20 8.068 -1.954 -2.800 166 HD23 LEU 20 HD23 LEU 20 6.497 -1.683 -2.033 167 H ILE 21 H ILE 21 9.561 0.274 1.205 168 HA ILE 21 HA ILE 21 8.697 2.861 1.895 169 HB ILE 21 HB ILE 21 9.401 0.355 3.413 170 HG12 ILE 21 HG12 ILE 21 6.893 2.030 3.682 171 HG13 ILE 21 HG13 ILE 21 7.093 0.913 2.336 172 HG21 ILE 21 HG21 ILE 21 8.886 2.973 4.872 173 HG22 ILE 21 HG22 ILE 21 8.851 1.358 5.604 174 HG23 ILE 21 HG23 ILE 21 10.342 1.967 4.922 175 HD11 ILE 21 HD11 ILE 21 7.104 0.173 5.294 176 HD12 ILE 21 HD12 ILE 21 5.799 -0.114 4.151 177 HD13 ILE 21 HD13 ILE 21 7.346 -0.968 3.982 178 H GLU 22 H GLU 22 11.839 1.241 2.589 179 HA GLU 22 HA GLU 22 12.846 3.717 3.777 180 HB2 GLU 22 HB2 GLU 22 13.354 1.357 4.538 181 HB3 GLU 22 HB3 GLU 22 14.417 1.211 3.140 182 HG2 GLU 22 HG2 GLU 22 15.817 3.030 3.951 183 HG3 GLU 22 HG3 GLU 22 14.632 3.453 5.191 184 H ASN 23 H ASN 23 12.856 2.250 0.622 185 HA ASN 23 HA ASN 23 15.135 3.622 -0.459 186 HB2 ASN 23 HB2 ASN 23 13.183 1.736 -1.484 187 HB3 ASN 23 HB3 ASN 23 13.336 3.068 -2.581 188 HD21 ASN 23 HD21 ASN 23 15.621 1.123 -0.494 189 HD22 ASN 23 HD22 ASN 23 16.782 0.923 -1.805 190 H PHE 24 H PHE 24 11.633 4.460 -0.386 191 HA PHE 24 HA PHE 24 12.401 7.056 -1.626 192 HB2 PHE 24 HB2 PHE 24 10.501 5.262 -2.486 193 HB3 PHE 24 HB3 PHE 24 9.532 6.472 -1.678 194 HD1 PHE 24 HD1 PHE 24 10.549 9.041 -2.174 195 HD2 PHE 24 HD2 PHE 24 10.845 5.612 -4.773 196 HE1 PHE 24 HE1 PHE 24 10.994 10.530 -4.097 197 HE2 PHE 24 HE2 PHE 24 11.138 7.128 -6.711 198 HZ PHE 24 HZ PHE 24 11.294 9.584 -6.367 199 HA PRO 25 HA PRO 25 11.558 8.024 2.801 200 HB2 PRO 25 HB2 PRO 25 13.582 9.841 3.182 201 HB3 PRO 25 HB3 PRO 25 13.801 8.076 3.174 202 HG2 PRO 25 HG2 PRO 25 14.191 9.965 0.838 203 HG3 PRO 25 HG3 PRO 25 15.362 8.772 1.519 204 HD2 PRO 25 HD2 PRO 25 13.838 8.093 -0.557 205 HD3 PRO 25 HD3 PRO 25 14.090 6.944 0.787 206 H ASN 26 H ASN 26 10.182 9.380 0.337 207 HA ASN 26 HA ASN 26 10.005 12.202 1.378 208 HB2 ASN 26 HB2 ASN 26 9.208 10.783 -1.145 209 HB3 ASN 26 HB3 ASN 26 8.193 12.122 -0.625 210 HD21 ASN 26 HD21 ASN 26 11.736 11.399 -1.018 211 HD22 ASN 26 HD22 ASN 26 12.129 13.013 -1.525 212 H ALA 27 H ALA 27 8.330 9.165 1.384 213 HA ALA 27 HA ALA 27 6.491 9.828 3.477 214 HB1 ALA 27 HB1 ALA 27 5.246 11.111 1.742 215 HB2 ALA 27 HB2 ALA 27 5.369 9.766 0.610 216 HB3 ALA 27 HB3 ALA 27 4.375 9.609 2.078 217 H PHE 28 H PHE 28 6.519 7.823 4.402 218 HA PHE 28 HA PHE 28 5.282 5.592 3.349 219 HB2 PHE 28 HB2 PHE 28 8.163 5.620 2.702 220 HB3 PHE 28 HB3 PHE 28 7.634 4.196 3.566 221 HD1 PHE 28 HD1 PHE 28 5.245 3.152 2.658 222 HD2 PHE 28 HD2 PHE 28 8.030 5.492 0.323 223 HE1 PHE 28 HE1 PHE 28 4.161 2.376 0.595 224 HE2 PHE 28 HE2 PHE 28 6.904 4.742 -1.738 225 HZ PHE 28 HZ PHE 28 4.916 3.236 -1.610 226 H PHE 29 H PHE 29 5.119 3.835 4.881 227 HA PHE 29 HA PHE 29 6.152 4.458 7.597 228 HB2 PHE 29 HB2 PHE 29 3.281 3.926 6.809 229 HB3 PHE 29 HB3 PHE 29 3.881 3.793 8.446 230 HD1 PHE 29 HD1 PHE 29 2.974 6.141 5.759 231 HD2 PHE 29 HD2 PHE 29 4.622 5.804 9.724 232 HE1 PHE 29 HE1 PHE 29 2.585 8.551 6.121 233 HE2 PHE 29 HE2 PHE 29 4.108 8.190 10.136 234 HZ PHE 29 HZ PHE 29 3.086 9.571 8.355 235 H LYS 30 H LYS 30 6.890 2.685 8.597 236 HA LYS 30 HA LYS 30 6.895 0.087 7.276 237 HB2 LYS 30 HB2 LYS 30 7.913 0.950 10.001 238 HB3 LYS 30 HB3 LYS 30 7.886 -0.719 9.449 239 HG2 LYS 30 HG2 LYS 30 10.060 -0.099 9.020 240 HG3 LYS 30 HG3 LYS 30 9.279 -0.018 7.442 241 HD2 LYS 30 HD2 LYS 30 9.007 2.461 7.807 242 HD3 LYS 30 HD3 LYS 30 9.894 2.307 9.305 243 HE2 LYS 30 HE2 LYS 30 11.125 1.268 6.717 244 HE3 LYS 30 HE3 LYS 30 11.069 3.010 6.969 245 HZ1 LYS 30 HZ1 LYS 30 13.169 2.123 7.616 246 HZ2 LYS 30 HZ2 LYS 30 12.454 2.756 8.897 247 HZ3 LYS 30 HZ3 LYS 30 12.519 1.095 8.693 248 H LYS 31 H LYS 31 5.535 1.025 10.402 249 HA LYS 31 HA LYS 31 4.053 -1.488 10.601 250 HB2 LYS 31 HB2 LYS 31 3.903 1.056 12.254 251 HB3 LYS 31 HB3 LYS 31 2.811 -0.303 12.501 252 HG2 LYS 31 HG2 LYS 31 4.517 -0.443 14.106 253 HG3 LYS 31 HG3 LYS 31 4.714 -1.791 12.984 254 HD2 LYS 31 HD2 LYS 31 6.667 -0.815 12.006 255 HD3 LYS 31 HD3 LYS 31 6.298 0.788 12.665 256 HE2 LYS 31 HE2 LYS 31 8.157 -0.308 13.853 257 HE3 LYS 31 HE3 LYS 31 6.812 0.106 14.907 258 HZ1 LYS 31 HZ1 LYS 31 7.237 -2.603 13.817 259 HZ2 LYS 31 HZ2 LYS 31 7.844 -2.073 15.242 260 HZ3 LYS 31 HZ3 LYS 31 6.226 -2.141 15.069 261 H GLY 32 H GLY 32 2.147 -2.067 9.762 262 HA2 GLY 32 HA2 GLY 32 0.518 -0.650 8.003 263 HA3 GLY 32 HA3 GLY 32 0.051 -2.075 8.907 264 H ASN 33 H ASN 33 0.509 -0.229 11.447 265 HA ASN 33 HA ASN 33 -2.308 0.627 11.537 266 HB2 ASN 33 HB2 ASN 33 -2.151 0.609 13.790 267 HB3 ASN 33 HB3 ASN 33 -0.960 -0.620 13.425 268 HD21 ASN 33 HD21 ASN 33 1.293 1.249 12.742 269 HD22 ASN 33 HD22 ASN 33 1.679 1.965 14.309 270 H GLN 34 H GLN 34 0.682 2.244 10.831 271 HA GLN 34 HA GLN 34 -0.512 4.875 11.570 272 HB2 GLN 34 HB2 GLN 34 1.786 5.716 11.813 273 HB3 GLN 34 HB3 GLN 34 1.368 4.479 12.996 274 HG2 GLN 34 HG2 GLN 34 2.644 2.808 11.801 275 HG3 GLN 34 HG3 GLN 34 2.919 3.901 10.453 276 HE21 GLN 34 HE21 GLN 34 5.265 3.614 10.651 277 HE22 GLN 34 HE22 GLN 34 6.128 4.283 12.019 278 H VAL 35 H VAL 35 -0.397 3.029 9.024 279 HA VAL 35 HA VAL 35 1.003 4.572 7.044 280 HB VAL 35 HB VAL 35 -0.379 3.326 5.405 281 HG11 VAL 35 HG11 VAL 35 0.663 1.570 7.665 282 HG12 VAL 35 HG12 VAL 35 0.375 1.061 5.989 283 HG13 VAL 35 HG13 VAL 35 1.623 2.261 6.343 284 HG21 VAL 35 HG21 VAL 35 -1.906 2.221 7.817 285 HG22 VAL 35 HG22 VAL 35 -2.558 3.227 6.515 286 HG23 VAL 35 HG23 VAL 35 -1.994 1.587 6.167 287 H LYS 36 H LYS 36 0.007 5.925 5.327 288 HA LYS 36 HA LYS 36 -2.484 7.361 5.999 289 HB2 LYS 36 HB2 LYS 36 0.300 8.494 5.468 290 HB3 LYS 36 HB3 LYS 36 -1.159 9.417 5.114 291 HG2 LYS 36 HG2 LYS 36 -1.886 9.309 7.438 292 HG3 LYS 36 HG3 LYS 36 -0.525 8.271 7.860 293 HD2 LYS 36 HD2 LYS 36 -0.177 10.580 8.603 294 HD3 LYS 36 HD3 LYS 36 1.065 10.049 7.467 295 HE2 LYS 36 HE2 LYS 36 0.114 11.328 5.673 296 HE3 LYS 36 HE3 LYS 36 -1.314 11.742 6.621 297 HZ1 LYS 36 HZ1 LYS 36 1.416 12.596 7.412 298 HZ2 LYS 36 HZ2 LYS 36 0.424 13.489 6.469 299 HZ3 LYS 36 HZ3 LYS 36 -0.026 13.133 8.006 300 HA PRO 37 HA PRO 37 -3.026 6.340 1.757 301 HB2 PRO 37 HB2 PRO 37 -4.549 8.347 0.658 302 HB3 PRO 37 HB3 PRO 37 -5.165 7.161 1.845 303 HG2 PRO 37 HG2 PRO 37 -4.238 9.991 2.345 304 HG3 PRO 37 HG3 PRO 37 -5.666 9.143 3.013 305 HD2 PRO 37 HD2 PRO 37 -3.288 9.419 4.383 306 HD3 PRO 37 HD3 PRO 37 -4.394 8.041 4.620 307 H LEU 38 H LEU 38 -2.375 6.635 -0.380 308 HA LEU 38 HA LEU 38 -0.309 8.702 -0.903 309 HB2 LEU 38 HB2 LEU 38 -0.579 5.749 -1.664 310 HB3 LEU 38 HB3 LEU 38 0.472 6.859 -2.498 311 HG LEU 38 HG LEU 38 1.819 5.684 -1.117 312 HD11 LEU 38 HD11 LEU 38 1.481 8.270 0.459 313 HD12 LEU 38 HD12 LEU 38 2.987 7.443 0.022 314 HD13 LEU 38 HD13 LEU 38 2.083 8.246 -1.205 315 HD21 LEU 38 HD21 LEU 38 0.071 4.834 0.436 316 HD22 LEU 38 HD22 LEU 38 1.635 5.180 1.160 317 HD23 LEU 38 HD23 LEU 38 0.300 6.329 1.375 318 H LYS 39 H LYS 39 0.080 8.985 -3.208 319 HA LYS 39 HA LYS 39 -2.086 10.015 -4.610 320 HB2 LYS 39 HB2 LYS 39 0.184 10.715 -4.934 321 HB3 LYS 39 HB3 LYS 39 0.708 9.125 -5.424 322 HG2 LYS 39 HG2 LYS 39 -1.369 10.378 -7.185 323 HG3 LYS 39 HG3 LYS 39 0.181 11.196 -7.123 324 HD2 LYS 39 HD2 LYS 39 1.362 9.056 -7.671 325 HD3 LYS 39 HD3 LYS 39 -0.188 8.265 -7.813 326 HE2 LYS 39 HE2 LYS 39 -0.118 8.870 -10.001 327 HE3 LYS 39 HE3 LYS 39 -0.562 10.490 -9.437 328 HZ1 LYS 39 HZ1 LYS 39 1.932 10.845 -9.218 329 HZ2 LYS 39 HZ2 LYS 39 2.133 9.451 -10.038 330 HZ3 LYS 39 HZ3 LYS 39 1.372 10.721 -10.758 331 H ILE 40 H ILE 40 -3.287 9.347 -6.430 332 HA ILE 40 HA ILE 40 -4.053 6.638 -6.408 333 HB ILE 40 HB ILE 40 -5.578 8.452 -6.943 334 HG12 ILE 40 HG12 ILE 40 -6.713 7.513 -8.908 335 HG13 ILE 40 HG13 ILE 40 -5.292 6.550 -9.316 336 HG21 ILE 40 HG21 ILE 40 -5.551 9.653 -9.030 337 HG22 ILE 40 HG22 ILE 40 -3.963 9.864 -8.270 338 HG23 ILE 40 HG23 ILE 40 -4.149 8.707 -9.598 339 HD11 ILE 40 HD11 ILE 40 -5.569 5.222 -7.272 340 HD12 ILE 40 HD12 ILE 40 -6.892 6.286 -6.733 341 HD13 ILE 40 HD13 ILE 40 -7.088 5.262 -8.173 342 H GLY 41 H GLY 41 -3.103 5.023 -7.229 343 HA2 GLY 41 HA2 GLY 41 -1.891 3.593 -8.635 344 HA3 GLY 41 HA3 GLY 41 -1.877 4.886 -9.829 345 H ILE 42 H ILE 42 -0.519 5.574 -6.676 346 HA ILE 42 HA ILE 42 1.919 6.540 -7.434 347 HB ILE 42 HB ILE 42 0.874 6.845 -5.284 348 HG12 ILE 42 HG12 ILE 42 3.717 5.830 -5.036 349 HG13 ILE 42 HG13 ILE 42 3.239 7.357 -5.768 350 HG21 ILE 42 HG21 ILE 42 0.039 4.689 -4.660 351 HG22 ILE 42 HG22 ILE 42 1.650 3.951 -4.703 352 HG23 ILE 42 HG23 ILE 42 1.259 5.101 -3.457 353 HD11 ILE 42 HD11 ILE 42 3.941 7.812 -3.542 354 HD12 ILE 42 HD12 ILE 42 2.180 7.992 -3.569 355 HD13 ILE 42 HD13 ILE 42 2.943 6.529 -2.877 356 H PHE 43 H PHE 43 1.124 2.993 -7.100 357 HA PHE 43 HA PHE 43 3.844 2.121 -6.715 358 HB2 PHE 43 HB2 PHE 43 2.858 0.143 -6.533 359 HB3 PHE 43 HB3 PHE 43 1.357 0.747 -7.210 360 HD1 PHE 43 HD1 PHE 43 0.886 0.597 -9.598 361 HD2 PHE 43 HD2 PHE 43 4.573 -1.164 -8.074 362 HE1 PHE 43 HE1 PHE 43 1.335 -0.436 -11.794 363 HE2 PHE 43 HE2 PHE 43 4.942 -2.165 -10.251 364 HZ PHE 43 HZ PHE 43 3.409 -1.763 -12.142 365 H ASP 44 H ASP 44 2.004 3.155 -9.564 366 HA ASP 44 HA ASP 44 3.904 2.180 -11.491 367 HB2 ASP 44 HB2 ASP 44 1.436 2.806 -11.842 368 HB3 ASP 44 HB3 ASP 44 1.994 4.485 -11.934 369 H ASP 45 H ASP 45 3.828 5.038 -9.495 370 HA ASP 45 HA ASP 45 5.737 6.585 -11.114 371 HB2 ASP 45 HB2 ASP 45 4.602 6.959 -8.298 372 HB3 ASP 45 HB3 ASP 45 5.714 8.069 -9.116 373 H LEU 46 H LEU 46 5.570 4.742 -8.210 374 HA LEU 46 HA LEU 46 8.216 4.924 -7.183 375 HB2 LEU 46 HB2 LEU 46 6.185 4.567 -5.873 376 HB3 LEU 46 HB3 LEU 46 5.910 3.022 -6.638 377 HG LEU 46 HG LEU 46 6.854 3.140 -4.244 378 HD11 LEU 46 HD11 LEU 46 6.543 1.092 -5.235 379 HD12 LEU 46 HD12 LEU 46 7.850 1.288 -6.402 380 HD13 LEU 46 HD13 LEU 46 8.229 1.054 -4.691 381 HD21 LEU 46 HD21 LEU 46 9.535 3.507 -5.611 382 HD22 LEU 46 HD22 LEU 46 8.690 4.707 -4.612 383 HD23 LEU 46 HD23 LEU 46 9.228 3.189 -3.910 384 H ILE 47 H ILE 47 6.637 2.730 -9.456 385 HA ILE 47 HA ILE 47 8.360 0.577 -9.358 386 HB ILE 47 HB ILE 47 6.173 1.163 -10.750 387 HG12 ILE 47 HG12 ILE 47 7.065 -1.026 -10.508 388 HG13 ILE 47 HG13 ILE 47 6.276 -0.728 -12.043 389 HG21 ILE 47 HG21 ILE 47 6.342 1.630 -13.022 390 HG22 ILE 47 HG22 ILE 47 7.261 2.880 -12.184 391 HG23 ILE 47 HG23 ILE 47 8.127 1.608 -13.014 392 HD11 ILE 47 HD11 ILE 47 8.200 -2.104 -12.399 393 HD12 ILE 47 HD12 ILE 47 8.494 -0.549 -13.174 394 HD13 ILE 47 HD13 ILE 47 9.296 -0.944 -11.647 395 H ASP 48 H ASP 48 8.801 3.773 -10.765 396 HA ASP 48 HA ASP 48 11.051 3.174 -12.439 397 HB2 ASP 48 HB2 ASP 48 9.841 5.674 -11.341 398 HB3 ASP 48 HB3 ASP 48 11.501 5.757 -11.858 399 H PHE 49 H PHE 49 10.832 3.593 -8.999 400 HA PHE 49 HA PHE 49 13.650 4.245 -8.624 401 HB2 PHE 49 HB2 PHE 49 11.503 4.714 -7.097 402 HB3 PHE 49 HB3 PHE 49 12.027 3.218 -6.343 403 HD1 PHE 49 HD1 PHE 49 13.769 3.354 -4.728 404 HD2 PHE 49 HD2 PHE 49 13.227 6.609 -7.462 405 HE1 PHE 49 HE1 PHE 49 15.573 4.634 -3.561 406 HE2 PHE 49 HE2 PHE 49 14.998 7.879 -6.300 407 HZ PHE 49 HZ PHE 49 16.174 6.905 -4.343 408 H TYR 50 H TYR 50 11.777 1.176 -8.595 409 HA TYR 50 HA TYR 50 13.685 -0.589 -7.500 410 HB2 TYR 50 HB2 TYR 50 11.406 -1.319 -8.011 411 HB3 TYR 50 HB3 TYR 50 11.507 -0.684 -9.612 412 HD1 TYR 50 HD1 TYR 50 12.849 -3.552 -7.587 413 HD2 TYR 50 HD2 TYR 50 11.923 -1.957 -11.475 414 HE1 TYR 50 HE1 TYR 50 12.956 -5.819 -8.519 415 HE2 TYR 50 HE2 TYR 50 12.287 -4.201 -12.466 416 HH TYR 50 HH TYR 50 13.087 -6.406 -11.994 417 H GLU 51 H GLU 51 13.233 0.924 -10.654 418 HA GLU 51 HA GLU 51 14.841 -0.763 -12.294 419 HB2 GLU 51 HB2 GLU 51 14.003 2.117 -12.678 420 HB3 GLU 51 HB3 GLU 51 14.775 1.131 -13.915 421 HG2 GLU 51 HG2 GLU 51 12.346 -0.032 -12.608 422 HG3 GLU 51 HG3 GLU 51 12.081 1.397 -13.606 423 H ARG 52 H ARG 52 15.651 1.563 -9.869 424 HA ARG 52 HA ARG 52 18.337 2.180 -10.891 425 HB2 ARG 52 HB2 ARG 52 17.080 2.696 -8.146 426 HB3 ARG 52 HB3 ARG 52 18.593 3.314 -8.727 427 HG2 ARG 52 HG2 ARG 52 15.867 4.000 -9.929 428 HG3 ARG 52 HG3 ARG 52 16.788 5.017 -8.815 429 HD2 ARG 52 HD2 ARG 52 18.645 5.155 -10.451 430 HD3 ARG 52 HD3 ARG 52 17.743 4.079 -11.536 431 HE ARG 52 HE ARG 52 16.552 6.663 -10.741 432 HH11 ARG 52 HH11 ARG 52 18.231 4.780 -13.285 433 HH12 ARG 52 HH12 ARG 52 17.518 5.658 -14.589 434 HH21 ARG 52 HH21 ARG 52 15.642 7.867 -12.541 435 HH22 ARG 52 HH22 ARG 52 16.191 7.518 -14.144 436 H LEU 53 H LEU 53 16.851 -0.380 -9.030 437 HA LEU 53 HA LEU 53 19.157 -1.054 -7.445 438 HB2 LEU 53 HB2 LEU 53 17.010 -2.939 -8.487 439 HB3 LEU 53 HB3 LEU 53 18.061 -3.180 -7.089 440 HG LEU 53 HG LEU 53 15.849 -1.093 -7.342 441 HD11 LEU 53 HD11 LEU 53 14.653 -2.363 -5.771 442 HD12 LEU 53 HD12 LEU 53 15.118 -3.438 -7.090 443 HD13 LEU 53 HD13 LEU 53 16.017 -3.509 -5.543 444 HD21 LEU 53 HD21 LEU 53 17.454 -0.048 -6.027 445 HD22 LEU 53 HD22 LEU 53 16.194 -0.644 -4.962 446 HD23 LEU 53 HD23 LEU 53 17.746 -1.527 -5.053 447 H ASP 54 H ASP 54 20.907 -2.230 -8.013 448 HA ASP 54 HA ASP 54 21.390 -2.699 -10.892 449 HB2 ASP 54 HB2 ASP 54 23.072 -1.532 -9.861 450 HB3 ASP 54 HB3 ASP 54 23.006 -2.446 -8.375 451 H THR 55 H THR 55 20.478 -4.499 -8.113 452 HA THR 55 HA THR 55 20.467 -7.026 -9.667 453 HB THR 55 HB THR 55 21.702 -6.778 -6.913 454 HG1 THR 55 HG1 THR 55 22.809 -6.486 -9.318 455 HG21 THR 55 HG21 THR 55 20.622 -8.996 -7.253 456 HG22 THR 55 HG22 THR 55 21.562 -9.232 -8.717 457 HG23 THR 55 HG23 THR 55 22.384 -9.130 -7.153 458 HA PRO 56 HA PRO 56 16.654 -5.975 -7.352 459 HB2 PRO 56 HB2 PRO 56 14.922 -6.582 -9.396 460 HB3 PRO 56 HB3 PRO 56 15.655 -4.964 -9.133 461 HG2 PRO 56 HG2 PRO 56 16.387 -7.124 -11.096 462 HG3 PRO 56 HG3 PRO 56 16.406 -5.346 -11.314 463 HD2 PRO 56 HD2 PRO 56 18.639 -6.889 -10.773 464 HD3 PRO 56 HD3 PRO 56 18.492 -5.163 -10.333 465 HA PRO 57 HA PRO 57 16.420 -10.500 -6.710 466 HB2 PRO 57 HB2 PRO 57 15.080 -10.535 -4.320 467 HB3 PRO 57 HB3 PRO 57 16.814 -10.137 -4.484 468 HG2 PRO 57 HG2 PRO 57 14.486 -8.210 -4.243 469 HG3 PRO 57 HG3 PRO 57 16.055 -8.175 -3.387 470 HD2 PRO 57 HD2 PRO 57 15.578 -6.676 -5.634 471 HD3 PRO 57 HD3 PRO 57 17.178 -7.354 -5.262 472 H PHE 58 H PHE 58 13.381 -8.897 -5.549 473 HA PHE 58 HA PHE 58 11.762 -10.919 -6.867 474 HB2 PHE 58 HB2 PHE 58 11.096 -8.515 -5.142 475 HB3 PHE 58 HB3 PHE 58 9.880 -9.589 -5.819 476 HD1 PHE 58 HD1 PHE 58 10.065 -12.138 -5.321 477 HD2 PHE 58 HD2 PHE 58 12.087 -9.085 -3.030 478 HE1 PHE 58 HE1 PHE 58 10.258 -13.689 -3.390 479 HE2 PHE 58 HE2 PHE 58 12.223 -10.620 -1.106 480 HZ PHE 58 HZ PHE 58 11.293 -12.918 -1.271 481 H SER 59 H SER 59 9.759 -10.238 -8.080 482 HA SER 59 HA SER 59 10.576 -8.601 -10.346 483 HB2 SER 59 HB2 SER 59 8.010 -10.192 -9.959 484 HB3 SER 59 HB3 SER 59 8.673 -9.593 -11.478 485 HG SER 59 HG SER 59 9.285 -11.564 -11.498 486 H LYS 60 H LYS 60 9.058 -7.310 -11.528 487 HA LYS 60 HA LYS 60 8.065 -5.091 -10.115 488 HB2 LYS 60 HB2 LYS 60 7.379 -6.094 -12.885 489 HB3 LYS 60 HB3 LYS 60 6.941 -4.500 -12.234 490 HG2 LYS 60 HG2 LYS 60 9.331 -3.983 -11.894 491 HG3 LYS 60 HG3 LYS 60 9.793 -5.553 -12.547 492 HD2 LYS 60 HD2 LYS 60 9.004 -5.010 -14.747 493 HD3 LYS 60 HD3 LYS 60 8.145 -3.577 -14.167 494 HE2 LYS 60 HE2 LYS 60 10.324 -2.558 -13.475 495 HE3 LYS 60 HE3 LYS 60 11.170 -3.962 -14.140 496 HZ1 LYS 60 HZ1 LYS 60 10.453 -3.361 -16.302 497 HZ2 LYS 60 HZ2 LYS 60 9.503 -2.121 -15.730 498 HZ3 LYS 60 HZ3 LYS 60 11.139 -2.057 -15.593 499 H LYS 61 H LYS 61 6.076 -7.781 -11.467 500 HA LYS 61 HA LYS 61 3.660 -6.841 -10.376 501 HB2 LYS 61 HB2 LYS 61 2.778 -9.034 -10.733 502 HB3 LYS 61 HB3 LYS 61 3.877 -8.625 -12.039 503 HG2 LYS 61 HG2 LYS 61 4.561 -10.769 -11.728 504 HG3 LYS 61 HG3 LYS 61 5.642 -10.003 -10.588 505 HD2 LYS 61 HD2 LYS 61 4.753 -11.944 -9.539 506 HD3 LYS 61 HD3 LYS 61 3.948 -10.598 -8.740 507 HE2 LYS 61 HE2 LYS 61 1.950 -10.920 -10.197 508 HE3 LYS 61 HE3 LYS 61 2.778 -12.261 -10.994 509 HZ1 LYS 61 HZ1 LYS 61 1.430 -13.218 -9.383 510 HZ2 LYS 61 HZ2 LYS 61 2.924 -13.262 -8.694 511 HZ3 LYS 61 HZ3 LYS 61 1.839 -12.156 -8.196 512 H SER 62 H SER 62 6.199 -8.814 -8.766 513 HA SER 62 HA SER 62 4.720 -9.547 -6.519 514 HB2 SER 62 HB2 SER 62 7.715 -9.099 -6.600 515 HB3 SER 62 HB3 SER 62 6.802 -10.267 -5.634 516 HG SER 62 HG SER 62 7.712 -11.290 -7.487 517 H LEU 63 H LEU 63 6.334 -6.482 -7.285 518 HA LEU 63 HA LEU 63 6.316 -5.425 -4.606 519 HB2 LEU 63 HB2 LEU 63 7.687 -4.579 -6.548 520 HB3 LEU 63 HB3 LEU 63 6.191 -3.945 -7.239 521 HG LEU 63 HG LEU 63 7.236 -3.125 -4.549 522 HD11 LEU 63 HD11 LEU 63 8.351 -1.271 -5.361 523 HD12 LEU 63 HD12 LEU 63 8.823 -2.533 -6.470 524 HD13 LEU 63 HD13 LEU 63 7.596 -1.362 -7.002 525 HD21 LEU 63 HD21 LEU 63 5.088 -2.394 -4.477 526 HD22 LEU 63 HD22 LEU 63 5.833 -0.995 -5.225 527 HD23 LEU 63 HD23 LEU 63 4.968 -2.151 -6.237 528 H ARG 64 H ARG 64 4.217 -4.872 -7.471 529 HA ARG 64 HA ARG 64 2.250 -3.353 -6.177 530 HB2 ARG 64 HB2 ARG 64 2.525 -3.510 -8.612 531 HB3 ARG 64 HB3 ARG 64 2.024 -5.195 -8.599 532 HG2 ARG 64 HG2 ARG 64 0.287 -3.658 -9.411 533 HG3 ARG 64 HG3 ARG 64 -0.234 -4.603 -8.015 534 HD2 ARG 64 HD2 ARG 64 -0.224 -2.736 -6.564 535 HD3 ARG 64 HD3 ARG 64 0.844 -1.812 -7.622 536 HE ARG 64 HE ARG 64 -0.949 -0.964 -8.689 537 HH11 ARG 64 HH11 ARG 64 -2.109 -4.071 -7.363 538 HH12 ARG 64 HH12 ARG 64 -3.700 -3.848 -8.037 539 HH21 ARG 64 HH21 ARG 64 -2.991 -0.676 -9.382 540 HH22 ARG 64 HH22 ARG 64 -4.265 -1.817 -9.125 541 H GLU 65 H GLU 65 2.353 -6.913 -6.642 542 HA GLU 65 HA GLU 65 -0.158 -7.451 -5.484 543 HB2 GLU 65 HB2 GLU 65 1.153 -8.983 -6.878 544 HB3 GLU 65 HB3 GLU 65 2.331 -9.204 -5.581 545 HG2 GLU 65 HG2 GLU 65 0.817 -10.445 -4.260 546 HG3 GLU 65 HG3 GLU 65 -0.604 -9.750 -5.061 547 H ALA 66 H ALA 66 3.103 -7.231 -3.881 548 HA ALA 66 HA ALA 66 1.920 -7.864 -1.316 549 HB1 ALA 66 HB1 ALA 66 4.235 -8.400 -1.628 550 HB2 ALA 66 HB2 ALA 66 4.602 -6.690 -2.028 551 HB3 ALA 66 HB3 ALA 66 4.094 -7.155 -0.389 552 H LEU 67 H LEU 67 2.742 -4.761 -2.981 553 HA LEU 67 HA LEU 67 2.252 -3.095 -0.730 554 HB2 LEU 67 HB2 LEU 67 3.246 -2.617 -3.167 555 HB3 LEU 67 HB3 LEU 67 1.598 -2.110 -3.503 556 HG LEU 67 HG LEU 67 3.546 -1.008 -1.425 557 HD11 LEU 67 HD11 LEU 67 3.973 -0.322 -3.755 558 HD12 LEU 67 HD12 LEU 67 2.305 0.270 -3.906 559 HD13 LEU 67 HD13 LEU 67 3.442 1.046 -2.786 560 HD21 LEU 67 HD21 LEU 67 0.661 -0.137 -1.879 561 HD22 LEU 67 HD22 LEU 67 1.391 -0.733 -0.376 562 HD23 LEU 67 HD23 LEU 67 1.882 0.827 -1.017 563 H SER 68 H SER 68 0.001 -4.471 -3.240 564 HA SER 68 HA SER 68 -2.224 -2.932 -2.544 565 HB2 SER 68 HB2 SER 68 -3.574 -4.916 -3.392 566 HB3 SER 68 HB3 SER 68 -2.474 -4.103 -4.499 567 HG SER 68 HG SER 68 -1.341 -6.305 -3.275 568 H TYR 69 H TYR 69 -0.749 -5.582 -0.888 569 HA TYR 69 HA TYR 69 -2.888 -6.367 0.808 570 HB2 TYR 69 HB2 TYR 69 -0.370 -7.259 0.173 571 HB3 TYR 69 HB3 TYR 69 -0.077 -6.578 1.774 572 HD1 TYR 69 HD1 TYR 69 -0.584 -7.969 3.658 573 HD2 TYR 69 HD2 TYR 69 -2.280 -8.775 -0.221 574 HE1 TYR 69 HE1 TYR 69 -1.437 -10.129 4.503 575 HE2 TYR 69 HE2 TYR 69 -3.207 -10.958 0.645 576 HH TYR 69 HH TYR 69 -3.004 -11.804 4.103 577 H TYR 70 H TYR 70 -0.281 -3.869 1.098 578 HA TYR 70 HA TYR 70 -0.947 -3.229 3.857 579 HB2 TYR 70 HB2 TYR 70 1.009 -2.292 1.841 580 HB3 TYR 70 HB3 TYR 70 0.324 -1.007 2.822 581 HD1 TYR 70 HD1 TYR 70 1.004 -4.550 3.967 582 HD2 TYR 70 HD2 TYR 70 2.133 -0.390 4.196 583 HE1 TYR 70 HE1 TYR 70 2.478 -5.040 5.892 584 HE2 TYR 70 HE2 TYR 70 3.664 -0.891 6.039 585 HH TYR 70 HH TYR 70 4.452 -2.494 7.447 586 H SER 71 H SER 71 -1.785 -1.818 0.627 587 HA SER 71 HA SER 71 -3.533 0.135 1.882 588 HB2 SER 71 HB2 SER 71 -4.494 0.088 -0.582 589 HB3 SER 71 HB3 SER 71 -3.002 0.922 -0.128 590 HG SER 71 HG SER 71 -3.099 -0.622 -2.027 591 H ALA 72 H ALA 72 -3.836 -3.159 1.785 592 HA ALA 72 HA ALA 72 -6.805 -3.169 1.891 593 HB1 ALA 72 HB1 ALA 72 -4.829 -5.426 1.318 594 HB2 ALA 72 HB2 ALA 72 -6.571 -5.617 1.465 595 HB3 ALA 72 HB3 ALA 72 -5.918 -4.654 0.136 596 H SER 73 H SER 73 -4.301 -2.623 3.877 597 HA SER 73 HA SER 73 -4.610 -4.654 5.911 598 HB2 SER 73 HB2 SER 73 -3.503 -1.803 5.961 599 HB3 SER 73 HB3 SER 73 -3.617 -2.795 7.402 600 HG SER 73 HG SER 73 -2.433 -4.387 5.781 601 HA PRO 74 HA PRO 74 -8.413 -3.392 7.620 602 HB2 PRO 74 HB2 PRO 74 -7.916 -3.523 10.391 603 HB3 PRO 74 HB3 PRO 74 -8.450 -4.877 9.304 604 HG2 PRO 74 HG2 PRO 74 -5.723 -4.161 10.374 605 HG3 PRO 74 HG3 PRO 74 -6.395 -5.782 10.024 606 HD2 PRO 74 HD2 PRO 74 -4.585 -4.456 8.407 607 HD3 PRO 74 HD3 PRO 74 -5.784 -5.630 7.763 608 H ALA 75 H ALA 75 -5.586 -1.934 9.344 609 HA ALA 75 HA ALA 75 -6.892 0.271 10.418 610 HB1 ALA 75 HB1 ALA 75 -4.036 0.079 9.372 611 HB2 ALA 75 HB2 ALA 75 -4.649 1.212 10.603 612 HB3 ALA 75 HB3 ALA 75 -4.626 -0.537 10.938 613 H TYR 76 H TYR 76 -5.274 0.057 7.188 614 HA TYR 76 HA TYR 76 -5.652 2.730 6.421 615 HB2 TYR 76 HB2 TYR 76 -4.213 1.155 5.184 616 HB3 TYR 76 HB3 TYR 76 -5.602 0.170 4.750 617 HD1 TYR 76 HD1 TYR 76 -3.691 3.225 3.937 618 HD2 TYR 76 HD2 TYR 76 -7.273 0.963 3.077 619 HE1 TYR 76 HE1 TYR 76 -4.051 4.553 1.919 620 HE2 TYR 76 HE2 TYR 76 -7.638 2.306 1.041 621 HH TYR 76 HH TYR 76 -6.780 4.042 -0.361 622 H LEU 77 H LEU 77 -7.882 -0.008 6.027 623 HA LEU 77 HA LEU 77 -9.813 1.620 4.586 624 HB2 LEU 77 HB2 LEU 77 -10.176 -1.092 5.907 625 HB3 LEU 77 HB3 LEU 77 -11.213 -0.362 4.683 626 HG LEU 77 HG LEU 77 -8.297 -0.965 4.094 627 HD11 LEU 77 HD11 LEU 77 -8.978 -3.079 3.175 628 HD12 LEU 77 HD12 LEU 77 -9.332 -3.009 4.901 629 HD13 LEU 77 HD13 LEU 77 -10.650 -2.815 3.728 630 HD21 LEU 77 HD21 LEU 77 -9.420 0.587 2.566 631 HD22 LEU 77 HD22 LEU 77 -9.022 -0.952 1.788 632 HD23 LEU 77 HD23 LEU 77 -10.698 -0.595 2.288 633 H SER 78 H SER 78 -9.573 0.250 7.848 634 HA SER 78 HA SER 78 -11.973 1.187 8.954 635 HB2 SER 78 HB2 SER 78 -10.419 -0.510 9.855 636 HB3 SER 78 HB3 SER 78 -9.245 0.762 10.245 637 HG SER 78 HG SER 78 -11.107 1.672 11.481 638 H CYS 79 H CYS 79 -8.938 2.948 8.328 639 HA CYS 79 HA CYS 79 -9.731 5.202 10.016 640 HB2 CYS 79 HB2 CYS 79 -7.599 6.001 9.760 641 HB3 CYS 79 HB3 CYS 79 -7.430 4.250 9.952 642 HG CYS 79 HG CYS 79 -5.826 5.751 8.161 643 H GLN 80 H GLN 80 -10.943 4.280 7.177 644 HA GLN 80 HA GLN 80 -10.843 6.004 5.149 645 HB2 GLN 80 HB2 GLN 80 -13.386 5.758 5.049 646 HB3 GLN 80 HB3 GLN 80 -12.419 4.302 5.057 647 HG2 GLN 80 HG2 GLN 80 -12.938 4.166 7.610 648 HG3 GLN 80 HG3 GLN 80 -14.119 5.436 7.312 649 HE21 GLN 80 HE21 GLN 80 -15.277 3.348 8.348 650 HE22 GLN 80 HE22 GLN 80 -16.063 2.377 7.113 651 H LYS 81 H LYS 81 -10.127 8.152 5.676 652 HA LYS 81 HA LYS 81 -12.224 9.948 6.726 653 HB2 LYS 81 HB2 LYS 81 -9.237 9.937 7.184 654 HB3 LYS 81 HB3 LYS 81 -10.246 11.332 7.506 655 HG2 LYS 81 HG2 LYS 81 -11.425 8.925 8.713 656 HG3 LYS 81 HG3 LYS 81 -9.747 9.106 9.207 657 HD2 LYS 81 HD2 LYS 81 -11.623 11.448 9.350 658 HD3 LYS 81 HD3 LYS 81 -11.644 10.176 10.596 659 HE2 LYS 81 HE2 LYS 81 -9.267 10.444 11.029 660 HE3 LYS 81 HE3 LYS 81 -9.123 11.645 9.735 661 HZ1 LYS 81 HZ1 LYS 81 -10.631 13.086 10.985 662 HZ2 LYS 81 HZ2 LYS 81 -10.648 11.993 12.250 663 HZ3 LYS 81 HZ3 LYS 81 -9.273 12.771 11.812 664 HA PRO 82 HA PRO 82 -11.278 11.468 2.515 665 HB2 PRO 82 HB2 PRO 82 -13.473 13.057 2.189 666 HB3 PRO 82 HB3 PRO 82 -13.584 11.280 2.088 667 HG2 PRO 82 HG2 PRO 82 -14.182 13.051 4.484 668 HG3 PRO 82 HG3 PRO 82 -15.207 11.751 3.807 669 HD2 PRO 82 HD2 PRO 82 -13.563 11.332 5.925 670 HD3 PRO 82 HD3 PRO 82 -13.837 10.057 4.708 671 H ASP 83 H ASP 83 -11.167 13.886 1.809 672 HA ASP 83 HA ASP 83 -10.075 15.946 2.179 673 HB2 ASP 83 HB2 ASP 83 -11.955 16.909 3.011 674 HB3 ASP 83 HB3 ASP 83 -12.127 15.782 4.337 675 H THR 84 H THR 84 -8.222 14.559 2.189 676 HA THR 84 HA THR 84 -6.677 14.860 4.689 677 HB THR 84 HB THR 84 -7.654 12.642 4.805 678 HG1 THR 84 HG1 THR 84 -5.033 13.080 4.797 679 HG21 THR 84 HG21 THR 84 -6.293 12.029 2.149 680 HG22 THR 84 HG22 THR 84 -7.163 10.880 3.196 681 HG23 THR 84 HG23 THR 84 -8.053 12.180 2.417 682 H ALA 85 H ALA 85 -6.583 15.139 1.268 683 HA ALA 85 HA ALA 85 -4.941 15.596 -0.213 684 HB1 ALA 85 HB1 ALA 85 -3.283 17.236 0.474 685 HB2 ALA 85 HB2 ALA 85 -4.882 17.640 1.133 686 HB3 ALA 85 HB3 ALA 85 -3.638 16.924 2.185 687 H ARG 86 H ARG 86 -4.332 13.576 -0.773 688 HA ARG 86 HA ARG 86 -2.274 12.161 0.761 689 HB2 ARG 86 HB2 ARG 86 -2.425 10.400 -0.967 690 HB3 ARG 86 HB3 ARG 86 -3.976 10.847 -0.259 691 HG2 ARG 86 HG2 ARG 86 -4.020 12.441 -2.441 692 HG3 ARG 86 HG3 ARG 86 -2.947 11.176 -3.021 693 HD2 ARG 86 HD2 ARG 86 -4.644 9.535 -2.955 694 HD3 ARG 86 HD3 ARG 86 -5.604 10.453 -1.799 695 HE ARG 86 HE ARG 86 -6.788 11.126 -3.572 696 HH11 ARG 86 HH11 ARG 86 -3.439 11.458 -4.692 697 HH12 ARG 86 HH12 ARG 86 -3.956 11.925 -6.297 698 HH21 ARG 86 HH21 ARG 86 -7.342 11.923 -5.586 699 HH22 ARG 86 HH22 ARG 86 -6.136 12.262 -6.783 700 H VAL 87 H VAL 87 -0.247 11.264 -0.625 701 HA VAL 87 HA VAL 87 0.982 13.490 -2.150 702 HB VAL 87 HB VAL 87 3.071 13.141 -0.886 703 HG11 VAL 87 HG11 VAL 87 0.758 14.135 0.829 704 HG12 VAL 87 HG12 VAL 87 2.483 14.527 1.021 705 HG13 VAL 87 HG13 VAL 87 1.617 15.053 -0.424 706 HG21 VAL 87 HG21 VAL 87 1.346 11.587 1.092 707 HG22 VAL 87 HG22 VAL 87 2.674 10.935 0.115 708 HG23 VAL 87 HG23 VAL 87 3.007 12.136 1.370 709 H ASP 88 H ASP 88 2.713 12.845 -3.447 710 HA ASP 88 HA ASP 88 2.584 10.039 -4.425 711 HB2 ASP 88 HB2 ASP 88 1.909 11.844 -5.907 712 HB3 ASP 88 HB3 ASP 88 3.497 12.625 -5.741 713 H ILE 89 H ILE 89 4.916 9.425 -5.377 714 HA ILE 89 HA ILE 89 6.715 9.219 -3.157 715 HB ILE 89 HB ILE 89 8.407 8.489 -4.931 716 HG12 ILE 89 HG12 ILE 89 6.104 8.259 -6.861 717 HG13 ILE 89 HG13 ILE 89 6.963 9.782 -6.778 718 HG21 ILE 89 HG21 ILE 89 5.740 7.050 -4.901 719 HG22 ILE 89 HG22 ILE 89 7.332 6.372 -5.294 720 HG23 ILE 89 HG23 ILE 89 6.999 6.924 -3.640 721 HD11 ILE 89 HD11 ILE 89 7.866 8.292 -8.525 722 HD12 ILE 89 HD12 ILE 89 9.067 8.768 -7.333 723 HD13 ILE 89 HD13 ILE 89 8.353 7.135 -7.272 724 H TYR 90 H TYR 90 6.429 11.695 -5.665 725 HA TYR 90 HA TYR 90 9.044 12.835 -5.102 726 HB2 TYR 90 HB2 TYR 90 6.602 13.702 -6.677 727 HB3 TYR 90 HB3 TYR 90 8.091 14.639 -6.623 728 HD1 TYR 90 HD1 TYR 90 6.482 11.561 -7.982 729 HD2 TYR 90 HD2 TYR 90 10.154 13.828 -7.709 730 HE1 TYR 90 HE1 TYR 90 7.419 10.248 -9.813 731 HE2 TYR 90 HE2 TYR 90 11.118 12.454 -9.540 732 HH TYR 90 HH TYR 90 9.411 9.647 -10.928 733 H GLY 91 H GLY 91 6.405 12.642 -3.074 734 HA2 GLY 91 HA2 GLY 91 5.931 13.707 -1.160 735 HA3 GLY 91 HA3 GLY 91 7.244 14.858 -1.466 736 H ASN 92 H ASN 92 5.475 14.997 -4.246 737 HA ASN 92 HA ASN 92 4.402 17.549 -3.734 738 HB2 ASN 92 HB2 ASN 92 3.366 15.672 -5.882 739 HB3 ASN 92 HB3 ASN 92 3.409 17.427 -5.897 740 HD21 ASN 92 HD21 ASN 92 4.435 15.459 -7.840 741 HD22 ASN 92 HD22 ASN 92 6.170 15.691 -7.992 742 H GLU 93 H GLU 93 2.396 18.229 -3.069 743 HA GLU 93 HA GLU 93 0.635 16.311 -1.855 744 HB2 GLU 93 HB2 GLU 93 0.826 19.299 -2.310 745 HB3 GLU 93 HB3 GLU 93 -0.725 18.603 -1.881 746 HG2 GLU 93 HG2 GLU 93 0.009 17.829 0.229 747 HG3 GLU 93 HG3 GLU 93 1.705 17.941 -0.228 748 H VAL 94 H VAL 94 -1.209 15.570 -2.676 749 HA VAL 94 HA VAL 94 -2.098 16.320 -5.356 750 HB VAL 94 HB VAL 94 -2.727 13.930 -5.753 751 HG11 VAL 94 HG11 VAL 94 -0.982 15.059 -7.015 752 HG12 VAL 94 HG12 VAL 94 0.206 14.776 -5.721 753 HG13 VAL 94 HG13 VAL 94 -0.456 13.415 -6.644 754 HG21 VAL 94 HG21 VAL 94 -2.190 13.208 -3.412 755 HG22 VAL 94 HG22 VAL 94 -1.481 12.205 -4.711 756 HG23 VAL 94 HG23 VAL 94 -0.470 13.360 -3.820 757 H ASP 95 H ASP 95 -4.532 15.108 -5.533 758 HA ASP 95 HA ASP 95 -5.973 16.952 -3.887 759 HB2 ASP 95 HB2 ASP 95 -7.367 14.649 -5.233 760 HB3 ASP 95 HB3 ASP 95 -7.797 16.349 -5.189 761 H VAL 96 H VAL 96 -8.254 15.859 -2.982 762 HA VAL 96 HA VAL 96 -7.307 13.963 -0.892 763 HB VAL 96 HB VAL 96 -8.797 14.985 0.568 764 HG11 VAL 96 HG11 VAL 96 -8.020 17.428 -1.065 765 HG12 VAL 96 HG12 VAL 96 -8.157 17.273 0.692 766 HG13 VAL 96 HG13 VAL 96 -6.825 16.510 -0.186 767 HG21 VAL 96 HG21 VAL 96 -10.851 15.153 -0.717 768 HG22 VAL 96 HG22 VAL 96 -10.449 16.759 -0.088 769 HG23 VAL 96 HG23 VAL 96 -10.111 16.373 -1.785 770 H VAL 97 H VAL 97 -8.740 12.432 -0.051 771 HA VAL 97 HA VAL 97 -10.081 10.921 -2.137 772 HB VAL 97 HB VAL 97 -10.119 10.429 0.876 773 HG11 VAL 97 HG11 VAL 97 -10.464 8.524 -1.494 774 HG12 VAL 97 HG12 VAL 97 -10.507 8.084 0.229 775 HG13 VAL 97 HG13 VAL 97 -11.772 9.112 -0.449 776 HG21 VAL 97 HG21 VAL 97 -8.223 8.865 0.470 777 HG22 VAL 97 HG22 VAL 97 -8.095 9.463 -1.196 778 HG23 VAL 97 HG23 VAL 97 -7.763 10.538 0.185 779 H THR 98 H THR 98 -12.275 10.977 -2.663 780 HA THR 98 HA THR 98 -13.856 13.125 -1.669 781 HB THR 98 HB THR 98 -15.596 11.630 -3.106 782 HG1 THR 98 HG1 THR 98 -14.110 10.693 -4.797 783 HG21 THR 98 HG21 THR 98 -14.804 13.824 -3.798 784 HG22 THR 98 HG22 THR 98 -13.229 13.147 -4.299 785 HG23 THR 98 HG23 THR 98 -14.722 12.716 -5.164 786 HA PRO 99 HA PRO 99 -15.732 11.317 1.821 787 HB2 PRO 99 HB2 PRO 99 -18.405 12.065 1.667 788 HB3 PRO 99 HB3 PRO 99 -17.048 13.104 2.201 789 HG2 PRO 99 HG2 PRO 99 -18.283 12.914 -0.559 790 HG3 PRO 99 HG3 PRO 99 -17.861 14.385 0.374 791 HD2 PRO 99 HD2 PRO 99 -16.206 13.470 -1.541 792 HD3 PRO 99 HD3 PRO 99 -15.538 14.073 0.006 793 H GLU 100 H GLU 100 -17.517 10.574 -1.176 794 HA GLU 100 HA GLU 100 -18.808 8.244 -0.058 795 HB2 GLU 100 HB2 GLU 100 -18.403 9.163 -2.922 796 HB3 GLU 100 HB3 GLU 100 -19.347 7.756 -2.424 797 HG2 GLU 100 HG2 GLU 100 -20.484 9.612 -0.795 798 HG3 GLU 100 HG3 GLU 100 -19.940 10.686 -2.085 799 H GLN 101 H GLN 101 -15.881 8.742 -2.146 800 HA GLN 101 HA GLN 101 -15.390 5.934 -2.357 801 HB2 GLN 101 HB2 GLN 101 -13.437 8.240 -2.646 802 HB3 GLN 101 HB3 GLN 101 -13.152 6.538 -3.079 803 HG2 GLN 101 HG2 GLN 101 -15.057 6.626 -4.678 804 HG3 GLN 101 HG3 GLN 101 -15.272 8.342 -4.308 805 HE21 GLN 101 HE21 GLN 101 -14.940 8.247 -6.842 806 HE22 GLN 101 HE22 GLN 101 -13.283 8.479 -7.362 807 H ALA 102 H ALA 102 -14.427 8.360 0.101 808 HA ALA 102 HA ALA 102 -12.458 6.716 1.375 809 HB1 ALA 102 HB1 ALA 102 -12.627 9.132 1.828 810 HB2 ALA 102 HB2 ALA 102 -14.245 8.921 2.530 811 HB3 ALA 102 HB3 ALA 102 -12.820 8.213 3.324 812 H LYS 103 H LYS 103 -15.964 7.217 2.151 813 HA LYS 103 HA LYS 103 -16.020 5.245 4.183 814 HB2 LYS 103 HB2 LYS 103 -18.450 5.374 4.096 815 HB3 LYS 103 HB3 LYS 103 -17.771 6.992 3.965 816 HG2 LYS 103 HG2 LYS 103 -18.201 7.000 1.576 817 HG3 LYS 103 HG3 LYS 103 -18.730 5.317 1.604 818 HD2 LYS 103 HD2 LYS 103 -20.672 6.542 1.435 819 HD3 LYS 103 HD3 LYS 103 -20.617 6.050 3.134 820 HE2 LYS 103 HE2 LYS 103 -19.835 8.285 3.778 821 HE3 LYS 103 HE3 LYS 103 -19.730 8.770 2.074 822 HZ1 LYS 103 HZ1 LYS 103 -22.112 8.460 1.896 823 HZ2 LYS 103 HZ2 LYS 103 -22.231 8.019 3.469 824 HZ3 LYS 103 HZ3 LYS 103 -21.772 9.552 3.075 825 H TYR 104 H TYR 104 -16.239 4.839 0.734 826 HA TYR 104 HA TYR 104 -17.421 2.332 0.505 827 HB2 TYR 104 HB2 TYR 104 -16.042 4.163 -1.193 828 HB3 TYR 104 HB3 TYR 104 -15.234 2.624 -1.394 829 HD1 TYR 104 HD1 TYR 104 -18.605 4.252 -1.302 830 HD2 TYR 104 HD2 TYR 104 -16.225 0.995 -2.830 831 HE1 TYR 104 HE1 TYR 104 -20.520 3.501 -2.658 832 HE2 TYR 104 HE2 TYR 104 -18.119 0.270 -4.255 833 HH TYR 104 HH TYR 104 -21.369 1.720 -3.867 834 H ALA 105 H ALA 105 -14.225 3.170 1.709 835 HA ALA 105 HA ALA 105 -12.776 0.792 1.302 836 HB1 ALA 105 HB1 ALA 105 -11.484 1.559 3.223 837 HB2 ALA 105 HB2 ALA 105 -11.890 2.944 2.189 838 HB3 ALA 105 HB3 ALA 105 -12.785 2.655 3.695 839 H TYR 106 H TYR 106 -15.389 1.502 3.615 840 HA TYR 106 HA TYR 106 -15.008 -0.596 5.402 841 HB2 TYR 106 HB2 TYR 106 -16.950 0.066 6.299 842 HB3 TYR 106 HB3 TYR 106 -16.735 1.436 5.262 843 HD1 TYR 106 HD1 TYR 106 -17.861 0.991 2.700 844 HD2 TYR 106 HD2 TYR 106 -19.034 -0.848 6.439 845 HE1 TYR 106 HE1 TYR 106 -20.117 0.530 1.783 846 HE2 TYR 106 HE2 TYR 106 -21.289 -1.250 5.541 847 HH TYR 106 HH TYR 106 -22.763 -0.835 3.760 848 H GLN 107 H GLN 107 -16.422 -0.770 2.131 849 HA GLN 107 HA GLN 107 -17.607 -3.361 2.463 850 HB2 GLN 107 HB2 GLN 107 -16.617 -1.872 0.019 851 HB3 GLN 107 HB3 GLN 107 -17.267 -3.518 -0.046 852 HG2 GLN 107 HG2 GLN 107 -19.309 -2.473 1.293 853 HG3 GLN 107 HG3 GLN 107 -18.713 -0.960 0.586 854 HE21 GLN 107 HE21 GLN 107 -18.241 -1.134 -1.885 855 HE22 GLN 107 HE22 GLN 107 -19.478 -1.984 -2.799 856 H ARG 108 H ARG 108 -14.418 -2.240 1.347 857 HA ARG 108 HA ARG 108 -13.323 -4.822 0.751 858 HB2 ARG 108 HB2 ARG 108 -11.755 -2.432 1.770 859 HB3 ARG 108 HB3 ARG 108 -11.212 -3.679 0.665 860 HG2 ARG 108 HG2 ARG 108 -13.285 -1.523 -0.014 861 HG3 ARG 108 HG3 ARG 108 -11.561 -1.463 -0.378 862 HD2 ARG 108 HD2 ARG 108 -11.772 -3.555 -1.706 863 HD3 ARG 108 HD3 ARG 108 -13.515 -3.546 -1.425 864 HE ARG 108 HE ARG 108 -13.430 -1.194 -2.474 865 HH11 ARG 108 HH11 ARG 108 -10.969 -3.584 -3.419 866 HH12 ARG 108 HH12 ARG 108 -10.940 -3.122 -5.060 867 HH21 ARG 108 HH21 ARG 108 -13.343 -0.493 -4.651 868 HH22 ARG 108 HH22 ARG 108 -12.348 -1.336 -5.793 869 H TYR 109 H TYR 109 -13.442 -2.860 3.753 870 HA TYR 109 HA TYR 109 -11.783 -4.583 5.329 871 HB2 TYR 109 HB2 TYR 109 -12.327 -2.299 5.879 872 HB3 TYR 109 HB3 TYR 109 -13.997 -2.655 6.167 873 HD1 TYR 109 HD1 TYR 109 -14.641 -4.387 7.999 874 HD2 TYR 109 HD2 TYR 109 -10.739 -2.532 7.659 875 HE1 TYR 109 HE1 TYR 109 -14.204 -4.860 10.365 876 HE2 TYR 109 HE2 TYR 109 -10.284 -3.065 10.010 877 HH TYR 109 HH TYR 109 -11.302 -3.655 12.038 878 H GLN 110 H GLN 110 -15.425 -4.385 5.106 879 HA GLN 110 HA GLN 110 -15.793 -6.598 6.768 880 HB2 GLN 110 HB2 GLN 110 -18.116 -6.604 6.178 881 HB3 GLN 110 HB3 GLN 110 -17.524 -4.946 6.309 882 HG2 GLN 110 HG2 GLN 110 -17.375 -4.828 3.863 883 HG3 GLN 110 HG3 GLN 110 -18.023 -6.446 3.706 884 HE21 GLN 110 HE21 GLN 110 -19.093 -3.659 5.813 885 HE22 GLN 110 HE22 GLN 110 -20.633 -3.487 4.979 886 H GLU 111 H GLU 111 -15.037 -6.466 3.362 887 HA GLU 111 HA GLU 111 -16.016 -9.000 2.514 888 HB2 GLU 111 HB2 GLU 111 -13.895 -7.085 1.590 889 HB3 GLU 111 HB3 GLU 111 -13.815 -8.710 0.954 890 HG2 GLU 111 HG2 GLU 111 -16.498 -7.323 0.917 891 HG3 GLU 111 HG3 GLU 111 -15.242 -6.748 -0.172 892 H ARG 112 H ARG 112 -12.974 -8.169 4.225 893 HA ARG 112 HA ARG 112 -12.425 -11.112 4.410 894 HB2 ARG 112 HB2 ARG 112 -10.484 -8.797 4.718 895 HB3 ARG 112 HB3 ARG 112 -10.128 -10.503 4.945 896 HG2 ARG 112 HG2 ARG 112 -11.327 -10.463 2.397 897 HG3 ARG 112 HG3 ARG 112 -10.438 -8.948 2.449 898 HD2 ARG 112 HD2 ARG 112 -8.999 -10.592 1.494 899 HD3 ARG 112 HD3 ARG 112 -8.375 -10.300 3.127 900 HE ARG 112 HE ARG 112 -10.061 -12.404 3.553 901 HH11 ARG 112 HH11 ARG 112 -7.486 -12.023 1.075 902 HH12 ARG 112 HH12 ARG 112 -7.125 -13.702 1.066 903 HH21 ARG 112 HH21 ARG 112 -9.735 -14.552 3.360 904 HH22 ARG 112 HH22 ARG 112 -8.553 -15.225 2.267 905 H TYR 113 H TYR 113 -12.328 -8.134 6.398 906 HA TYR 113 HA TYR 113 -12.141 -9.688 8.860 907 HB2 TYR 113 HB2 TYR 113 -12.171 -6.685 8.522 908 HB3 TYR 113 HB3 TYR 113 -11.532 -7.616 9.869 909 HD1 TYR 113 HD1 TYR 113 -10.560 -5.696 7.161 910 HD2 TYR 113 HD2 TYR 113 -9.700 -9.523 8.961 911 HE1 TYR 113 HE1 TYR 113 -8.385 -5.765 5.963 912 HE2 TYR 113 HE2 TYR 113 -7.557 -9.627 7.740 913 HH TYR 113 HH TYR 113 -6.888 -7.587 5.129 914 H GLY 114 H GLY 114 -14.788 -9.444 7.197 915 HA2 GLY 114 HA2 GLY 114 -16.509 -8.923 9.514 916 HA3 GLY 114 HA3 GLY 114 -16.809 -7.988 8.040 917 H ASN 115 H ASN 115 -18.887 -9.317 8.471 918 HA ASN 115 HA ASN 115 -18.890 -11.683 6.673 919 HB2 ASN 115 HB2 ASN 115 -19.884 -11.656 9.547 920 HB3 ASN 115 HB3 ASN 115 -20.626 -12.689 8.329 921 HD21 ASN 115 HD21 ASN 115 -19.513 -14.566 7.584 922 HD22 ASN 115 HD22 ASN 115 -17.972 -15.035 8.240 923 H LYS 116 H LYS 116 -19.762 -10.216 5.120 924 HA LYS 116 HA LYS 116 -22.575 -9.773 5.241 925 HB2 LYS 116 HB2 LYS 116 -21.527 -7.809 6.560 926 HB3 LYS 116 HB3 LYS 116 -20.646 -7.423 5.080 927 HG2 LYS 116 HG2 LYS 116 -22.432 -5.941 5.180 928 HG3 LYS 116 HG3 LYS 116 -22.833 -7.137 3.937 929 HD2 LYS 116 HD2 LYS 116 -24.409 -8.243 5.454 930 HD3 LYS 116 HD3 LYS 116 -23.868 -7.247 6.805 931 HE2 LYS 116 HE2 LYS 116 -26.022 -6.459 5.929 932 HE3 LYS 116 HE3 LYS 116 -24.762 -5.226 5.782 933 HZ1 LYS 116 HZ1 LYS 116 -26.144 -5.406 3.810 934 HZ2 LYS 116 HZ2 LYS 116 -24.581 -5.764 3.437 935 HZ3 LYS 116 HZ3 LYS 116 -25.734 -6.962 3.604 936 H LYS 117 H LYS 117 -23.253 -9.305 3.077 937 HA LYS 117 HA LYS 117 -21.269 -8.974 0.905 938 HB2 LYS 117 HB2 LYS 117 -21.464 -11.426 1.149 939 HB3 LYS 117 HB3 LYS 117 -23.217 -11.339 0.996 940 HG2 LYS 117 HG2 LYS 117 -23.021 -10.591 -1.321 941 HG3 LYS 117 HG3 LYS 117 -21.273 -10.421 -1.162 942 HD2 LYS 117 HD2 LYS 117 -21.124 -12.896 -0.813 943 HD3 LYS 117 HD3 LYS 117 -22.875 -13.014 -1.099 944 HE2 LYS 117 HE2 LYS 117 -22.610 -12.064 -3.344 945 HE3 LYS 117 HE3 LYS 117 -20.882 -11.780 -3.062 946 HZ1 LYS 117 HZ1 LYS 117 -20.530 -14.145 -2.980 947 HZ2 LYS 117 HZ2 LYS 117 -22.150 -14.447 -3.136 948 HZ3 LYS 117 HZ3 LYS 117 -21.329 -13.776 -4.368 949 H SER 118 H SER 118 -22.204 -8.156 -1.018 950 HA SER 118 HA SER 118 -25.027 -7.907 -1.403 951 HB2 SER 118 HB2 SER 118 -24.518 -5.970 0.215 952 HB3 SER 118 HB3 SER 118 -23.460 -5.310 -1.041 953 HG SER 118 HG SER 118 -26.229 -5.984 -1.306 954 H GLN 119 H GLN 119 -24.743 -8.817 -3.470 955 HA GLN 119 HA GLN 119 -23.126 -7.265 -5.338 956 HB2 GLN 119 HB2 GLN 119 -21.618 -9.016 -4.266 957 HB3 GLN 119 HB3 GLN 119 -22.637 -10.257 -5.018 958 HG2 GLN 119 HG2 GLN 119 -22.158 -9.243 -7.250 959 HG3 GLN 119 HG3 GLN 119 -21.145 -8.019 -6.467 960 HE21 GLN 119 HE21 GLN 119 -20.273 -9.968 -8.502 961 HE22 GLN 119 HE22 GLN 119 -19.036 -10.928 -7.729 962 H ASP 120 H ASP 120 -24.373 -6.980 -7.066 963 HA ASP 120 HA ASP 120 -26.097 -9.110 -8.117 964 HB2 ASP 120 HB2 ASP 120 -28.065 -7.971 -8.018 965 HB3 ASP 120 HB3 ASP 120 -27.351 -7.414 -6.514 966 H LEU 121 H LEU 121 -26.590 -8.761 -10.327 967 HA LEU 121 HA LEU 121 -25.462 -6.505 -11.682 968 HB2 LEU 121 HB2 LEU 121 -24.572 -9.382 -12.361 969 HB3 LEU 121 HB3 LEU 121 -24.334 -7.988 -13.392 970 HG LEU 121 HG LEU 121 -23.044 -7.022 -11.246 971 HD11 LEU 121 HD11 LEU 121 -23.419 -9.088 -9.838 972 HD12 LEU 121 HD12 LEU 121 -22.556 -10.036 -11.053 973 HD13 LEU 121 HD13 LEU 121 -21.712 -8.763 -10.142 974 HD21 LEU 121 HD21 LEU 121 -20.952 -7.778 -12.250 975 HD22 LEU 121 HD22 LEU 121 -21.824 -8.999 -13.193 976 HD23 LEU 121 HD23 LEU 121 -22.109 -7.281 -13.504 977 H LYS 122 H LYS 122 -26.301 -6.579 -14.016 978 HA LYS 122 HA LYS 122 -29.025 -7.701 -14.005 979 HB2 LYS 122 HB2 LYS 122 -28.513 -5.362 -14.760 980 HB3 LYS 122 HB3 LYS 122 -27.648 -6.049 -16.140 981 HG2 LYS 122 HG2 LYS 122 -29.943 -7.346 -16.547 982 HG3 LYS 122 HG3 LYS 122 -30.604 -6.163 -15.431 983 HD2 LYS 122 HD2 LYS 122 -30.986 -5.309 -17.633 984 HD3 LYS 122 HD3 LYS 122 -29.684 -4.345 -16.938 985 HE2 LYS 122 HE2 LYS 122 -29.080 -4.839 -19.203 986 HE3 LYS 122 HE3 LYS 122 -28.017 -5.800 -18.168 987 HZ1 LYS 122 HZ1 LYS 122 -30.429 -6.778 -19.573 988 HZ2 LYS 122 HZ2 LYS 122 -28.901 -7.052 -20.039 989 HZ3 LYS 122 HZ3 LYS 122 -29.449 -7.738 -18.647 Start of MODEL 17 1 H1 GLY 1 H GLY 1 26.440 1.777 11.177 2 HA2 GLY 1 HA2 GLY 1 24.662 -0.187 12.501 3 HA3 GLY 1 HA3 GLY 1 24.178 0.780 11.089 4 H SER 2 H SER 2 25.802 -2.054 12.164 5 HA SER 2 HA SER 2 27.490 -2.508 9.902 6 HB2 SER 2 HB2 SER 2 27.786 -3.540 12.120 7 HB3 SER 2 HB3 SER 2 26.255 -4.402 11.944 8 HG SER 2 HG SER 2 28.341 -4.750 10.055 9 H ASN 3 H ASN 3 24.050 -2.969 10.498 10 HA ASN 3 HA ASN 3 22.360 -3.954 9.351 11 HB2 ASN 3 HB2 ASN 3 23.682 -2.429 7.073 12 HB3 ASN 3 HB3 ASN 3 22.015 -3.003 7.121 13 HD21 ASN 3 HD21 ASN 3 20.899 -2.244 9.481 14 HD22 ASN 3 HD22 ASN 3 21.215 -0.574 9.842 15 H GLN 4 H GLN 4 23.750 -6.013 9.748 16 HA GLN 4 HA GLN 4 24.392 -7.424 7.192 17 HB2 GLN 4 HB2 GLN 4 25.185 -7.778 10.110 18 HB3 GLN 4 HB3 GLN 4 25.397 -9.071 8.948 19 HG2 GLN 4 HG2 GLN 4 26.582 -6.335 8.401 20 HG3 GLN 4 HG3 GLN 4 27.386 -7.458 9.472 21 HE21 GLN 4 HE21 GLN 4 27.330 -6.457 6.315 22 HE22 GLN 4 HE22 GLN 4 27.999 -7.824 5.520 23 H GLN 5 H GLN 5 23.723 -9.810 7.327 24 HA GLN 5 HA GLN 5 22.059 -11.291 7.209 25 HB2 GLN 5 HB2 GLN 5 21.628 -10.577 10.103 26 HB3 GLN 5 HB3 GLN 5 21.106 -12.043 9.254 27 HG2 GLN 5 HG2 GLN 5 23.476 -12.641 8.820 28 HG3 GLN 5 HG3 GLN 5 24.011 -11.179 9.676 29 HE21 GLN 5 HE21 GLN 5 25.256 -12.915 10.921 30 HE22 GLN 5 HE22 GLN 5 24.445 -13.592 12.317 31 H LEU 6 H LEU 6 20.980 -9.930 5.766 32 HA LEU 6 HA LEU 6 18.415 -8.784 6.616 33 HB2 LEU 6 HB2 LEU 6 20.209 -8.152 4.246 34 HB3 LEU 6 HB3 LEU 6 18.669 -7.368 4.586 35 HG LEU 6 HG LEU 6 21.209 -7.173 6.274 36 HD11 LEU 6 HD11 LEU 6 19.719 -5.140 4.555 37 HD12 LEU 6 HD12 LEU 6 21.141 -4.811 5.562 38 HD13 LEU 6 HD13 LEU 6 21.276 -5.899 4.172 39 HD21 LEU 6 HD21 LEU 6 19.899 -5.412 7.526 40 HD22 LEU 6 HD22 LEU 6 18.451 -5.985 6.650 41 HD23 LEU 6 HD23 LEU 6 19.312 -7.059 7.790 42 H ASN 7 H ASN 7 17.144 -8.704 4.790 43 HA ASN 7 HA ASN 7 15.536 -9.459 3.401 44 HB2 ASN 7 HB2 ASN 7 17.493 -9.989 1.854 45 HB3 ASN 7 HB3 ASN 7 17.297 -11.679 2.342 46 HD21 ASN 7 HD21 ASN 7 16.826 -11.715 -0.281 47 HD22 ASN 7 HD22 ASN 7 15.124 -11.478 -0.628 48 H ALA 8 H ALA 8 13.887 -11.213 3.161 49 HA ALA 8 HA ALA 8 14.005 -13.239 5.346 50 HB1 ALA 8 HB1 ALA 8 12.845 -11.310 6.281 51 HB2 ALA 8 HB2 ALA 8 11.800 -11.191 4.848 52 HB3 ALA 8 HB3 ALA 8 11.651 -12.575 5.938 53 H THR 9 H THR 9 12.504 -14.945 5.143 54 HA THR 9 HA THR 9 11.414 -15.464 2.408 55 HB THR 9 HB THR 9 11.996 -17.895 3.075 56 HG1 THR 9 HG1 THR 9 14.051 -17.696 4.432 57 HG21 THR 9 HG21 THR 9 13.166 -16.571 1.330 58 HG22 THR 9 HG22 THR 9 14.278 -15.961 2.576 59 HG23 THR 9 HG23 THR 9 14.230 -17.685 2.178 60 H LYS 10 H LYS 10 10.948 -15.842 5.937 61 HA LYS 10 HA LYS 10 8.631 -17.526 5.753 62 HB2 LYS 10 HB2 LYS 10 9.945 -17.261 7.767 63 HB3 LYS 10 HB3 LYS 10 9.555 -15.547 7.889 64 HG2 LYS 10 HG2 LYS 10 7.263 -17.484 7.852 65 HG3 LYS 10 HG3 LYS 10 8.303 -17.508 9.275 66 HD2 LYS 10 HD2 LYS 10 7.954 -15.113 9.628 67 HD3 LYS 10 HD3 LYS 10 6.882 -15.015 8.238 68 HE2 LYS 10 HE2 LYS 10 6.383 -16.818 10.647 69 HE3 LYS 10 HE3 LYS 10 5.776 -15.166 10.533 70 HZ1 LYS 10 HZ1 LYS 10 4.496 -15.794 8.587 71 HZ2 LYS 10 HZ2 LYS 10 5.076 -17.336 8.660 72 HZ3 LYS 10 HZ3 LYS 10 4.126 -16.768 9.854 73 H LYS 11 H LYS 11 9.113 -14.154 5.058 74 HA LYS 11 HA LYS 11 6.245 -13.854 4.460 75 HB2 LYS 11 HB2 LYS 11 6.180 -11.701 5.605 76 HB3 LYS 11 HB3 LYS 11 6.433 -13.030 6.707 77 HG2 LYS 11 HG2 LYS 11 8.932 -12.446 6.741 78 HG3 LYS 11 HG3 LYS 11 8.515 -10.977 5.871 79 HD2 LYS 11 HD2 LYS 11 8.625 -10.304 8.105 80 HD3 LYS 11 HD3 LYS 11 6.907 -10.431 7.778 81 HE2 LYS 11 HE2 LYS 11 6.758 -11.695 9.631 82 HE3 LYS 11 HE3 LYS 11 7.509 -12.986 8.691 83 HZ1 LYS 11 HZ1 LYS 11 9.664 -12.183 9.487 84 HZ2 LYS 11 HZ2 LYS 11 8.919 -11.057 10.444 85 HZ3 LYS 11 HZ3 LYS 11 8.739 -12.680 10.711 86 H ASP 12 H ASP 12 7.279 -14.303 2.275 87 HA ASP 12 HA ASP 12 9.136 -12.496 1.148 88 HB2 ASP 12 HB2 ASP 12 8.411 -14.773 0.287 89 HB3 ASP 12 HB3 ASP 12 6.944 -14.015 -0.317 90 H LYS 13 H LYS 13 5.620 -12.364 1.480 91 HA LYS 13 HA LYS 13 5.315 -10.018 -0.207 92 HB2 LYS 13 HB2 LYS 13 3.425 -11.249 1.818 93 HB3 LYS 13 HB3 LYS 13 3.010 -9.994 0.627 94 HG2 LYS 13 HG2 LYS 13 3.938 -11.627 -1.168 95 HG3 LYS 13 HG3 LYS 13 3.888 -12.860 0.083 96 HD2 LYS 13 HD2 LYS 13 1.574 -11.224 -1.074 97 HD3 LYS 13 HD3 LYS 13 1.851 -12.952 -1.295 98 HE2 LYS 13 HE2 LYS 13 1.507 -13.285 1.179 99 HE3 LYS 13 HE3 LYS 13 1.150 -11.552 1.309 100 HZ1 LYS 13 HZ1 LYS 13 -0.877 -12.511 1.139 101 HZ2 LYS 13 HZ2 LYS 13 -0.631 -12.025 -0.405 102 HZ3 LYS 13 HZ3 LYS 13 -0.461 -13.621 -0.011 103 H LEU 14 H LEU 14 5.512 -10.485 3.381 104 HA LEU 14 HA LEU 14 5.081 -7.618 3.762 105 HB2 LEU 14 HB2 LEU 14 6.318 -9.609 5.670 106 HB3 LEU 14 HB3 LEU 14 5.880 -7.971 6.076 107 HG LEU 14 HG LEU 14 3.803 -9.938 5.019 108 HD11 LEU 14 HD11 LEU 14 3.097 -10.181 7.426 109 HD12 LEU 14 HD12 LEU 14 4.624 -10.964 7.039 110 HD13 LEU 14 HD13 LEU 14 4.626 -9.407 7.898 111 HD21 LEU 14 HD21 LEU 14 2.220 -8.370 6.112 112 HD22 LEU 14 HD22 LEU 14 3.578 -7.342 6.615 113 HD23 LEU 14 HD23 LEU 14 3.194 -7.545 4.893 114 H GLN 15 H GLN 15 7.883 -9.691 3.163 115 HA GLN 15 HA GLN 15 9.961 -7.962 3.857 116 HB2 GLN 15 HB2 GLN 15 10.288 -10.275 3.366 117 HB3 GLN 15 HB3 GLN 15 9.684 -10.124 1.731 118 HG2 GLN 15 HG2 GLN 15 12.207 -8.691 2.594 119 HG3 GLN 15 HG3 GLN 15 12.180 -10.405 2.170 120 HE21 GLN 15 HE21 GLN 15 11.930 -7.118 0.825 121 HE22 GLN 15 HE22 GLN 15 11.979 -7.678 -0.847 122 H VAL 16 H VAL 16 8.193 -8.189 0.683 123 HA VAL 16 HA VAL 16 9.817 -6.142 -0.501 124 HB VAL 16 HB VAL 16 8.060 -6.024 -2.231 125 HG11 VAL 16 HG11 VAL 16 8.408 -8.271 -3.099 126 HG12 VAL 16 HG12 VAL 16 9.884 -7.690 -2.292 127 HG13 VAL 16 HG13 VAL 16 8.846 -8.869 -1.488 128 HG21 VAL 16 HG21 VAL 16 6.045 -6.555 -0.870 129 HG22 VAL 16 HG22 VAL 16 6.213 -7.580 -2.307 130 HG23 VAL 16 HG23 VAL 16 6.639 -8.231 -0.733 131 H ILE 17 H ILE 17 6.803 -5.970 1.386 132 HA ILE 17 HA ILE 17 6.490 -3.161 0.840 133 HB ILE 17 HB ILE 17 5.199 -4.604 3.148 134 HG12 ILE 17 HG12 ILE 17 4.061 -4.354 0.312 135 HG13 ILE 17 HG13 ILE 17 4.757 -5.822 0.967 136 HG21 ILE 17 HG21 ILE 17 5.035 -2.152 3.123 137 HG22 ILE 17 HG22 ILE 17 4.426 -2.172 1.454 138 HG23 ILE 17 HG23 ILE 17 3.457 -2.847 2.778 139 HD11 ILE 17 HD11 ILE 17 3.064 -5.541 2.932 140 HD12 ILE 17 HD12 ILE 17 2.177 -4.509 1.768 141 HD13 ILE 17 HD13 ILE 17 2.540 -6.207 1.397 142 H ASP 18 H ASP 18 7.959 -5.006 3.509 143 HA ASP 18 HA ASP 18 8.503 -2.743 5.180 144 HB2 ASP 18 HB2 ASP 18 8.478 -5.197 5.800 145 HB3 ASP 18 HB3 ASP 18 10.061 -5.343 5.034 146 H TRP 19 H TRP 19 10.132 -4.166 2.412 147 HA TRP 19 HA TRP 19 12.635 -2.752 2.614 148 HB2 TRP 19 HB2 TRP 19 12.579 -4.782 1.348 149 HB3 TRP 19 HB3 TRP 19 11.196 -4.261 0.395 150 HD1 TRP 19 HD1 TRP 19 11.604 -2.702 -1.682 151 HE1 TRP 19 HE1 TRP 19 13.655 -1.745 -2.857 152 HE3 TRP 19 HE3 TRP 19 15.200 -4.148 1.681 153 HZ2 TRP 19 HZ2 TRP 19 16.509 -1.603 -2.393 154 HZ3 TRP 19 HZ3 TRP 19 17.550 -3.510 1.323 155 HH2 TRP 19 HH2 TRP 19 18.204 -2.157 -0.673 156 H LEU 20 H LEU 20 9.706 -2.255 0.447 157 HA LEU 20 HA LEU 20 10.747 0.153 -0.621 158 HB2 LEU 20 HB2 LEU 20 8.573 0.589 -1.521 159 HB3 LEU 20 HB3 LEU 20 9.025 -1.090 -1.746 160 HG LEU 20 HG LEU 20 7.571 -1.322 0.501 161 HD11 LEU 20 HD11 LEU 20 6.969 1.076 0.633 162 HD12 LEU 20 HD12 LEU 20 6.207 0.959 -0.959 163 HD13 LEU 20 HD13 LEU 20 5.547 0.048 0.416 164 HD21 LEU 20 HD21 LEU 20 5.673 -2.083 -0.794 165 HD22 LEU 20 HD22 LEU 20 6.250 -1.252 -2.228 166 HD23 LEU 20 HD23 LEU 20 7.173 -2.605 -1.559 167 H ILE 21 H ILE 21 8.972 -0.408 2.400 168 HA ILE 21 HA ILE 21 8.418 2.380 2.939 169 HB ILE 21 HB ILE 21 8.540 -0.101 4.669 170 HG12 ILE 21 HG12 ILE 21 6.145 1.647 3.903 171 HG13 ILE 21 HG13 ILE 21 6.640 0.266 2.961 172 HG21 ILE 21 HG21 ILE 21 7.355 1.563 6.368 173 HG22 ILE 21 HG22 ILE 21 9.119 1.528 6.228 174 HG23 ILE 21 HG23 ILE 21 8.216 2.805 5.454 175 HD11 ILE 21 HD11 ILE 21 5.700 0.262 5.835 176 HD12 ILE 21 HD12 ILE 21 4.847 -0.346 4.433 177 HD13 ILE 21 HD13 ILE 21 6.322 -1.182 5.002 178 H GLU 22 H GLU 22 11.134 0.152 4.012 179 HA GLU 22 HA GLU 22 12.396 2.243 5.486 180 HB2 GLU 22 HB2 GLU 22 12.850 -0.316 5.627 181 HB3 GLU 22 HB3 GLU 22 13.959 -0.059 4.276 182 HG2 GLU 22 HG2 GLU 22 15.151 1.692 5.633 183 HG3 GLU 22 HG3 GLU 22 14.011 1.426 6.955 184 H ASN 23 H ASN 23 12.664 1.299 2.081 185 HA ASN 23 HA ASN 23 14.986 2.963 1.581 186 HB2 ASN 23 HB2 ASN 23 13.038 1.538 -0.247 187 HB3 ASN 23 HB3 ASN 23 14.223 2.687 -0.870 188 HD21 ASN 23 HD21 ASN 23 13.943 -0.354 0.990 189 HD22 ASN 23 HD22 ASN 23 15.564 -0.894 0.571 190 H PHE 24 H PHE 24 11.473 3.630 1.438 191 HA PHE 24 HA PHE 24 12.175 6.431 0.659 192 HB2 PHE 24 HB2 PHE 24 9.821 4.727 -0.135 193 HB3 PHE 24 HB3 PHE 24 9.741 6.479 -0.134 194 HD1 PHE 24 HD1 PHE 24 12.190 7.536 -1.227 195 HD2 PHE 24 HD2 PHE 24 9.907 4.061 -2.387 196 HE1 PHE 24 HE1 PHE 24 12.784 7.916 -3.564 197 HE2 PHE 24 HE2 PHE 24 10.530 4.477 -4.750 198 HZ PHE 24 HZ PHE 24 11.839 6.470 -5.345 199 HA PRO 25 HA PRO 25 10.311 6.592 4.861 200 HB2 PRO 25 HB2 PRO 25 12.242 8.025 6.153 201 HB3 PRO 25 HB3 PRO 25 12.441 6.290 5.795 202 HG2 PRO 25 HG2 PRO 25 13.473 8.645 4.177 203 HG3 PRO 25 HG3 PRO 25 14.383 7.224 4.796 204 HD2 PRO 25 HD2 PRO 25 13.376 7.299 2.269 205 HD3 PRO 25 HD3 PRO 25 13.416 5.787 3.221 206 H ASN 26 H ASN 26 10.033 8.457 2.284 207 HA ASN 26 HA ASN 26 9.986 11.117 3.415 208 HB2 ASN 26 HB2 ASN 26 8.830 10.097 0.813 209 HB3 ASN 26 HB3 ASN 26 8.890 11.776 1.339 210 HD21 ASN 26 HD21 ASN 26 10.860 9.078 0.483 211 HD22 ASN 26 HD22 ASN 26 12.423 9.839 0.273 212 H ALA 27 H ALA 27 7.837 8.428 3.158 213 HA ALA 27 HA ALA 27 5.801 9.320 4.952 214 HB1 ALA 27 HB1 ALA 27 5.033 10.732 3.072 215 HB2 ALA 27 HB2 ALA 27 5.351 9.433 1.902 216 HB3 ALA 27 HB3 ALA 27 4.009 9.277 3.069 217 H PHE 28 H PHE 28 5.515 7.187 5.818 218 HA PHE 28 HA PHE 28 4.219 5.219 4.400 219 HB2 PHE 28 HB2 PHE 28 7.170 4.981 4.173 220 HB3 PHE 28 HB3 PHE 28 6.372 3.547 4.730 221 HD1 PHE 28 HD1 PHE 28 3.788 3.472 3.215 222 HD2 PHE 28 HD2 PHE 28 7.782 4.506 1.922 223 HE1 PHE 28 HE1 PHE 28 3.168 2.986 0.879 224 HE2 PHE 28 HE2 PHE 28 7.155 3.995 -0.400 225 HZ PHE 28 HZ PHE 28 4.839 3.247 -0.942 226 H PHE 29 H PHE 29 4.164 3.041 5.772 227 HA PHE 29 HA PHE 29 4.799 3.434 8.589 228 HB2 PHE 29 HB2 PHE 29 1.959 3.401 7.506 229 HB3 PHE 29 HB3 PHE 29 2.325 2.992 9.171 230 HD1 PHE 29 HD1 PHE 29 1.821 5.716 6.814 231 HD2 PHE 29 HD2 PHE 29 3.443 4.691 10.638 232 HE1 PHE 29 HE1 PHE 29 1.777 8.101 7.451 233 HE2 PHE 29 HE2 PHE 29 3.216 7.075 11.378 234 HZ PHE 29 HZ PHE 29 2.405 8.787 9.772 235 H LYS 30 H LYS 30 4.756 1.495 9.715 236 HA LYS 30 HA LYS 30 4.039 -1.000 8.176 237 HB2 LYS 30 HB2 LYS 30 5.944 -0.688 10.524 238 HB3 LYS 30 HB3 LYS 30 5.517 -2.206 9.741 239 HG2 LYS 30 HG2 LYS 30 7.300 -1.964 8.436 240 HG3 LYS 30 HG3 LYS 30 6.403 -0.718 7.602 241 HD2 LYS 30 HD2 LYS 30 8.224 0.521 8.104 242 HD3 LYS 30 HD3 LYS 30 7.369 0.819 9.618 243 HE2 LYS 30 HE2 LYS 30 9.304 -1.512 9.194 244 HE3 LYS 30 HE3 LYS 30 9.898 0.092 9.595 245 HZ1 LYS 30 HZ1 LYS 30 8.855 0.077 11.623 246 HZ2 LYS 30 HZ2 LYS 30 7.975 -1.304 11.340 247 HZ3 LYS 30 HZ3 LYS 30 9.596 -1.365 11.528 248 H LYS 31 H LYS 31 3.418 0.798 11.065 249 HA LYS 31 HA LYS 31 2.281 -1.259 12.685 250 HB2 LYS 31 HB2 LYS 31 2.019 1.746 12.702 251 HB3 LYS 31 HB3 LYS 31 1.313 0.722 13.945 252 HG2 LYS 31 HG2 LYS 31 3.234 1.589 14.856 253 HG3 LYS 31 HG3 LYS 31 3.599 -0.106 14.534 254 HD2 LYS 31 HD2 LYS 31 5.151 0.419 12.856 255 HD3 LYS 31 HD3 LYS 31 4.371 1.979 12.482 256 HE2 LYS 31 HE2 LYS 31 5.161 2.975 14.531 257 HE3 LYS 31 HE3 LYS 31 5.839 1.436 15.081 258 HZ1 LYS 31 HZ1 LYS 31 6.765 2.706 12.587 259 HZ2 LYS 31 HZ2 LYS 31 7.443 3.061 14.052 260 HZ3 LYS 31 HZ3 LYS 31 7.498 1.543 13.492 261 H GLY 32 H GLY 32 0.841 -0.422 9.765 262 HA2 GLY 32 HA2 GLY 32 -1.218 -0.786 8.956 263 HA3 GLY 32 HA3 GLY 32 -1.606 -1.620 10.446 264 H ASN 33 H ASN 33 -2.192 -0.168 12.228 265 HA ASN 33 HA ASN 33 -4.527 1.302 11.819 266 HB2 ASN 33 HB2 ASN 33 -4.670 1.558 14.105 267 HB3 ASN 33 HB3 ASN 33 -3.721 0.083 13.938 268 HD21 ASN 33 HD21 ASN 33 -1.168 1.035 13.434 269 HD22 ASN 33 HD22 ASN 33 -0.626 1.732 14.952 270 H GLN 34 H GLN 34 -1.432 2.529 11.409 271 HA GLN 34 HA GLN 34 -2.395 5.323 11.684 272 HB2 GLN 34 HB2 GLN 34 0.021 5.972 12.037 273 HB3 GLN 34 HB3 GLN 34 -0.827 5.193 13.378 274 HG2 GLN 34 HG2 GLN 34 0.285 3.077 12.896 275 HG3 GLN 34 HG3 GLN 34 1.054 3.764 11.461 276 HE21 GLN 34 HE21 GLN 34 0.726 5.011 14.924 277 HE22 GLN 34 HE22 GLN 34 2.460 5.210 15.104 278 H VAL 35 H VAL 35 -1.893 2.971 9.476 279 HA VAL 35 HA VAL 35 -0.167 4.287 7.576 280 HB VAL 35 HB VAL 35 -1.267 3.162 5.735 281 HG11 VAL 35 HG11 VAL 35 -0.928 0.797 6.523 282 HG12 VAL 35 HG12 VAL 35 0.409 1.925 6.753 283 HG13 VAL 35 HG13 VAL 35 -0.596 1.468 8.132 284 HG21 VAL 35 HG21 VAL 35 -3.447 2.364 7.680 285 HG22 VAL 35 HG22 VAL 35 -3.576 3.224 6.164 286 HG23 VAL 35 HG23 VAL 35 -3.118 1.514 6.154 287 H LYS 36 H LYS 36 -0.372 5.816 5.947 288 HA LYS 36 HA LYS 36 -2.860 7.475 5.969 289 HB2 LYS 36 HB2 LYS 36 0.059 8.262 5.603 290 HB3 LYS 36 HB3 LYS 36 -1.292 9.333 5.235 291 HG2 LYS 36 HG2 LYS 36 -2.109 9.150 7.588 292 HG3 LYS 36 HG3 LYS 36 -0.765 8.073 7.956 293 HD2 LYS 36 HD2 LYS 36 0.045 10.055 8.752 294 HD3 LYS 36 HD3 LYS 36 0.767 10.021 7.143 295 HE2 LYS 36 HE2 LYS 36 -1.278 11.431 6.403 296 HE3 LYS 36 HE3 LYS 36 -1.586 11.674 8.131 297 HZ1 LYS 36 HZ1 LYS 36 0.865 12.378 6.642 298 HZ2 LYS 36 HZ2 LYS 36 -0.239 13.443 7.205 299 HZ3 LYS 36 HZ3 LYS 36 0.708 12.589 8.272 300 HA PRO 37 HA PRO 37 -3.093 6.308 1.753 301 HB2 PRO 37 HB2 PRO 37 -4.534 8.204 0.530 302 HB3 PRO 37 HB3 PRO 37 -5.201 7.280 1.899 303 HG2 PRO 37 HG2 PRO 37 -3.943 10.046 2.005 304 HG3 PRO 37 HG3 PRO 37 -5.494 9.489 2.711 305 HD2 PRO 37 HD2 PRO 37 -3.140 9.601 4.131 306 HD3 PRO 37 HD3 PRO 37 -4.433 8.418 4.480 307 H LEU 38 H LEU 38 -1.889 6.256 -0.046 308 HA LEU 38 HA LEU 38 0.184 8.375 -0.411 309 HB2 LEU 38 HB2 LEU 38 0.001 5.476 -1.337 310 HB3 LEU 38 HB3 LEU 38 1.171 6.624 -1.935 311 HG LEU 38 HG LEU 38 2.324 5.314 -0.410 312 HD11 LEU 38 HD11 LEU 38 2.777 7.780 -0.197 313 HD12 LEU 38 HD12 LEU 38 1.690 7.813 1.208 314 HD13 LEU 38 HD13 LEU 38 3.178 6.839 1.242 315 HD21 LEU 38 HD21 LEU 38 0.477 4.306 0.774 316 HD22 LEU 38 HD22 LEU 38 1.729 4.874 1.880 317 HD23 LEU 38 HD23 LEU 38 0.225 5.807 1.690 318 H LYS 39 H LYS 39 0.779 8.810 -2.687 319 HA LYS 39 HA LYS 39 -1.363 9.847 -4.167 320 HB2 LYS 39 HB2 LYS 39 0.986 10.619 -4.315 321 HB3 LYS 39 HB3 LYS 39 1.459 9.108 -5.071 322 HG2 LYS 39 HG2 LYS 39 -0.734 10.369 -6.580 323 HG3 LYS 39 HG3 LYS 39 0.496 11.520 -6.304 324 HD2 LYS 39 HD2 LYS 39 1.439 8.847 -7.334 325 HD3 LYS 39 HD3 LYS 39 0.512 9.896 -8.426 326 HE2 LYS 39 HE2 LYS 39 1.999 11.807 -7.828 327 HE3 LYS 39 HE3 LYS 39 2.945 10.700 -6.828 328 HZ1 LYS 39 HZ1 LYS 39 3.535 9.507 -8.880 329 HZ2 LYS 39 HZ2 LYS 39 2.579 10.541 -9.749 330 HZ3 LYS 39 HZ3 LYS 39 3.926 11.100 -8.976 331 H ILE 40 H ILE 40 -2.237 9.274 -6.169 332 HA ILE 40 HA ILE 40 -3.140 6.642 -6.433 333 HB ILE 40 HB ILE 40 -4.416 8.479 -7.340 334 HG12 ILE 40 HG12 ILE 40 -4.701 7.871 -9.741 335 HG13 ILE 40 HG13 ILE 40 -3.251 6.891 -9.681 336 HG21 ILE 40 HG21 ILE 40 -3.360 9.780 -9.369 337 HG22 ILE 40 HG22 ILE 40 -2.907 10.231 -7.717 338 HG23 ILE 40 HG23 ILE 40 -1.827 9.253 -8.699 339 HD11 ILE 40 HD11 ILE 40 -5.830 6.491 -8.104 340 HD12 ILE 40 HD12 ILE 40 -5.216 5.469 -9.417 341 HD13 ILE 40 HD13 ILE 40 -4.380 5.492 -7.865 342 H GLY 41 H GLY 41 -2.360 4.972 -7.502 343 HA2 GLY 41 HA2 GLY 41 -0.873 3.577 -8.538 344 HA3 GLY 41 HA3 GLY 41 -0.661 4.884 -9.700 345 H ILE 42 H ILE 42 0.383 5.327 -6.325 346 HA ILE 42 HA ILE 42 2.906 6.209 -6.878 347 HB ILE 42 HB ILE 42 1.792 6.555 -4.778 348 HG12 ILE 42 HG12 ILE 42 4.317 5.029 -4.082 349 HG13 ILE 42 HG13 ILE 42 4.349 6.533 -4.991 350 HG21 ILE 42 HG21 ILE 42 1.713 4.738 -3.030 351 HG22 ILE 42 HG22 ILE 42 0.654 4.442 -4.408 352 HG23 ILE 42 HG23 ILE 42 2.208 3.575 -4.256 353 HD11 ILE 42 HD11 ILE 42 3.369 6.123 -2.167 354 HD12 ILE 42 HD12 ILE 42 4.683 7.143 -2.699 355 HD13 ILE 42 HD13 ILE 42 3.025 7.615 -3.089 356 H PHE 43 H PHE 43 1.908 2.805 -6.869 357 HA PHE 43 HA PHE 43 4.442 1.642 -6.350 358 HB2 PHE 43 HB2 PHE 43 2.743 0.130 -6.284 359 HB3 PHE 43 HB3 PHE 43 1.851 0.866 -7.612 360 HD1 PHE 43 HD1 PHE 43 1.951 0.042 -9.779 361 HD2 PHE 43 HD2 PHE 43 4.907 -1.157 -6.940 362 HE1 PHE 43 HE1 PHE 43 2.858 -1.603 -11.445 363 HE2 PHE 43 HE2 PHE 43 5.837 -2.815 -8.586 364 HZ PHE 43 HZ PHE 43 4.790 -3.033 -10.825 365 H ASP 44 H ASP 44 3.028 3.090 -9.240 366 HA ASP 44 HA ASP 44 5.094 2.060 -11.031 367 HB2 ASP 44 HB2 ASP 44 2.990 4.192 -11.376 368 HB3 ASP 44 HB3 ASP 44 4.328 4.039 -12.514 369 H ASP 45 H ASP 45 4.919 4.813 -8.854 370 HA ASP 45 HA ASP 45 7.143 6.296 -10.079 371 HB2 ASP 45 HB2 ASP 45 5.720 6.478 -7.375 372 HB3 ASP 45 HB3 ASP 45 7.023 7.516 -7.906 373 H LEU 46 H LEU 46 6.447 4.292 -7.275 374 HA LEU 46 HA LEU 46 8.999 4.198 -6.079 375 HB2 LEU 46 HB2 LEU 46 7.194 3.713 -4.712 376 HB3 LEU 46 HB3 LEU 46 6.411 2.701 -5.927 377 HG LEU 46 HG LEU 46 8.063 0.884 -5.544 378 HD11 LEU 46 HD11 LEU 46 9.869 2.340 -4.447 379 HD12 LEU 46 HD12 LEU 46 8.814 2.367 -3.016 380 HD13 LEU 46 HD13 LEU 46 9.478 0.836 -3.633 381 HD21 LEU 46 HD21 LEU 46 7.070 0.185 -3.460 382 HD22 LEU 46 HD22 LEU 46 6.406 1.814 -3.197 383 HD23 LEU 46 HD23 LEU 46 5.859 0.833 -4.582 384 H ILE 47 H ILE 47 7.457 1.990 -8.436 385 HA ILE 47 HA ILE 47 9.395 -0.055 -8.172 386 HB ILE 47 HB ILE 47 7.169 -0.208 -9.344 387 HG12 ILE 47 HG12 ILE 47 9.078 -1.912 -9.336 388 HG13 ILE 47 HG13 ILE 47 7.709 -2.117 -10.417 389 HG21 ILE 47 HG21 ILE 47 8.708 0.972 -11.716 390 HG22 ILE 47 HG22 ILE 47 7.093 0.202 -11.788 391 HG23 ILE 47 HG23 ILE 47 7.342 1.682 -10.855 392 HD11 ILE 47 HD11 ILE 47 10.049 -2.556 -11.339 393 HD12 ILE 47 HD12 ILE 47 8.952 -1.562 -12.331 394 HD13 ILE 47 HD13 ILE 47 10.263 -0.823 -11.422 395 H ASP 48 H ASP 48 9.449 3.007 -9.932 396 HA ASP 48 HA ASP 48 11.568 2.529 -11.644 397 HB2 ASP 48 HB2 ASP 48 9.938 4.616 -11.156 398 HB3 ASP 48 HB3 ASP 48 11.352 5.221 -10.303 399 H PHE 49 H PHE 49 11.494 3.208 -8.183 400 HA PHE 49 HA PHE 49 14.370 3.632 -7.866 401 HB2 PHE 49 HB2 PHE 49 12.329 4.388 -6.312 402 HB3 PHE 49 HB3 PHE 49 12.592 2.823 -5.588 403 HD1 PHE 49 HD1 PHE 49 13.846 6.242 -5.990 404 HD2 PHE 49 HD2 PHE 49 14.946 2.289 -4.622 405 HE1 PHE 49 HE1 PHE 49 15.708 7.202 -4.702 406 HE2 PHE 49 HE2 PHE 49 16.832 3.262 -3.366 407 HZ PHE 49 HZ PHE 49 17.194 5.739 -3.383 408 H TYR 50 H TYR 50 12.143 0.874 -7.688 409 HA TYR 50 HA TYR 50 13.948 -1.014 -6.419 410 HB2 TYR 50 HB2 TYR 50 11.824 -1.812 -6.338 411 HB3 TYR 50 HB3 TYR 50 11.347 -1.130 -7.865 412 HD1 TYR 50 HD1 TYR 50 12.621 -4.151 -6.228 413 HD2 TYR 50 HD2 TYR 50 12.018 -2.226 -10.041 414 HE1 TYR 50 HE1 TYR 50 12.391 -6.352 -7.305 415 HE2 TYR 50 HE2 TYR 50 11.953 -4.458 -11.147 416 HH TYR 50 HH TYR 50 12.101 -7.503 -9.240 417 H GLU 51 H GLU 51 13.650 0.267 -9.716 418 HA GLU 51 HA GLU 51 15.305 -1.777 -10.916 419 HB2 GLU 51 HB2 GLU 51 14.561 1.045 -11.771 420 HB3 GLU 51 HB3 GLU 51 15.424 -0.122 -12.781 421 HG2 GLU 51 HG2 GLU 51 13.322 -1.676 -12.209 422 HG3 GLU 51 HG3 GLU 51 12.546 -0.125 -11.874 423 H ARG 52 H ARG 52 16.145 0.686 -8.653 424 HA ARG 52 HA ARG 52 18.782 1.279 -9.814 425 HB2 ARG 52 HB2 ARG 52 17.768 1.651 -6.958 426 HB3 ARG 52 HB3 ARG 52 19.258 2.311 -7.606 427 HG2 ARG 52 HG2 ARG 52 16.476 3.023 -8.616 428 HG3 ARG 52 HG3 ARG 52 17.366 3.959 -7.422 429 HD2 ARG 52 HD2 ARG 52 19.001 4.659 -8.993 430 HD3 ARG 52 HD3 ARG 52 18.550 3.416 -10.169 431 HE ARG 52 HE ARG 52 17.039 5.870 -9.477 432 HH11 ARG 52 HH11 ARG 52 17.421 3.159 -11.783 433 HH12 ARG 52 HH12 ARG 52 15.812 3.334 -12.420 434 HH21 ARG 52 HH21 ARG 52 15.082 6.287 -10.622 435 HH22 ARG 52 HH22 ARG 52 14.555 5.227 -11.867 436 H LEU 53 H LEU 53 17.385 -1.307 -7.658 437 HA LEU 53 HA LEU 53 19.535 -2.228 -6.393 438 HB2 LEU 53 HB2 LEU 53 17.054 -3.487 -7.659 439 HB3 LEU 53 HB3 LEU 53 18.121 -4.317 -6.546 440 HG LEU 53 HG LEU 53 17.740 -2.787 -4.853 441 HD11 LEU 53 HD11 LEU 53 16.012 -1.079 -4.634 442 HD12 LEU 53 HD12 LEU 53 17.527 -0.674 -5.425 443 HD13 LEU 53 HD13 LEU 53 16.090 -0.937 -6.399 444 HD21 LEU 53 HD21 LEU 53 15.417 -3.360 -4.263 445 HD22 LEU 53 HD22 LEU 53 15.054 -3.579 -6.000 446 HD23 LEU 53 HD23 LEU 53 16.175 -4.682 -5.166 447 H ASP 54 H ASP 54 21.052 -3.521 -6.892 448 HA ASP 54 HA ASP 54 22.010 -3.740 -9.639 449 HB2 ASP 54 HB2 ASP 54 23.510 -3.451 -7.681 450 HB3 ASP 54 HB3 ASP 54 23.025 -5.034 -7.069 451 H THR 55 H THR 55 20.450 -5.934 -7.343 452 HA THR 55 HA THR 55 19.867 -7.857 -9.530 453 HB THR 55 HB THR 55 20.692 -9.705 -7.928 454 HG1 THR 55 HG1 THR 55 21.077 -8.289 -6.106 455 HG21 THR 55 HG21 THR 55 22.909 -7.967 -9.053 456 HG22 THR 55 HG22 THR 55 22.928 -9.698 -8.692 457 HG23 THR 55 HG23 THR 55 21.903 -9.086 -10.009 458 HA PRO 56 HA PRO 56 16.440 -7.034 -6.449 459 HB2 PRO 56 HB2 PRO 56 14.472 -7.052 -8.417 460 HB3 PRO 56 HB3 PRO 56 15.255 -5.604 -7.707 461 HG2 PRO 56 HG2 PRO 56 15.824 -7.036 -10.294 462 HG3 PRO 56 HG3 PRO 56 15.816 -5.276 -9.949 463 HD2 PRO 56 HD2 PRO 56 18.119 -6.721 -10.119 464 HD3 PRO 56 HD3 PRO 56 17.958 -5.393 -8.939 465 HA PRO 57 HA PRO 57 15.961 -11.550 -7.007 466 HB2 PRO 57 HB2 PRO 57 15.359 -12.342 -4.477 467 HB3 PRO 57 HB3 PRO 57 17.015 -11.861 -4.957 468 HG2 PRO 57 HG2 PRO 57 14.897 -10.145 -3.609 469 HG3 PRO 57 HG3 PRO 57 16.607 -10.379 -3.118 470 HD2 PRO 57 HD2 PRO 57 15.857 -8.251 -4.610 471 HD3 PRO 57 HD3 PRO 57 17.402 -9.082 -4.876 472 H PHE 58 H PHE 58 13.546 -9.267 -5.740 473 HA PHE 58 HA PHE 58 11.411 -11.295 -6.194 474 HB2 PHE 58 HB2 PHE 58 9.934 -9.746 -4.954 475 HB3 PHE 58 HB3 PHE 58 11.219 -10.491 -4.027 476 HD1 PHE 58 HD1 PHE 58 12.800 -9.182 -2.804 477 HD2 PHE 58 HD2 PHE 58 10.201 -7.293 -5.692 478 HE1 PHE 58 HE1 PHE 58 13.537 -6.941 -2.009 479 HE2 PHE 58 HE2 PHE 58 10.927 -5.081 -4.876 480 HZ PHE 58 HZ PHE 58 12.576 -4.890 -3.023 481 H SER 59 H SER 59 9.484 -10.641 -7.326 482 HA SER 59 HA SER 59 10.137 -9.125 -9.765 483 HB2 SER 59 HB2 SER 59 8.039 -11.084 -8.804 484 HB3 SER 59 HB3 SER 59 7.732 -10.125 -10.239 485 HG SER 59 HG SER 59 10.137 -11.621 -9.861 486 H LYS 60 H LYS 60 8.726 -7.638 -10.709 487 HA LYS 60 HA LYS 60 7.872 -5.466 -9.080 488 HB2 LYS 60 HB2 LYS 60 6.953 -6.141 -11.920 489 HB3 LYS 60 HB3 LYS 60 6.913 -4.561 -11.139 490 HG2 LYS 60 HG2 LYS 60 9.391 -4.568 -11.036 491 HG3 LYS 60 HG3 LYS 60 9.428 -6.130 -11.849 492 HD2 LYS 60 HD2 LYS 60 8.307 -5.184 -13.831 493 HD3 LYS 60 HD3 LYS 60 8.222 -3.604 -13.051 494 HE2 LYS 60 HE2 LYS 60 10.753 -3.604 -12.906 495 HE3 LYS 60 HE3 LYS 60 10.770 -5.140 -13.754 496 HZ1 LYS 60 HZ1 LYS 60 9.727 -3.998 -15.654 497 HZ2 LYS 60 HZ2 LYS 60 9.820 -2.567 -14.845 498 HZ3 LYS 60 HZ3 LYS 60 11.189 -3.376 -15.262 499 H LYS 61 H LYS 61 6.143 -8.113 -10.685 500 HA LYS 61 HA LYS 61 3.520 -7.352 -9.949 501 HB2 LYS 61 HB2 LYS 61 4.849 -9.960 -10.718 502 HB3 LYS 61 HB3 LYS 61 3.219 -9.999 -10.034 503 HG2 LYS 61 HG2 LYS 61 2.349 -8.508 -11.719 504 HG3 LYS 61 HG3 LYS 61 3.964 -8.232 -12.407 505 HD2 LYS 61 HD2 LYS 61 4.123 -10.413 -13.262 506 HD3 LYS 61 HD3 LYS 61 2.855 -11.032 -12.193 507 HE2 LYS 61 HE2 LYS 61 1.184 -9.604 -13.423 508 HE3 LYS 61 HE3 LYS 61 2.463 -9.161 -14.567 509 HZ1 LYS 61 HZ1 LYS 61 1.100 -10.997 -15.345 510 HZ2 LYS 61 HZ2 LYS 61 2.663 -11.469 -15.165 511 HZ3 LYS 61 HZ3 LYS 61 1.542 -11.923 -14.046 512 H SER 62 H SER 62 5.880 -9.511 -8.138 513 HA SER 62 HA SER 62 4.230 -10.033 -5.974 514 HB2 SER 62 HB2 SER 62 7.228 -9.594 -5.739 515 HB3 SER 62 HB3 SER 62 6.184 -10.727 -4.864 516 HG SER 62 HG SER 62 7.172 -11.909 -6.346 517 H LEU 63 H LEU 63 6.572 -7.314 -6.452 518 HA LEU 63 HA LEU 63 6.323 -6.087 -3.966 519 HB2 LEU 63 HB2 LEU 63 7.965 -5.498 -5.774 520 HB3 LEU 63 HB3 LEU 63 6.671 -4.698 -6.643 521 HG LEU 63 HG LEU 63 6.523 -3.518 -4.095 522 HD11 LEU 63 HD11 LEU 63 8.703 -2.801 -3.452 523 HD12 LEU 63 HD12 LEU 63 8.813 -4.565 -3.597 524 HD13 LEU 63 HD13 LEU 63 9.447 -3.520 -4.888 525 HD21 LEU 63 HD21 LEU 63 8.131 -2.450 -6.475 526 HD22 LEU 63 HD22 LEU 63 6.381 -2.392 -6.299 527 HD23 LEU 63 HD23 LEU 63 7.415 -1.520 -5.141 528 H ARG 64 H ARG 64 4.351 -5.330 -6.919 529 HA ARG 64 HA ARG 64 2.620 -3.626 -5.387 530 HB2 ARG 64 HB2 ARG 64 2.907 -3.471 -7.868 531 HB3 ARG 64 HB3 ARG 64 2.024 -4.972 -8.069 532 HG2 ARG 64 HG2 ARG 64 0.695 -2.891 -8.490 533 HG3 ARG 64 HG3 ARG 64 -0.030 -3.957 -7.282 534 HD2 ARG 64 HD2 ARG 64 0.448 -2.544 -5.498 535 HD3 ARG 64 HD3 ARG 64 1.777 -1.754 -6.346 536 HE ARG 64 HE ARG 64 -0.594 -1.150 -7.738 537 HH11 ARG 64 HH11 ARG 64 0.635 -0.618 -4.471 538 HH12 ARG 64 HH12 ARG 64 -0.102 0.919 -4.242 539 HH21 ARG 64 HH21 ARG 64 -1.438 1.022 -7.565 540 HH22 ARG 64 HH22 ARG 64 -1.393 1.829 -6.009 541 H GLU 65 H GLU 65 2.357 -7.077 -6.231 542 HA GLU 65 HA GLU 65 -0.347 -7.516 -5.598 543 HB2 GLU 65 HB2 GLU 65 1.002 -9.150 -6.751 544 HB3 GLU 65 HB3 GLU 65 2.137 -9.263 -5.403 545 HG2 GLU 65 HG2 GLU 65 0.463 -10.356 -4.013 546 HG3 GLU 65 HG3 GLU 65 -0.773 -10.120 -5.268 547 H ALA 66 H ALA 66 2.595 -7.653 -3.567 548 HA ALA 66 HA ALA 66 1.233 -8.186 -1.117 549 HB1 ALA 66 HB1 ALA 66 3.618 -8.728 -1.569 550 HB2 ALA 66 HB2 ALA 66 3.972 -6.992 -1.689 551 HB3 ALA 66 HB3 ALA 66 3.433 -7.688 -0.144 552 H LEU 67 H LEU 67 2.545 -5.114 -2.564 553 HA LEU 67 HA LEU 67 1.944 -3.388 -0.450 554 HB2 LEU 67 HB2 LEU 67 3.040 -3.053 -2.889 555 HB3 LEU 67 HB3 LEU 67 1.460 -2.384 -3.246 556 HG LEU 67 HG LEU 67 3.433 -1.484 -1.094 557 HD11 LEU 67 HD11 LEU 67 3.802 0.464 -2.531 558 HD12 LEU 67 HD12 LEU 67 4.105 -1.001 -3.461 559 HD13 LEU 67 HD13 LEU 67 2.600 -0.094 -3.704 560 HD21 LEU 67 HD21 LEU 67 1.266 -0.890 -0.251 561 HD22 LEU 67 HD22 LEU 67 1.987 0.569 -0.916 562 HD23 LEU 67 HD23 LEU 67 0.729 -0.293 -1.839 563 H SER 68 H SER 68 -0.215 -4.671 -2.949 564 HA SER 68 HA SER 68 -2.470 -3.045 -2.565 565 HB2 SER 68 HB2 SER 68 -2.496 -6.029 -3.155 566 HB3 SER 68 HB3 SER 68 -3.766 -4.862 -3.524 567 HG SER 68 HG SER 68 -1.110 -4.807 -4.601 568 H TYR 69 H TYR 69 -1.287 -5.705 -0.469 569 HA TYR 69 HA TYR 69 -3.752 -5.951 1.031 570 HB2 TYR 69 HB2 TYR 69 -1.013 -7.069 1.192 571 HB3 TYR 69 HB3 TYR 69 -1.710 -6.693 2.752 572 HD1 TYR 69 HD1 TYR 69 -2.662 -8.494 3.818 573 HD2 TYR 69 HD2 TYR 69 -2.972 -8.219 -0.484 574 HE1 TYR 69 HE1 TYR 69 -3.967 -10.568 3.786 575 HE2 TYR 69 HE2 TYR 69 -4.362 -10.255 -0.514 576 HH TYR 69 HH TYR 69 -5.356 -11.930 2.500 577 H TYR 70 H TYR 70 -0.757 -3.975 1.414 578 HA TYR 70 HA TYR 70 -1.521 -2.905 3.967 579 HB2 TYR 70 HB2 TYR 70 0.519 -2.170 1.898 580 HB3 TYR 70 HB3 TYR 70 -0.005 -0.939 3.033 581 HD1 TYR 70 HD1 TYR 70 0.413 -4.606 3.816 582 HD2 TYR 70 HD2 TYR 70 1.916 -0.586 4.340 583 HE1 TYR 70 HE1 TYR 70 2.003 -5.417 5.518 584 HE2 TYR 70 HE2 TYR 70 3.520 -1.417 6.019 585 HH TYR 70 HH TYR 70 4.614 -3.577 6.797 586 H SER 71 H SER 71 -2.234 -1.925 0.626 587 HA SER 71 HA SER 71 -3.673 0.479 1.456 588 HB2 SER 71 HB2 SER 71 -3.982 -0.908 -1.189 589 HB3 SER 71 HB3 SER 71 -4.130 0.817 -0.781 590 HG SER 71 HG SER 71 -2.142 -0.183 -1.889 591 H ALA 72 H ALA 72 -4.487 -2.755 1.768 592 HA ALA 72 HA ALA 72 -7.416 -2.280 1.582 593 HB1 ALA 72 HB1 ALA 72 -6.624 -3.894 -0.123 594 HB2 ALA 72 HB2 ALA 72 -5.864 -4.867 1.166 595 HB3 ALA 72 HB3 ALA 72 -7.630 -4.671 1.115 596 H SER 73 H SER 73 -5.127 -2.049 3.719 597 HA SER 73 HA SER 73 -5.521 -3.990 5.744 598 HB2 SER 73 HB2 SER 73 -4.885 -1.017 6.083 599 HB3 SER 73 HB3 SER 73 -4.633 -2.280 7.298 600 HG SER 73 HG SER 73 -3.261 -1.752 4.918 601 HA PRO 74 HA PRO 74 -9.611 -3.049 7.102 602 HB2 PRO 74 HB2 PRO 74 -9.373 -3.304 9.896 603 HB3 PRO 74 HB3 PRO 74 -9.690 -4.616 8.730 604 HG2 PRO 74 HG2 PRO 74 -7.109 -3.809 10.034 605 HG3 PRO 74 HG3 PRO 74 -7.682 -5.443 9.586 606 HD2 PRO 74 HD2 PRO 74 -5.828 -4.024 8.131 607 HD3 PRO 74 HD3 PRO 74 -6.955 -5.177 7.380 608 H ALA 75 H ALA 75 -7.153 -1.592 9.321 609 HA ALA 75 HA ALA 75 -8.542 0.669 9.985 610 HB1 ALA 75 HB1 ALA 75 -6.458 -0.155 11.044 611 HB2 ALA 75 HB2 ALA 75 -5.531 0.420 9.629 612 HB3 ALA 75 HB3 ALA 75 -6.399 1.573 10.665 613 H TYR 76 H TYR 76 -6.621 0.250 7.031 614 HA TYR 76 HA TYR 76 -6.543 2.989 6.254 615 HB2 TYR 76 HB2 TYR 76 -5.156 1.236 5.082 616 HB3 TYR 76 HB3 TYR 76 -6.609 0.441 4.550 617 HD1 TYR 76 HD1 TYR 76 -4.440 3.423 4.125 618 HD2 TYR 76 HD2 TYR 76 -7.921 1.323 2.689 619 HE1 TYR 76 HE1 TYR 76 -4.374 4.735 2.081 620 HE2 TYR 76 HE2 TYR 76 -7.820 2.598 0.588 621 HH TYR 76 HH TYR 76 -6.700 4.295 -0.620 622 H LEU 77 H LEU 77 -8.781 0.348 5.367 623 HA LEU 77 HA LEU 77 -10.533 2.018 3.823 624 HB2 LEU 77 HB2 LEU 77 -10.997 -0.696 5.123 625 HB3 LEU 77 HB3 LEU 77 -12.002 0.018 3.872 626 HG LEU 77 HG LEU 77 -9.057 -0.598 3.413 627 HD11 LEU 77 HD11 LEU 77 -10.144 -2.636 4.125 628 HD12 LEU 77 HD12 LEU 77 -11.450 -2.379 2.949 629 HD13 LEU 77 HD13 LEU 77 -9.797 -2.711 2.385 630 HD21 LEU 77 HD21 LEU 77 -11.357 -0.162 1.487 631 HD22 LEU 77 HD22 LEU 77 -10.011 0.946 1.786 632 HD23 LEU 77 HD23 LEU 77 -9.708 -0.631 1.049 633 H SER 78 H SER 78 -10.759 0.614 7.079 634 HA SER 78 HA SER 78 -13.284 1.542 7.812 635 HB2 SER 78 HB2 SER 78 -11.531 -0.097 8.944 636 HB3 SER 78 HB3 SER 78 -11.058 1.334 9.854 637 HG SER 78 HG SER 78 -12.633 0.117 10.910 638 H CYS 79 H CYS 79 -10.235 3.417 7.712 639 HA CYS 79 HA CYS 79 -11.305 5.369 9.565 640 HB2 CYS 79 HB2 CYS 79 -8.821 4.876 8.696 641 HB3 CYS 79 HB3 CYS 79 -9.207 6.191 7.581 642 HG CYS 79 HG CYS 79 -7.898 6.811 9.940 643 H GLN 80 H GLN 80 -11.798 4.790 6.180 644 HA GLN 80 HA GLN 80 -12.419 6.330 4.511 645 HB2 GLN 80 HB2 GLN 80 -14.877 6.100 4.446 646 HB3 GLN 80 HB3 GLN 80 -14.029 4.594 4.701 647 HG2 GLN 80 HG2 GLN 80 -14.999 4.224 6.714 648 HG3 GLN 80 HG3 GLN 80 -14.775 5.884 7.261 649 HE21 GLN 80 HE21 GLN 80 -16.173 7.542 5.991 650 HE22 GLN 80 HE22 GLN 80 -17.847 7.127 5.721 651 H LYS 81 H LYS 81 -11.362 8.316 5.151 652 HA LYS 81 HA LYS 81 -13.365 10.404 5.739 653 HB2 LYS 81 HB2 LYS 81 -10.774 9.837 7.133 654 HB3 LYS 81 HB3 LYS 81 -11.241 11.529 6.897 655 HG2 LYS 81 HG2 LYS 81 -13.255 11.308 8.084 656 HG3 LYS 81 HG3 LYS 81 -13.288 9.559 7.920 657 HD2 LYS 81 HD2 LYS 81 -11.407 9.344 9.509 658 HD3 LYS 81 HD3 LYS 81 -11.469 11.110 9.790 659 HE2 LYS 81 HE2 LYS 81 -13.722 11.008 10.581 660 HE3 LYS 81 HE3 LYS 81 -13.988 9.409 9.888 661 HZ1 LYS 81 HZ1 LYS 81 -12.658 8.437 11.564 662 HZ2 LYS 81 HZ2 LYS 81 -12.302 9.944 12.241 663 HZ3 LYS 81 HZ3 LYS 81 -13.818 9.381 12.228 664 HA PRO 82 HA PRO 82 -11.386 11.564 1.823 665 HB2 PRO 82 HB2 PRO 82 -13.231 13.411 1.000 666 HB3 PRO 82 HB3 PRO 82 -13.588 11.665 0.991 667 HG2 PRO 82 HG2 PRO 82 -14.324 13.715 3.095 668 HG3 PRO 82 HG3 PRO 82 -15.379 12.484 2.338 669 HD2 PRO 82 HD2 PRO 82 -14.169 12.120 4.759 670 HD3 PRO 82 HD3 PRO 82 -14.492 10.760 3.643 671 H ASP 83 H ASP 83 -11.005 13.927 0.947 672 HA ASP 83 HA ASP 83 -9.758 15.865 1.232 673 HB2 ASP 83 HB2 ASP 83 -11.556 16.415 3.580 674 HB3 ASP 83 HB3 ASP 83 -10.693 17.568 2.559 675 H THR 84 H THR 84 -8.502 13.667 2.253 676 HA THR 84 HA THR 84 -7.145 14.532 4.734 677 HB THR 84 HB THR 84 -8.260 12.404 4.776 678 HG1 THR 84 HG1 THR 84 -5.454 12.419 4.899 679 HG21 THR 84 HG21 THR 84 -7.454 10.492 3.434 680 HG22 THR 84 HG22 THR 84 -8.273 11.696 2.456 681 HG23 THR 84 HG23 THR 84 -6.497 11.595 2.420 682 H ALA 85 H ALA 85 -6.441 14.593 1.366 683 HA ALA 85 HA ALA 85 -4.581 15.080 0.181 684 HB1 ALA 85 HB1 ALA 85 -2.847 16.421 1.127 685 HB2 ALA 85 HB2 ALA 85 -4.422 16.945 1.759 686 HB3 ALA 85 HB3 ALA 85 -3.319 15.985 2.777 687 H ARG 86 H ARG 86 -3.825 13.416 -0.803 688 HA ARG 86 HA ARG 86 -2.383 11.253 0.573 689 HB2 ARG 86 HB2 ARG 86 -2.851 11.958 -2.334 690 HB3 ARG 86 HB3 ARG 86 -2.147 10.429 -1.807 691 HG2 ARG 86 HG2 ARG 86 -4.313 9.810 -0.837 692 HG3 ARG 86 HG3 ARG 86 -4.995 11.385 -1.219 693 HD2 ARG 86 HD2 ARG 86 -4.013 9.349 -3.259 694 HD3 ARG 86 HD3 ARG 86 -5.696 9.658 -2.838 695 HE ARG 86 HE ARG 86 -3.992 11.872 -3.858 696 HH11 ARG 86 HH11 ARG 86 -7.032 9.956 -4.434 697 HH12 ARG 86 HH12 ARG 86 -7.624 11.200 -5.463 698 HH21 ARG 86 HH21 ARG 86 -4.626 12.977 -5.773 699 HH22 ARG 86 HH22 ARG 86 -6.264 12.896 -6.245 700 H VAL 87 H VAL 87 -0.051 10.689 -0.311 701 HA VAL 87 HA VAL 87 1.526 13.070 -1.105 702 HB VAL 87 HB VAL 87 3.283 12.319 0.521 703 HG11 VAL 87 HG11 VAL 87 2.434 13.536 2.374 704 HG12 VAL 87 HG12 VAL 87 1.884 14.317 0.898 705 HG13 VAL 87 HG13 VAL 87 0.736 13.334 1.832 706 HG21 VAL 87 HG21 VAL 87 2.439 10.083 1.088 707 HG22 VAL 87 HG22 VAL 87 2.611 11.095 2.524 708 HG23 VAL 87 HG23 VAL 87 0.995 10.788 1.857 709 H ASP 88 H ASP 88 3.533 12.578 -2.128 710 HA ASP 88 HA ASP 88 3.523 9.945 -3.499 711 HB2 ASP 88 HB2 ASP 88 4.543 10.939 -5.280 712 HB3 ASP 88 HB3 ASP 88 3.446 12.179 -4.759 713 H ILE 89 H ILE 89 5.918 9.245 -4.089 714 HA ILE 89 HA ILE 89 7.132 8.400 -1.635 715 HB ILE 89 HB ILE 89 9.062 7.702 -3.305 716 HG12 ILE 89 HG12 ILE 89 6.959 8.195 -5.452 717 HG13 ILE 89 HG13 ILE 89 8.126 9.431 -5.021 718 HG21 ILE 89 HG21 ILE 89 7.205 6.211 -2.433 719 HG22 ILE 89 HG22 ILE 89 6.363 6.542 -3.971 720 HG23 ILE 89 HG23 ILE 89 7.945 5.753 -3.981 721 HD11 ILE 89 HD11 ILE 89 8.908 8.209 -6.919 722 HD12 ILE 89 HD12 ILE 89 9.985 8.000 -5.550 723 HD13 ILE 89 HD13 ILE 89 8.855 6.670 -6.002 724 H TYR 90 H TYR 90 7.529 11.389 -3.307 725 HA TYR 90 HA TYR 90 10.260 11.843 -2.243 726 HB2 TYR 90 HB2 TYR 90 8.464 13.505 -4.010 727 HB3 TYR 90 HB3 TYR 90 10.059 13.970 -3.472 728 HD1 TYR 90 HD1 TYR 90 8.194 11.457 -5.584 729 HD2 TYR 90 HD2 TYR 90 12.006 13.263 -4.660 730 HE1 TYR 90 HE1 TYR 90 9.149 10.454 -7.600 731 HE2 TYR 90 HE2 TYR 90 12.966 12.205 -6.652 732 HH TYR 90 HH TYR 90 12.271 11.256 -8.901 733 H GLY 91 H GLY 91 6.974 11.980 -1.261 734 HA2 GLY 91 HA2 GLY 91 6.174 12.689 0.770 735 HA3 GLY 91 HA3 GLY 91 7.599 13.708 1.023 736 H ASN 92 H ASN 92 6.351 14.189 -2.148 737 HA ASN 92 HA ASN 92 5.536 16.894 -1.473 738 HB2 ASN 92 HB2 ASN 92 5.023 15.314 -4.035 739 HB3 ASN 92 HB3 ASN 92 4.778 17.039 -3.818 740 HD21 ASN 92 HD21 ASN 92 6.922 14.764 -4.958 741 HD22 ASN 92 HD22 ASN 92 8.370 15.771 -5.033 742 H GLU 93 H GLU 93 3.480 17.658 -1.208 743 HA GLU 93 HA GLU 93 1.385 15.766 -0.566 744 HB2 GLU 93 HB2 GLU 93 1.949 18.340 0.213 745 HB3 GLU 93 HB3 GLU 93 0.677 18.650 -0.971 746 HG2 GLU 93 HG2 GLU 93 -0.903 17.351 0.242 747 HG3 GLU 93 HG3 GLU 93 0.349 16.594 1.238 748 H VAL 94 H VAL 94 -0.459 15.330 -1.705 749 HA VAL 94 HA VAL 94 -0.720 16.305 -4.434 750 HB VAL 94 HB VAL 94 -0.754 14.389 -5.528 751 HG11 VAL 94 HG11 VAL 94 1.220 13.067 -4.998 752 HG12 VAL 94 HG12 VAL 94 1.572 14.722 -4.547 753 HG13 VAL 94 HG13 VAL 94 1.164 13.551 -3.302 754 HG21 VAL 94 HG21 VAL 94 -0.982 12.641 -3.104 755 HG22 VAL 94 HG22 VAL 94 -2.391 13.179 -4.075 756 HG23 VAL 94 HG23 VAL 94 -1.146 12.182 -4.809 757 H ASP 95 H ASP 95 -3.185 15.294 -5.165 758 HA ASP 95 HA ASP 95 -4.765 16.956 -3.389 759 HB2 ASP 95 HB2 ASP 95 -6.133 15.147 -5.336 760 HB3 ASP 95 HB3 ASP 95 -6.510 16.793 -4.881 761 H VAL 96 H VAL 96 -7.182 15.886 -3.042 762 HA VAL 96 HA VAL 96 -6.676 13.641 -1.171 763 HB VAL 96 HB VAL 96 -8.349 14.604 0.150 764 HG11 VAL 96 HG11 VAL 96 -7.782 16.871 0.574 765 HG12 VAL 96 HG12 VAL 96 -6.293 16.153 -0.013 766 HG13 VAL 96 HG13 VAL 96 -7.245 17.167 -1.081 767 HG21 VAL 96 HG21 VAL 96 -9.748 16.636 -0.707 768 HG22 VAL 96 HG22 VAL 96 -9.263 16.150 -2.320 769 HG23 VAL 96 HG23 VAL 96 -10.199 15.039 -1.278 770 H VAL 97 H VAL 97 -8.387 12.215 -0.706 771 HA VAL 97 HA VAL 97 -9.632 11.068 -3.091 772 HB VAL 97 HB VAL 97 -9.790 10.235 -0.149 773 HG11 VAL 97 HG11 VAL 97 -10.398 8.671 -2.705 774 HG12 VAL 97 HG12 VAL 97 -10.367 7.996 -1.055 775 HG13 VAL 97 HG13 VAL 97 -11.578 9.202 -1.482 776 HG21 VAL 97 HG21 VAL 97 -7.884 9.375 -2.371 777 HG22 VAL 97 HG22 VAL 97 -7.459 10.166 -0.820 778 HG23 VAL 97 HG23 VAL 97 -8.064 8.521 -0.828 779 H THR 98 H THR 98 -11.764 11.240 -3.646 780 HA THR 98 HA THR 98 -13.382 13.332 -2.559 781 HB THR 98 HB THR 98 -15.132 12.166 -4.123 782 HG1 THR 98 HG1 THR 98 -12.767 10.942 -5.080 783 HG21 THR 98 HG21 THR 98 -14.254 13.206 -6.070 784 HG22 THR 98 HG22 THR 98 -13.867 14.229 -4.687 785 HG23 THR 98 HG23 THR 98 -12.598 13.222 -5.414 786 HA PRO 99 HA PRO 99 -15.721 11.228 0.503 787 HB2 PRO 99 HB2 PRO 99 -18.304 12.149 0.215 788 HB3 PRO 99 HB3 PRO 99 -16.962 13.120 0.862 789 HG2 PRO 99 HG2 PRO 99 -18.009 13.103 -1.972 790 HG3 PRO 99 HG3 PRO 99 -17.645 14.507 -0.906 791 HD2 PRO 99 HD2 PRO 99 -15.863 13.669 -2.751 792 HD3 PRO 99 HD3 PRO 99 -15.316 14.197 -1.130 793 H GLU 100 H GLU 100 -16.953 10.888 -2.864 794 HA GLU 100 HA GLU 100 -18.646 8.608 -2.283 795 HB2 GLU 100 HB2 GLU 100 -17.220 9.520 -4.813 796 HB3 GLU 100 HB3 GLU 100 -18.247 8.081 -4.729 797 HG2 GLU 100 HG2 GLU 100 -20.205 9.384 -4.190 798 HG3 GLU 100 HG3 GLU 100 -19.242 10.865 -4.066 799 H GLN 101 H GLN 101 -15.259 8.920 -3.512 800 HA GLN 101 HA GLN 101 -14.755 6.095 -3.464 801 HB2 GLN 101 HB2 GLN 101 -12.946 8.574 -3.406 802 HB3 GLN 101 HB3 GLN 101 -12.316 6.930 -3.418 803 HG2 GLN 101 HG2 GLN 101 -13.630 6.541 -5.571 804 HG3 GLN 101 HG3 GLN 101 -13.996 8.268 -5.585 805 HE21 GLN 101 HE21 GLN 101 -12.707 9.060 -7.332 806 HE22 GLN 101 HE22 GLN 101 -11.000 8.719 -7.500 807 H ALA 102 H ALA 102 -14.456 8.636 -0.959 808 HA ALA 102 HA ALA 102 -12.934 7.055 0.843 809 HB1 ALA 102 HB1 ALA 102 -13.089 9.467 1.102 810 HB2 ALA 102 HB2 ALA 102 -14.838 9.362 1.412 811 HB3 ALA 102 HB3 ALA 102 -13.691 8.667 2.564 812 H LYS 103 H LYS 103 -16.541 7.592 0.641 813 HA LYS 103 HA LYS 103 -17.082 5.784 2.772 814 HB2 LYS 103 HB2 LYS 103 -19.363 5.938 2.254 815 HB3 LYS 103 HB3 LYS 103 -18.683 7.519 1.929 816 HG2 LYS 103 HG2 LYS 103 -18.711 7.113 -0.462 817 HG3 LYS 103 HG3 LYS 103 -19.255 5.453 -0.248 818 HD2 LYS 103 HD2 LYS 103 -20.897 7.911 0.382 819 HD3 LYS 103 HD3 LYS 103 -20.970 6.915 -1.075 820 HE2 LYS 103 HE2 LYS 103 -21.506 4.961 0.507 821 HE3 LYS 103 HE3 LYS 103 -21.796 6.186 1.747 822 HZ1 LYS 103 HZ1 LYS 103 -23.170 5.872 -0.849 823 HZ2 LYS 103 HZ2 LYS 103 -23.817 5.583 0.601 824 HZ3 LYS 103 HZ3 LYS 103 -23.491 7.134 0.202 825 H TYR 104 H TYR 104 -16.816 5.168 -0.726 826 HA TYR 104 HA TYR 104 -17.721 2.494 -0.913 827 HB2 TYR 104 HB2 TYR 104 -15.945 4.330 -2.471 828 HB3 TYR 104 HB3 TYR 104 -15.821 2.640 -2.803 829 HD1 TYR 104 HD1 TYR 104 -17.061 5.259 -4.357 830 HD2 TYR 104 HD2 TYR 104 -18.707 1.670 -2.563 831 HE1 TYR 104 HE1 TYR 104 -18.934 5.279 -5.970 832 HE2 TYR 104 HE2 TYR 104 -20.518 1.682 -4.178 833 HH TYR 104 HH TYR 104 -20.450 3.723 -7.028 834 H ALA 105 H ALA 105 -14.646 3.678 0.387 835 HA ALA 105 HA ALA 105 -13.220 1.281 0.237 836 HB1 ALA 105 HB1 ALA 105 -11.986 2.141 2.169 837 HB2 ALA 105 HB2 ALA 105 -12.370 3.446 1.018 838 HB3 ALA 105 HB3 ALA 105 -13.312 3.269 2.527 839 H TYR 106 H TYR 106 -15.935 2.106 2.408 840 HA TYR 106 HA TYR 106 -15.492 0.099 4.307 841 HB2 TYR 106 HB2 TYR 106 -17.460 0.828 5.197 842 HB3 TYR 106 HB3 TYR 106 -17.227 2.175 4.123 843 HD1 TYR 106 HD1 TYR 106 -18.240 1.345 1.455 844 HD2 TYR 106 HD2 TYR 106 -19.664 0.240 5.411 845 HE1 TYR 106 HE1 TYR 106 -20.388 0.598 0.503 846 HE2 TYR 106 HE2 TYR 106 -21.817 -0.416 4.458 847 HH TYR 106 HH TYR 106 -23.158 0.167 2.338 848 H GLN 107 H GLN 107 -16.818 -0.148 1.109 849 HA GLN 107 HA GLN 107 -18.250 -2.573 1.368 850 HB2 GLN 107 HB2 GLN 107 -18.583 -2.414 -0.894 851 HB3 GLN 107 HB3 GLN 107 -18.284 -0.734 -0.430 852 HG2 GLN 107 HG2 GLN 107 -15.872 -1.132 -1.278 853 HG3 GLN 107 HG3 GLN 107 -16.488 -2.563 -1.959 854 HE21 GLN 107 HE21 GLN 107 -15.792 0.515 -2.688 855 HE22 GLN 107 HE22 GLN 107 -17.038 0.848 -3.906 856 H ARG 108 H ARG 108 -15.066 -1.779 0.322 857 HA ARG 108 HA ARG 108 -14.060 -4.436 -0.118 858 HB2 ARG 108 HB2 ARG 108 -12.381 -2.084 0.814 859 HB3 ARG 108 HB3 ARG 108 -11.813 -3.503 -0.064 860 HG2 ARG 108 HG2 ARG 108 -13.701 -1.347 -1.100 861 HG3 ARG 108 HG3 ARG 108 -11.995 -1.520 -1.478 862 HD2 ARG 108 HD2 ARG 108 -12.381 -3.743 -2.533 863 HD3 ARG 108 HD3 ARG 108 -14.107 -3.594 -2.202 864 HE ARG 108 HE ARG 108 -14.337 -2.425 -4.098 865 HH11 ARG 108 HH11 ARG 108 -10.834 -2.162 -3.292 866 HH12 ARG 108 HH12 ARG 108 -10.562 -1.047 -4.591 867 HH21 ARG 108 HH21 ARG 108 -13.780 -1.093 -5.933 868 HH22 ARG 108 HH22 ARG 108 -12.109 -0.880 -6.297 869 H TYR 109 H TYR 109 -14.184 -2.489 2.887 870 HA TYR 109 HA TYR 109 -12.608 -4.258 4.467 871 HB2 TYR 109 HB2 TYR 109 -13.341 -1.957 5.063 872 HB3 TYR 109 HB3 TYR 109 -14.968 -2.528 5.337 873 HD1 TYR 109 HD1 TYR 109 -15.203 -4.605 7.107 874 HD2 TYR 109 HD2 TYR 109 -11.941 -1.752 6.954 875 HE1 TYR 109 HE1 TYR 109 -14.612 -5.141 9.434 876 HE2 TYR 109 HE2 TYR 109 -11.417 -2.272 9.315 877 HH TYR 109 HH TYR 109 -13.299 -4.460 11.346 878 H GLN 110 H GLN 110 -16.212 -4.052 4.116 879 HA GLN 110 HA GLN 110 -16.665 -6.408 5.632 880 HB2 GLN 110 HB2 GLN 110 -18.954 -6.348 4.831 881 HB3 GLN 110 HB3 GLN 110 -18.395 -4.760 5.375 882 HG2 GLN 110 HG2 GLN 110 -18.009 -4.102 3.043 883 HG3 GLN 110 HG3 GLN 110 -18.627 -5.659 2.476 884 HE21 GLN 110 HE21 GLN 110 -20.699 -4.792 5.076 885 HE22 GLN 110 HE22 GLN 110 -21.807 -3.825 4.111 886 H GLU 111 H GLU 111 -15.889 -5.994 2.199 887 HA GLU 111 HA GLU 111 -16.764 -8.555 1.311 888 HB2 GLU 111 HB2 GLU 111 -14.453 -6.800 0.442 889 HB3 GLU 111 HB3 GLU 111 -14.765 -8.327 -0.344 890 HG2 GLU 111 HG2 GLU 111 -17.015 -6.331 -0.087 891 HG3 GLU 111 HG3 GLU 111 -15.737 -6.038 -1.267 892 H ARG 112 H ARG 112 -13.801 -7.688 3.144 893 HA ARG 112 HA ARG 112 -13.018 -10.546 2.978 894 HB2 ARG 112 HB2 ARG 112 -10.849 -9.797 3.844 895 HB3 ARG 112 HB3 ARG 112 -11.422 -9.430 2.213 896 HG2 ARG 112 HG2 ARG 112 -11.979 -7.072 3.229 897 HG3 ARG 112 HG3 ARG 112 -10.755 -7.523 4.405 898 HD2 ARG 112 HD2 ARG 112 -10.257 -7.871 1.435 899 HD3 ARG 112 HD3 ARG 112 -10.141 -6.261 2.151 900 HE ARG 112 HE ARG 112 -8.225 -6.808 3.288 901 HH11 ARG 112 HH11 ARG 112 -9.293 -9.767 1.522 902 HH12 ARG 112 HH12 ARG 112 -7.886 -10.635 1.977 903 HH21 ARG 112 HH21 ARG 112 -6.281 -7.969 3.618 904 HH22 ARG 112 HH22 ARG 112 -6.267 -9.681 3.308 905 H TYR 113 H TYR 113 -13.247 -7.948 5.282 906 HA TYR 113 HA TYR 113 -13.010 -9.791 7.586 907 HB2 TYR 113 HB2 TYR 113 -13.335 -6.766 7.499 908 HB3 TYR 113 HB3 TYR 113 -12.850 -7.722 8.890 909 HD1 TYR 113 HD1 TYR 113 -11.507 -5.525 6.602 910 HD2 TYR 113 HD2 TYR 113 -10.846 -9.530 8.070 911 HE1 TYR 113 HE1 TYR 113 -9.134 -5.402 5.851 912 HE2 TYR 113 HE2 TYR 113 -8.486 -9.395 7.411 913 HH TYR 113 HH TYR 113 -6.779 -7.760 7.021 914 H GLY 114 H GLY 114 -15.497 -9.042 5.650 915 HA2 GLY 114 HA2 GLY 114 -17.522 -9.229 7.902 916 HA3 GLY 114 HA3 GLY 114 -17.757 -8.172 6.515 917 H ASN 115 H ASN 115 -16.258 -11.102 5.641 918 HA ASN 115 HA ASN 115 -16.854 -12.951 4.563 919 HB2 ASN 115 HB2 ASN 115 -19.654 -12.817 5.698 920 HB3 ASN 115 HB3 ASN 115 -18.791 -14.224 5.118 921 HD21 ASN 115 HD21 ASN 115 -19.686 -12.618 7.975 922 HD22 ASN 115 HD22 ASN 115 -18.467 -13.318 8.996 923 H LYS 116 H LYS 116 -18.663 -13.900 3.047 924 HA LYS 116 HA LYS 116 -18.762 -12.072 0.816 925 HB2 LYS 116 HB2 LYS 116 -19.770 -14.870 1.405 926 HB3 LYS 116 HB3 LYS 116 -20.145 -14.098 -0.129 927 HG2 LYS 116 HG2 LYS 116 -17.261 -14.067 0.778 928 HG3 LYS 116 HG3 LYS 116 -17.924 -15.620 0.300 929 HD2 LYS 116 HD2 LYS 116 -18.157 -13.160 -1.481 930 HD3 LYS 116 HD3 LYS 116 -16.766 -14.244 -1.505 931 HE2 LYS 116 HE2 LYS 116 -18.235 -16.186 -1.955 932 HE3 LYS 116 HE3 LYS 116 -19.655 -15.134 -1.947 933 HZ1 LYS 116 HZ1 LYS 116 -18.756 -15.705 -4.155 934 HZ2 LYS 116 HZ2 LYS 116 -18.955 -14.109 -3.911 935 HZ3 LYS 116 HZ3 LYS 116 -17.431 -14.767 -3.858 936 H LYS 117 H LYS 117 -20.822 -11.769 -0.413 937 HA LYS 117 HA LYS 117 -23.204 -11.281 1.289 938 HB2 LYS 117 HB2 LYS 117 -23.449 -9.038 0.428 939 HB3 LYS 117 HB3 LYS 117 -21.887 -9.170 1.232 940 HG2 LYS 117 HG2 LYS 117 -20.726 -9.346 -0.917 941 HG3 LYS 117 HG3 LYS 117 -22.271 -9.432 -1.782 942 HD2 LYS 117 HD2 LYS 117 -21.430 -7.010 -0.132 943 HD3 LYS 117 HD3 LYS 117 -21.117 -7.200 -1.874 944 HE2 LYS 117 HE2 LYS 117 -23.546 -7.606 -2.247 945 HE3 LYS 117 HE3 LYS 117 -23.859 -7.256 -0.540 946 HZ1 LYS 117 HZ1 LYS 117 -24.280 -5.416 -1.992 947 HZ2 LYS 117 HZ2 LYS 117 -23.080 -5.027 -0.904 948 HZ3 LYS 117 HZ3 LYS 117 -22.748 -5.350 -2.509 949 H SER 118 H SER 118 -24.760 -10.076 -0.769 950 HA SER 118 HA SER 118 -24.720 -12.095 -2.931 951 HB2 SER 118 HB2 SER 118 -26.258 -12.617 -0.944 952 HB3 SER 118 HB3 SER 118 -27.202 -11.201 -1.450 953 HG SER 118 HG SER 118 -26.514 -13.489 -3.029 954 H GLN 119 H GLN 119 -26.759 -11.349 -4.402 955 HA GLN 119 HA GLN 119 -25.850 -8.875 -5.654 956 HB2 GLN 119 HB2 GLN 119 -28.205 -10.722 -6.275 957 HB3 GLN 119 HB3 GLN 119 -27.709 -9.359 -7.258 958 HG2 GLN 119 HG2 GLN 119 -26.469 -10.826 -8.408 959 HG3 GLN 119 HG3 GLN 119 -25.308 -10.668 -7.095 960 HE21 GLN 119 HE21 GLN 119 -24.680 -12.689 -6.202 961 HE22 GLN 119 HE22 GLN 119 -25.702 -14.124 -6.210 962 H ASP 120 H ASP 120 -27.734 -7.305 -6.402 963 HA ASP 120 HA ASP 120 -29.604 -6.681 -4.180 964 HB2 ASP 120 HB2 ASP 120 -27.730 -5.299 -3.676 965 HB3 ASP 120 HB3 ASP 120 -27.536 -4.784 -5.346 966 H LEU 121 H LEU 121 -28.745 -4.729 -6.899 967 HA LEU 121 HA LEU 121 -31.380 -4.689 -7.839 968 HB2 LEU 121 HB2 LEU 121 -30.564 -3.326 -9.688 969 HB3 LEU 121 HB3 LEU 121 -29.811 -2.872 -8.175 970 HG LEU 121 HG LEU 121 -27.908 -4.613 -9.047 971 HD11 LEU 121 HD11 LEU 121 -29.096 -3.395 -11.585 972 HD12 LEU 121 HD12 LEU 121 -27.565 -4.281 -11.469 973 HD13 LEU 121 HD13 LEU 121 -29.080 -5.130 -11.168 974 HD21 LEU 121 HD21 LEU 121 -26.640 -2.681 -9.870 975 HD22 LEU 121 HD22 LEU 121 -28.130 -1.716 -9.952 976 HD23 LEU 121 HD23 LEU 121 -27.516 -2.282 -8.385 977 H LYS 122 H LYS 122 -32.295 -5.518 -9.750 978 HA LYS 122 HA LYS 122 -32.113 -8.238 -10.191 979 HB2 LYS 122 HB2 LYS 122 -33.050 -6.083 -12.128 980 HB3 LYS 122 HB3 LYS 122 -33.250 -7.824 -12.354 981 HG2 LYS 122 HG2 LYS 122 -34.746 -7.997 -10.457 982 HG3 LYS 122 HG3 LYS 122 -34.461 -6.300 -10.020 983 HD2 LYS 122 HD2 LYS 122 -36.592 -6.537 -11.243 984 HD3 LYS 122 HD3 LYS 122 -35.429 -5.539 -12.132 985 HE2 LYS 122 HE2 LYS 122 -34.802 -7.663 -13.449 986 HE3 LYS 122 HE3 LYS 122 -36.185 -8.450 -12.686 987 HZ1 LYS 122 HZ1 LYS 122 -37.574 -6.736 -13.731 988 HZ2 LYS 122 HZ2 LYS 122 -36.230 -6.051 -14.412 989 HZ3 LYS 122 HZ3 LYS 122 -36.688 -7.559 -14.856 Start of MODEL 18 1 H1 GLY 1 H GLY 1 28.202 4.420 9.188 2 HA2 GLY 1 HA2 GLY 1 28.892 2.060 9.256 3 HA3 GLY 1 HA3 GLY 1 27.582 1.796 10.442 4 H SER 2 H SER 2 27.791 0.428 7.862 5 HA SER 2 HA SER 2 25.281 1.453 6.609 6 HB2 SER 2 HB2 SER 2 27.729 0.503 5.099 7 HB3 SER 2 HB3 SER 2 26.196 1.051 4.423 8 HG SER 2 HG SER 2 27.602 2.778 4.387 9 H ASN 3 H ASN 3 25.244 -0.494 8.563 10 HA ASN 3 HA ASN 3 25.169 -3.137 7.225 11 HB2 ASN 3 HB2 ASN 3 24.243 -2.269 10.011 12 HB3 ASN 3 HB3 ASN 3 24.221 -3.916 9.401 13 HD21 ASN 3 HD21 ASN 3 26.380 -1.260 10.285 14 HD22 ASN 3 HD22 ASN 3 27.790 -2.280 10.565 15 H GLN 4 H GLN 4 23.014 -4.357 7.550 16 HA GLN 4 HA GLN 4 20.855 -2.884 6.286 17 HB2 GLN 4 HB2 GLN 4 19.693 -4.980 6.306 18 HB3 GLN 4 HB3 GLN 4 21.386 -5.297 5.900 19 HG2 GLN 4 HG2 GLN 4 21.628 -5.596 8.522 20 HG3 GLN 4 HG3 GLN 4 19.876 -5.786 8.478 21 HE21 GLN 4 HE21 GLN 4 19.482 -8.070 8.722 22 HE22 GLN 4 HE22 GLN 4 20.457 -9.255 7.915 23 H GLN 5 H GLN 5 18.756 -2.389 7.228 24 HA GLN 5 HA GLN 5 18.931 -1.836 10.124 25 HB2 GLN 5 HB2 GLN 5 17.923 -0.125 8.560 26 HB3 GLN 5 HB3 GLN 5 16.649 -1.265 8.192 27 HG2 GLN 5 HG2 GLN 5 15.823 0.252 9.832 28 HG3 GLN 5 HG3 GLN 5 16.050 -1.294 10.646 29 HE21 GLN 5 HE21 GLN 5 17.611 -1.388 12.435 30 HE22 GLN 5 HE22 GLN 5 18.426 0.058 12.964 31 H LEU 6 H LEU 6 16.151 -3.230 8.212 32 HA LEU 6 HA LEU 6 16.511 -5.830 9.330 33 HB2 LEU 6 HB2 LEU 6 15.558 -4.451 11.264 34 HB3 LEU 6 HB3 LEU 6 14.084 -4.230 10.330 35 HG LEU 6 HG LEU 6 15.334 -6.946 10.784 36 HD11 LEU 6 HD11 LEU 6 15.049 -5.887 12.985 37 HD12 LEU 6 HD12 LEU 6 13.332 -5.587 12.620 38 HD13 LEU 6 HD13 LEU 6 13.952 -7.254 12.780 39 HD21 LEU 6 HD21 LEU 6 12.836 -7.671 10.736 40 HD22 LEU 6 HD22 LEU 6 12.514 -6.052 10.081 41 HD23 LEU 6 HD23 LEU 6 13.571 -7.198 9.211 42 H ASN 7 H ASN 7 16.126 -6.827 7.348 43 HA ASN 7 HA ASN 7 13.475 -6.521 6.211 44 HB2 ASN 7 HB2 ASN 7 14.751 -4.750 5.036 45 HB3 ASN 7 HB3 ASN 7 15.979 -5.930 4.573 46 HD21 ASN 7 HD21 ASN 7 12.340 -5.798 4.477 47 HD22 ASN 7 HD22 ASN 7 12.223 -6.210 2.774 48 H ALA 8 H ALA 8 13.170 -8.156 4.416 49 HA ALA 8 HA ALA 8 12.833 -10.310 4.034 50 HB1 ALA 8 HB1 ALA 8 14.435 -9.570 2.364 51 HB2 ALA 8 HB2 ALA 8 15.782 -10.093 3.406 52 HB3 ALA 8 HB3 ALA 8 14.639 -11.291 2.764 53 H THR 9 H THR 9 12.250 -11.110 5.955 54 HA THR 9 HA THR 9 14.059 -13.251 6.970 55 HB THR 9 HB THR 9 13.011 -12.821 9.276 56 HG1 THR 9 HG1 THR 9 11.512 -11.218 8.847 57 HG21 THR 9 HG21 THR 9 15.398 -12.366 8.551 58 HG22 THR 9 HG22 THR 9 14.912 -10.686 8.245 59 HG23 THR 9 HG23 THR 9 14.816 -11.361 9.886 60 H LYS 10 H LYS 10 10.581 -12.186 6.662 61 HA LYS 10 HA LYS 10 9.950 -14.952 5.996 62 HB2 LYS 10 HB2 LYS 10 10.014 -14.902 8.522 63 HB3 LYS 10 HB3 LYS 10 8.697 -13.725 8.488 64 HG2 LYS 10 HG2 LYS 10 7.183 -15.310 7.561 65 HG3 LYS 10 HG3 LYS 10 8.482 -16.465 7.197 66 HD2 LYS 10 HD2 LYS 10 8.803 -16.963 9.514 67 HD3 LYS 10 HD3 LYS 10 7.802 -15.586 10.027 68 HE2 LYS 10 HE2 LYS 10 5.809 -16.623 8.999 69 HE3 LYS 10 HE3 LYS 10 6.789 -17.994 8.441 70 HZ1 LYS 10 HZ1 LYS 10 6.324 -17.263 11.266 71 HZ2 LYS 10 HZ2 LYS 10 5.631 -18.532 10.486 72 HZ3 LYS 10 HZ3 LYS 10 7.236 -18.537 10.727 73 H LYS 11 H LYS 11 7.824 -15.208 5.199 74 HA LYS 11 HA LYS 11 5.947 -14.802 4.104 75 HB2 LYS 11 HB2 LYS 11 5.859 -12.067 5.347 76 HB3 LYS 11 HB3 LYS 11 4.558 -12.863 4.500 77 HG2 LYS 11 HG2 LYS 11 5.697 -13.519 7.234 78 HG3 LYS 11 HG3 LYS 11 4.083 -12.966 6.802 79 HD2 LYS 11 HD2 LYS 11 3.950 -15.242 5.447 80 HD3 LYS 11 HD3 LYS 11 5.290 -15.707 6.467 81 HE2 LYS 11 HE2 LYS 11 3.236 -16.478 7.459 82 HE3 LYS 11 HE3 LYS 11 3.933 -15.230 8.503 83 HZ1 LYS 11 HZ1 LYS 11 2.284 -13.714 7.764 84 HZ2 LYS 11 HZ2 LYS 11 1.823 -14.668 6.516 85 HZ3 LYS 11 HZ3 LYS 11 1.473 -15.120 8.062 86 H ASP 12 H ASP 12 6.031 -14.697 1.965 87 HA ASP 12 HA ASP 12 7.976 -13.246 0.545 88 HB2 ASP 12 HB2 ASP 12 7.037 -14.188 -1.370 89 HB3 ASP 12 HB3 ASP 12 6.761 -15.391 -0.112 90 H LYS 13 H LYS 13 4.647 -12.447 1.398 91 HA LYS 13 HA LYS 13 4.524 -10.179 -0.467 92 HB2 LYS 13 HB2 LYS 13 2.762 -10.831 1.949 93 HB3 LYS 13 HB3 LYS 13 2.388 -9.662 0.683 94 HG2 LYS 13 HG2 LYS 13 2.689 -12.669 0.324 95 HG3 LYS 13 HG3 LYS 13 1.155 -11.798 0.428 96 HD2 LYS 13 HD2 LYS 13 1.799 -10.498 -1.644 97 HD3 LYS 13 HD3 LYS 13 3.242 -11.516 -1.788 98 HE2 LYS 13 HE2 LYS 13 0.332 -12.388 -1.957 99 HE3 LYS 13 HE3 LYS 13 1.537 -12.370 -3.260 100 HZ1 LYS 13 HZ1 LYS 13 1.337 -14.585 -2.446 101 HZ2 LYS 13 HZ2 LYS 13 2.795 -14.033 -1.940 102 HZ3 LYS 13 HZ3 LYS 13 1.530 -14.138 -0.888 103 H LEU 14 H LEU 14 4.818 -10.618 3.066 104 HA LEU 14 HA LEU 14 5.075 -7.831 3.589 105 HB2 LEU 14 HB2 LEU 14 6.272 -10.021 5.302 106 HB3 LEU 14 HB3 LEU 14 5.822 -8.416 5.797 107 HG LEU 14 HG LEU 14 3.881 -10.577 4.875 108 HD11 LEU 14 HD11 LEU 14 3.107 -10.635 7.142 109 HD12 LEU 14 HD12 LEU 14 4.869 -10.851 7.156 110 HD13 LEU 14 HD13 LEU 14 4.173 -9.297 7.605 111 HD21 LEU 14 HD21 LEU 14 2.084 -9.046 5.458 112 HD22 LEU 14 HD22 LEU 14 3.257 -7.760 5.848 113 HD23 LEU 14 HD23 LEU 14 3.047 -8.345 4.183 114 H GLN 15 H GLN 15 7.569 -10.219 2.693 115 HA GLN 15 HA GLN 15 9.795 -8.623 3.394 116 HB2 GLN 15 HB2 GLN 15 10.013 -10.967 2.849 117 HB3 GLN 15 HB3 GLN 15 9.398 -10.718 1.220 118 HG2 GLN 15 HG2 GLN 15 11.333 -9.318 0.634 119 HG3 GLN 15 HG3 GLN 15 11.968 -9.464 2.260 120 HE21 GLN 15 HE21 GLN 15 11.621 -12.380 2.653 121 HE22 GLN 15 HE22 GLN 15 12.741 -13.092 1.513 122 H VAL 16 H VAL 16 8.000 -8.709 0.217 123 HA VAL 16 HA VAL 16 9.739 -6.701 -0.895 124 HB VAL 16 HB VAL 16 8.180 -6.592 -2.725 125 HG11 VAL 16 HG11 VAL 16 9.873 -8.405 -2.631 126 HG12 VAL 16 HG12 VAL 16 8.667 -9.475 -1.880 127 HG13 VAL 16 HG13 VAL 16 8.419 -8.873 -3.532 128 HG21 VAL 16 HG21 VAL 16 6.209 -7.964 -2.940 129 HG22 VAL 16 HG22 VAL 16 6.418 -8.603 -1.302 130 HG23 VAL 16 HG23 VAL 16 6.035 -6.881 -1.556 131 H ILE 17 H ILE 17 6.628 -6.481 0.856 132 HA ILE 17 HA ILE 17 6.351 -3.677 0.263 133 HB ILE 17 HB ILE 17 5.108 -5.088 2.624 134 HG12 ILE 17 HG12 ILE 17 3.850 -4.696 -0.141 135 HG13 ILE 17 HG13 ILE 17 4.585 -6.191 0.365 136 HG21 ILE 17 HG21 ILE 17 3.412 -3.284 2.414 137 HG22 ILE 17 HG22 ILE 17 5.013 -2.597 2.600 138 HG23 ILE 17 HG23 ILE 17 4.266 -2.626 1.005 139 HD11 ILE 17 HD11 ILE 17 2.981 -6.005 2.462 140 HD12 ILE 17 HD12 ILE 17 2.040 -4.957 1.353 141 HD13 ILE 17 HD13 ILE 17 2.403 -6.646 0.939 142 H ASP 18 H ASP 18 7.868 -5.515 2.877 143 HA ASP 18 HA ASP 18 8.545 -3.336 4.598 144 HB2 ASP 18 HB2 ASP 18 8.458 -5.693 5.234 145 HB3 ASP 18 HB3 ASP 18 9.778 -6.075 4.123 146 H TRP 19 H TRP 19 10.134 -4.774 1.751 147 HA TRP 19 HA TRP 19 12.591 -3.299 1.968 148 HB2 TRP 19 HB2 TRP 19 12.573 -5.309 0.663 149 HB3 TRP 19 HB3 TRP 19 11.190 -4.781 -0.287 150 HD1 TRP 19 HD1 TRP 19 11.617 -3.385 -2.440 151 HE1 TRP 19 HE1 TRP 19 13.604 -2.328 -3.543 152 HE3 TRP 19 HE3 TRP 19 15.153 -4.298 1.172 153 HZ2 TRP 19 HZ2 TRP 19 16.489 -2.103 -3.091 154 HZ3 TRP 19 HZ3 TRP 19 17.498 -3.614 0.802 155 HH2 TRP 19 HH2 TRP 19 18.166 -2.521 -1.341 156 H LEU 20 H LEU 20 9.669 -2.802 -0.125 157 HA LEU 20 HA LEU 20 10.649 -0.361 -1.190 158 HB2 LEU 20 HB2 LEU 20 8.460 0.093 -2.050 159 HB3 LEU 20 HB3 LEU 20 8.986 -1.548 -2.367 160 HG LEU 20 HG LEU 20 7.569 -2.005 -0.152 161 HD11 LEU 20 HD11 LEU 20 5.503 -0.722 -0.057 162 HD12 LEU 20 HD12 LEU 20 6.865 0.371 0.147 163 HD13 LEU 20 HD13 LEU 20 6.038 0.291 -1.416 164 HD21 LEU 20 HD21 LEU 20 6.293 -1.774 -2.889 165 HD22 LEU 20 HD22 LEU 20 7.218 -3.154 -2.251 166 HD23 LEU 20 HD23 LEU 20 5.674 -2.709 -1.525 167 H ILE 21 H ILE 21 8.911 -0.984 1.827 168 HA ILE 21 HA ILE 21 8.271 1.752 2.433 169 HB ILE 21 HB ILE 21 8.569 -0.784 4.058 170 HG12 ILE 21 HG12 ILE 21 6.129 1.007 3.708 171 HG13 ILE 21 HG13 ILE 21 6.518 -0.254 2.559 172 HG21 ILE 21 HG21 ILE 21 7.508 0.774 5.935 173 HG22 ILE 21 HG22 ILE 21 9.266 0.659 5.718 174 HG23 ILE 21 HG23 ILE 21 8.360 2.032 5.083 175 HD11 ILE 21 HD11 ILE 21 6.382 -1.921 4.462 176 HD12 ILE 21 HD12 ILE 21 5.836 -0.591 5.502 177 HD13 ILE 21 HD13 ILE 21 4.872 -1.035 4.118 178 H GLU 22 H GLU 22 11.148 -0.313 3.183 179 HA GLU 22 HA GLU 22 12.510 1.739 4.645 180 HB2 GLU 22 HB2 GLU 22 12.849 -0.790 4.736 181 HB3 GLU 22 HB3 GLU 22 13.724 -0.656 3.204 182 HG2 GLU 22 HG2 GLU 22 15.316 0.947 4.336 183 HG3 GLU 22 HG3 GLU 22 14.429 0.711 5.847 184 H ASN 23 H ASN 23 12.395 0.869 1.252 185 HA ASN 23 HA ASN 23 14.639 2.360 0.290 186 HB2 ASN 23 HB2 ASN 23 12.124 1.211 -0.922 187 HB3 ASN 23 HB3 ASN 23 13.047 2.363 -1.857 188 HD21 ASN 23 HD21 ASN 23 14.621 0.014 0.331 189 HD22 ASN 23 HD22 ASN 23 15.240 -0.982 -0.960 190 H PHE 24 H PHE 24 11.151 3.329 0.533 191 HA PHE 24 HA PHE 24 12.056 6.152 0.097 192 HB2 PHE 24 HB2 PHE 24 9.604 4.725 -0.907 193 HB3 PHE 24 HB3 PHE 24 9.625 6.465 -0.681 194 HD1 PHE 24 HD1 PHE 24 11.978 7.618 -1.633 195 HD2 PHE 24 HD2 PHE 24 9.904 4.160 -3.170 196 HE1 PHE 24 HE1 PHE 24 12.813 8.121 -3.895 197 HE2 PHE 24 HE2 PHE 24 10.751 4.684 -5.449 198 HZ PHE 24 HZ PHE 24 12.193 6.662 -5.812 199 HA PRO 25 HA PRO 25 10.250 5.829 4.290 200 HB2 PRO 25 HB2 PRO 25 12.192 7.096 5.714 201 HB3 PRO 25 HB3 PRO 25 12.372 5.414 5.139 202 HG2 PRO 25 HG2 PRO 25 13.396 7.948 3.808 203 HG3 PRO 25 HG3 PRO 25 14.329 6.470 4.236 204 HD2 PRO 25 HD2 PRO 25 13.268 6.832 1.751 205 HD3 PRO 25 HD3 PRO 25 13.305 5.219 2.521 206 H ASN 26 H ASN 26 10.042 8.125 1.983 207 HA ASN 26 HA ASN 26 9.949 10.473 3.655 208 HB2 ASN 26 HB2 ASN 26 8.857 10.182 0.876 209 HB3 ASN 26 HB3 ASN 26 8.976 11.665 1.826 210 HD21 ASN 26 HD21 ASN 26 10.767 9.224 0.288 211 HD22 ASN 26 HD22 ASN 26 12.415 9.903 0.378 212 H ALA 27 H ALA 27 7.772 7.880 2.806 213 HA ALA 27 HA ALA 27 5.768 8.644 4.735 214 HB1 ALA 27 HB1 ALA 27 5.247 8.774 1.701 215 HB2 ALA 27 HB2 ALA 27 3.965 8.739 2.938 216 HB3 ALA 27 HB3 ALA 27 5.083 10.120 2.826 217 H PHE 28 H PHE 28 5.531 6.543 5.511 218 HA PHE 28 HA PHE 28 4.321 4.512 4.141 219 HB2 PHE 28 HB2 PHE 28 7.289 4.378 3.916 220 HB3 PHE 28 HB3 PHE 28 6.504 2.926 4.483 221 HD1 PHE 28 HD1 PHE 28 4.050 2.585 3.016 222 HD2 PHE 28 HD2 PHE 28 7.829 4.101 1.621 223 HE1 PHE 28 HE1 PHE 28 3.439 2.006 0.675 224 HE2 PHE 28 HE2 PHE 28 7.221 3.539 -0.688 225 HZ PHE 28 HZ PHE 28 4.989 2.525 -1.178 226 H PHE 29 H PHE 29 4.115 2.527 5.657 227 HA PHE 29 HA PHE 29 4.991 3.035 8.436 228 HB2 PHE 29 HB2 PHE 29 2.139 2.716 7.540 229 HB3 PHE 29 HB3 PHE 29 2.739 2.650 9.204 230 HD1 PHE 29 HD1 PHE 29 1.832 4.885 6.460 231 HD2 PHE 29 HD2 PHE 29 3.709 4.660 10.330 232 HE1 PHE 29 HE1 PHE 29 1.615 7.338 6.715 233 HE2 PHE 29 HE2 PHE 29 3.386 7.091 10.632 234 HZ PHE 29 HZ PHE 29 2.325 8.433 8.832 235 H LYS 30 H LYS 30 5.126 1.056 9.651 236 HA LYS 30 HA LYS 30 4.473 -1.433 8.075 237 HB2 LYS 30 HB2 LYS 30 6.568 -1.325 10.229 238 HB3 LYS 30 HB3 LYS 30 6.226 -2.589 9.078 239 HG2 LYS 30 HG2 LYS 30 7.913 -1.737 7.833 240 HG3 LYS 30 HG3 LYS 30 6.737 -0.520 7.407 241 HD2 LYS 30 HD2 LYS 30 8.483 0.837 8.058 242 HD3 LYS 30 HD3 LYS 30 7.652 0.704 9.592 243 HE2 LYS 30 HE2 LYS 30 10.082 -0.916 8.633 244 HE3 LYS 30 HE3 LYS 30 10.109 0.417 9.780 245 HZ1 LYS 30 HZ1 LYS 30 8.708 -0.959 11.252 246 HZ2 LYS 30 HZ2 LYS 30 8.949 -2.242 10.239 247 HZ3 LYS 30 HZ3 LYS 30 10.211 -1.547 11.012 248 H LYS 31 H LYS 31 3.790 0.167 11.171 249 HA LYS 31 HA LYS 31 3.267 -2.236 12.667 250 HB2 LYS 31 HB2 LYS 31 2.993 0.692 12.999 251 HB3 LYS 31 HB3 LYS 31 1.685 -0.193 13.736 252 HG2 LYS 31 HG2 LYS 31 3.200 0.095 15.415 253 HG3 LYS 31 HG3 LYS 31 3.391 -1.597 14.967 254 HD2 LYS 31 HD2 LYS 31 5.505 -1.138 13.909 255 HD3 LYS 31 HD3 LYS 31 5.206 0.626 13.932 256 HE2 LYS 31 HE2 LYS 31 5.215 0.617 16.396 257 HE3 LYS 31 HE3 LYS 31 5.504 -1.128 16.407 258 HZ1 LYS 31 HZ1 LYS 31 7.512 0.243 16.730 259 HZ2 LYS 31 HZ2 LYS 31 7.646 -0.775 15.449 260 HZ3 LYS 31 HZ3 LYS 31 7.382 0.822 15.207 261 H GLY 32 H GLY 32 1.520 -1.157 10.001 262 HA2 GLY 32 HA2 GLY 32 -0.428 -1.732 9.060 263 HA3 GLY 32 HA3 GLY 32 -0.721 -2.903 10.358 264 H ASN 33 H ASN 33 -0.571 -0.777 12.432 265 HA ASN 33 HA ASN 33 -3.344 0.111 12.318 266 HB2 ASN 33 HB2 ASN 33 -2.993 0.678 14.656 267 HB3 ASN 33 HB3 ASN 33 -2.528 -0.972 14.314 268 HD21 ASN 33 HD21 ASN 33 -0.553 2.183 14.015 269 HD22 ASN 33 HD22 ASN 33 0.639 1.586 15.144 270 H GLN 34 H GLN 34 -0.384 1.628 11.443 271 HA GLN 34 HA GLN 34 -1.576 4.323 11.962 272 HB2 GLN 34 HB2 GLN 34 0.778 5.177 12.078 273 HB3 GLN 34 HB3 GLN 34 0.242 4.179 13.426 274 HG2 GLN 34 HG2 GLN 34 1.450 2.242 12.568 275 HG3 GLN 34 HG3 GLN 34 1.878 3.139 11.120 276 HE21 GLN 34 HE21 GLN 34 2.229 5.021 14.137 277 HE22 GLN 34 HE22 GLN 34 3.971 4.875 14.091 278 H VAL 35 H VAL 35 -1.491 2.208 9.667 279 HA VAL 35 HA VAL 35 -0.100 3.388 7.474 280 HB VAL 35 HB VAL 35 -1.818 2.184 6.037 281 HG11 VAL 35 HG11 VAL 35 -1.076 0.019 6.446 282 HG12 VAL 35 HG12 VAL 35 0.254 1.102 6.863 283 HG13 VAL 35 HG13 VAL 35 -0.751 0.350 8.148 284 HG21 VAL 35 HG21 VAL 35 -3.822 2.297 7.395 285 HG22 VAL 35 HG22 VAL 35 -3.376 0.592 7.177 286 HG23 VAL 35 HG23 VAL 35 -3.058 1.401 8.709 287 H LYS 36 H LYS 36 -0.900 4.647 5.689 288 HA LYS 36 HA LYS 36 -3.324 6.314 6.029 289 HB2 LYS 36 HB2 LYS 36 -0.405 7.164 5.754 290 HB3 LYS 36 HB3 LYS 36 -1.688 8.187 5.160 291 HG2 LYS 36 HG2 LYS 36 -2.684 8.267 7.456 292 HG3 LYS 36 HG3 LYS 36 -1.277 7.355 8.063 293 HD2 LYS 36 HD2 LYS 36 0.242 9.118 7.252 294 HD3 LYS 36 HD3 LYS 36 -1.118 9.960 6.489 295 HE2 LYS 36 HE2 LYS 36 -2.126 10.379 8.681 296 HE3 LYS 36 HE3 LYS 36 -0.771 9.576 9.488 297 HZ1 LYS 36 HZ1 LYS 36 -0.693 12.099 9.216 298 HZ2 LYS 36 HZ2 LYS 36 0.671 11.273 8.826 299 HZ3 LYS 36 HZ3 LYS 36 -0.306 11.824 7.638 300 HA PRO 37 HA PRO 37 -3.396 5.488 1.662 301 HB2 PRO 37 HB2 PRO 37 -4.444 7.706 0.480 302 HB3 PRO 37 HB3 PRO 37 -5.414 6.666 1.563 303 HG2 PRO 37 HG2 PRO 37 -3.909 9.209 2.305 304 HG3 PRO 37 HG3 PRO 37 -5.626 8.792 2.612 305 HD2 PRO 37 HD2 PRO 37 -3.697 8.445 4.488 306 HD3 PRO 37 HD3 PRO 37 -5.015 7.257 4.299 307 H LEU 38 H LEU 38 -2.495 6.187 -0.423 308 HA LEU 38 HA LEU 38 -0.214 8.091 -0.283 309 HB2 LEU 38 HB2 LEU 38 -0.165 5.223 -1.270 310 HB3 LEU 38 HB3 LEU 38 1.099 6.392 -1.569 311 HG LEU 38 HG LEU 38 0.285 5.657 1.264 312 HD11 LEU 38 HD11 LEU 38 0.934 3.605 0.078 313 HD12 LEU 38 HD12 LEU 38 2.479 4.359 -0.381 314 HD13 LEU 38 HD13 LEU 38 2.100 4.076 1.330 315 HD21 LEU 38 HD21 LEU 38 2.571 6.458 1.801 316 HD22 LEU 38 HD22 LEU 38 2.854 6.849 0.100 317 HD23 LEU 38 HD23 LEU 38 1.623 7.731 1.020 318 H LYS 39 H LYS 39 0.625 8.486 -2.511 319 HA LYS 39 HA LYS 39 -1.263 9.645 -4.157 320 HB2 LYS 39 HB2 LYS 39 1.315 9.806 -4.000 321 HB3 LYS 39 HB3 LYS 39 1.380 8.496 -5.167 322 HG2 LYS 39 HG2 LYS 39 0.040 11.192 -5.599 323 HG3 LYS 39 HG3 LYS 39 1.718 10.828 -5.988 324 HD2 LYS 39 HD2 LYS 39 0.759 8.982 -7.528 325 HD3 LYS 39 HD3 LYS 39 -0.781 9.845 -7.358 326 HE2 LYS 39 HE2 LYS 39 1.815 10.806 -8.574 327 HE3 LYS 39 HE3 LYS 39 0.225 10.685 -9.329 328 HZ1 LYS 39 HZ1 LYS 39 0.724 12.933 -8.889 329 HZ2 LYS 39 HZ2 LYS 39 -0.457 12.531 -7.811 330 HZ3 LYS 39 HZ3 LYS 39 1.178 12.649 -7.384 331 H ILE 40 H ILE 40 -2.392 8.985 -6.116 332 HA ILE 40 HA ILE 40 -3.186 6.264 -6.165 333 HB ILE 40 HB ILE 40 -4.636 8.097 -6.683 334 HG12 ILE 40 HG12 ILE 40 -5.054 5.867 -7.739 335 HG13 ILE 40 HG13 ILE 40 -5.840 7.273 -8.453 336 HG21 ILE 40 HG21 ILE 40 -4.453 9.385 -8.807 337 HG22 ILE 40 HG22 ILE 40 -3.171 9.736 -7.650 338 HG23 ILE 40 HG23 ILE 40 -2.847 8.671 -9.032 339 HD11 ILE 40 HD11 ILE 40 -5.079 5.764 -10.182 340 HD12 ILE 40 HD12 ILE 40 -4.242 7.319 -10.302 341 HD13 ILE 40 HD13 ILE 40 -3.401 5.917 -9.625 342 H GLY 41 H GLY 41 -2.328 4.635 -7.219 343 HA2 GLY 41 HA2 GLY 41 -0.945 3.382 -8.632 344 HA3 GLY 41 HA3 GLY 41 -0.729 4.849 -9.590 345 H ILE 42 H ILE 42 0.236 5.164 -6.240 346 HA ILE 42 HA ILE 42 2.798 5.959 -6.759 347 HB ILE 42 HB ILE 42 1.558 6.312 -4.674 348 HG12 ILE 42 HG12 ILE 42 4.307 5.157 -4.225 349 HG13 ILE 42 HG13 ILE 42 3.945 6.764 -4.817 350 HG21 ILE 42 HG21 ILE 42 2.230 3.419 -3.982 351 HG22 ILE 42 HG22 ILE 42 1.480 4.585 -2.904 352 HG23 ILE 42 HG23 ILE 42 0.613 4.060 -4.333 353 HD11 ILE 42 HD11 ILE 42 2.822 7.285 -2.666 354 HD12 ILE 42 HD12 ILE 42 3.284 5.664 -2.072 355 HD13 ILE 42 HD13 ILE 42 4.527 6.834 -2.467 356 H PHE 43 H PHE 43 1.795 2.579 -6.669 357 HA PHE 43 HA PHE 43 4.397 1.450 -6.145 358 HB2 PHE 43 HB2 PHE 43 2.804 -0.211 -5.998 359 HB3 PHE 43 HB3 PHE 43 1.808 0.494 -7.266 360 HD1 PHE 43 HD1 PHE 43 2.016 -0.080 -9.560 361 HD2 PHE 43 HD2 PHE 43 4.878 -1.607 -6.702 362 HE1 PHE 43 HE1 PHE 43 3.051 -1.423 -11.321 363 HE2 PHE 43 HE2 PHE 43 5.911 -2.974 -8.512 364 HZ PHE 43 HZ PHE 43 5.010 -2.893 -10.809 365 H ASP 44 H ASP 44 2.762 2.699 -9.070 366 HA ASP 44 HA ASP 44 4.689 1.638 -10.895 367 HB2 ASP 44 HB2 ASP 44 2.183 2.566 -11.190 368 HB3 ASP 44 HB3 ASP 44 3.061 4.033 -11.654 369 H ASP 45 H ASP 45 4.603 4.481 -8.916 370 HA ASP 45 HA ASP 45 6.675 5.957 -10.381 371 HB2 ASP 45 HB2 ASP 45 4.717 6.858 -8.935 372 HB3 ASP 45 HB3 ASP 45 5.665 6.392 -7.539 373 H LEU 46 H LEU 46 6.338 3.762 -7.737 374 HA LEU 46 HA LEU 46 8.964 3.941 -6.531 375 HB2 LEU 46 HB2 LEU 46 7.248 3.334 -5.046 376 HB3 LEU 46 HB3 LEU 46 6.463 2.307 -6.232 377 HG LEU 46 HG LEU 46 8.345 0.634 -5.985 378 HD11 LEU 46 HD11 LEU 46 9.960 2.244 -4.847 379 HD12 LEU 46 HD12 LEU 46 8.917 2.149 -3.410 380 HD13 LEU 46 HD13 LEU 46 9.738 0.699 -4.026 381 HD21 LEU 46 HD21 LEU 46 6.143 0.329 -5.095 382 HD22 LEU 46 HD22 LEU 46 7.430 -0.419 -4.144 383 HD23 LEU 46 HD23 LEU 46 6.665 1.077 -3.557 384 H ILE 47 H ILE 47 7.392 1.825 -8.903 385 HA ILE 47 HA ILE 47 9.157 -0.332 -8.849 386 HB ILE 47 HB ILE 47 6.936 0.100 -10.138 387 HG12 ILE 47 HG12 ILE 47 8.404 -2.016 -10.044 388 HG13 ILE 47 HG13 ILE 47 7.114 -1.859 -11.222 389 HG21 ILE 47 HG21 ILE 47 8.831 0.809 -12.433 390 HG22 ILE 47 HG22 ILE 47 7.047 0.678 -12.468 391 HG23 ILE 47 HG23 ILE 47 7.879 1.952 -11.552 392 HD11 ILE 47 HD11 ILE 47 9.931 -1.127 -12.040 393 HD12 ILE 47 HD12 ILE 47 9.395 -2.791 -12.002 394 HD13 ILE 47 HD13 ILE 47 8.546 -1.624 -13.025 395 H ASP 48 H ASP 48 9.603 2.859 -10.256 396 HA ASP 48 HA ASP 48 11.768 2.324 -11.965 397 HB2 ASP 48 HB2 ASP 48 10.767 4.751 -10.497 398 HB3 ASP 48 HB3 ASP 48 12.421 4.810 -11.093 399 H PHE 49 H PHE 49 11.605 2.467 -8.461 400 HA PHE 49 HA PHE 49 14.452 2.713 -8.099 401 HB2 PHE 49 HB2 PHE 49 12.432 3.268 -6.475 402 HB3 PHE 49 HB3 PHE 49 12.665 1.617 -5.936 403 HD1 PHE 49 HD1 PHE 49 12.789 3.507 -3.956 404 HD2 PHE 49 HD2 PHE 49 15.998 2.586 -6.692 405 HE1 PHE 49 HE1 PHE 49 14.404 4.580 -2.453 406 HE2 PHE 49 HE2 PHE 49 17.611 3.595 -5.141 407 HZ PHE 49 HZ PHE 49 16.819 4.619 -3.008 408 H TYR 50 H TYR 50 12.165 -0.051 -8.336 409 HA TYR 50 HA TYR 50 13.880 -2.140 -7.362 410 HB2 TYR 50 HB2 TYR 50 11.782 -3.012 -7.578 411 HB3 TYR 50 HB3 TYR 50 11.299 -1.873 -8.795 412 HD1 TYR 50 HD1 TYR 50 12.513 -5.272 -8.239 413 HD2 TYR 50 HD2 TYR 50 11.695 -2.267 -11.179 414 HE1 TYR 50 HE1 TYR 50 12.527 -7.019 -10.005 415 HE2 TYR 50 HE2 TYR 50 11.715 -3.964 -12.965 416 HH TYR 50 HH TYR 50 12.989 -7.135 -12.529 417 H GLU 51 H GLU 51 13.698 -0.401 -10.387 418 HA GLU 51 HA GLU 51 15.396 -2.219 -11.877 419 HB2 GLU 51 HB2 GLU 51 14.473 0.647 -12.412 420 HB3 GLU 51 HB3 GLU 51 15.345 -0.385 -13.557 421 HG2 GLU 51 HG2 GLU 51 13.293 -2.049 -12.873 422 HG3 GLU 51 HG3 GLU 51 12.505 -0.488 -12.678 423 H ARG 52 H ARG 52 16.147 0.019 -9.359 424 HA ARG 52 HA ARG 52 18.787 0.746 -10.462 425 HB2 ARG 52 HB2 ARG 52 17.470 1.364 -7.796 426 HB3 ARG 52 HB3 ARG 52 19.023 1.968 -8.317 427 HG2 ARG 52 HG2 ARG 52 17.035 2.433 -10.433 428 HG3 ARG 52 HG3 ARG 52 16.457 3.089 -8.912 429 HD2 ARG 52 HD2 ARG 52 19.272 3.596 -9.895 430 HD3 ARG 52 HD3 ARG 52 17.924 4.533 -10.520 431 HE ARG 52 HE ARG 52 19.184 4.808 -7.935 432 HH11 ARG 52 HH11 ARG 52 16.135 5.278 -9.700 433 HH12 ARG 52 HH12 ARG 52 15.551 6.538 -8.683 434 HH21 ARG 52 HH21 ARG 52 18.401 6.434 -6.494 435 HH22 ARG 52 HH22 ARG 52 16.838 7.146 -6.764 436 H LEU 53 H LEU 53 17.456 -1.783 -8.235 437 HA LEU 53 HA LEU 53 19.662 -2.395 -6.726 438 HB2 LEU 53 HB2 LEU 53 17.436 -4.019 -8.081 439 HB3 LEU 53 HB3 LEU 53 18.538 -4.673 -6.876 440 HG LEU 53 HG LEU 53 17.769 -2.968 -5.291 441 HD11 LEU 53 HD11 LEU 53 16.974 -1.149 -6.174 442 HD12 LEU 53 HD12 LEU 53 15.933 -2.020 -7.286 443 HD13 LEU 53 HD13 LEU 53 15.522 -1.927 -5.555 444 HD21 LEU 53 HD21 LEU 53 15.431 -4.561 -6.359 445 HD22 LEU 53 HD22 LEU 53 16.784 -5.317 -5.478 446 HD23 LEU 53 HD23 LEU 53 15.764 -4.143 -4.650 447 H ASP 54 H ASP 54 21.202 -4.030 -7.027 448 HA ASP 54 HA ASP 54 22.525 -3.994 -9.580 449 HB2 ASP 54 HB2 ASP 54 23.786 -4.361 -7.559 450 HB3 ASP 54 HB3 ASP 54 22.848 -5.805 -7.152 451 H THR 55 H THR 55 20.523 -6.401 -7.944 452 HA THR 55 HA THR 55 19.592 -7.582 -10.451 453 HB THR 55 HB THR 55 20.166 -9.904 -9.171 454 HG1 THR 55 HG1 THR 55 22.534 -8.355 -8.793 455 HG21 THR 55 HG21 THR 55 22.065 -8.516 -11.084 456 HG22 THR 55 HG22 THR 55 21.986 -10.253 -10.749 457 HG23 THR 55 HG23 THR 55 20.620 -9.439 -11.534 458 HA PRO 56 HA PRO 56 16.507 -7.091 -7.153 459 HB2 PRO 56 HB2 PRO 56 14.363 -6.720 -8.736 460 HB3 PRO 56 HB3 PRO 56 15.517 -5.408 -8.381 461 HG2 PRO 56 HG2 PRO 56 15.307 -7.101 -10.870 462 HG3 PRO 56 HG3 PRO 56 15.627 -5.346 -10.733 463 HD2 PRO 56 HD2 PRO 56 17.592 -7.247 -11.075 464 HD3 PRO 56 HD3 PRO 56 17.876 -5.697 -10.225 465 HA PRO 57 HA PRO 57 15.616 -11.508 -7.849 466 HB2 PRO 57 HB2 PRO 57 14.658 -12.190 -5.377 467 HB3 PRO 57 HB3 PRO 57 16.384 -11.934 -5.743 468 HG2 PRO 57 HG2 PRO 57 14.434 -9.971 -4.495 469 HG3 PRO 57 HG3 PRO 57 16.088 -10.374 -3.963 470 HD2 PRO 57 HD2 PRO 57 15.543 -8.184 -5.494 471 HD3 PRO 57 HD3 PRO 57 17.056 -9.114 -5.691 472 H PHE 58 H PHE 58 13.052 -10.122 -5.725 473 HA PHE 58 HA PHE 58 10.937 -11.560 -7.031 474 HB2 PHE 58 HB2 PHE 58 11.048 -9.255 -5.052 475 HB3 PHE 58 HB3 PHE 58 9.534 -9.739 -5.782 476 HD1 PHE 58 HD1 PHE 58 8.331 -11.677 -5.098 477 HD2 PHE 58 HD2 PHE 58 12.279 -10.937 -3.540 478 HE1 PHE 58 HE1 PHE 58 7.930 -13.336 -3.316 479 HE2 PHE 58 HE2 PHE 58 11.904 -12.677 -1.805 480 HZ PHE 58 HZ PHE 58 9.732 -13.853 -1.665 481 H SER 59 H SER 59 9.841 -11.034 -8.893 482 HA SER 59 HA SER 59 10.664 -8.672 -10.385 483 HB2 SER 59 HB2 SER 59 8.474 -10.728 -10.924 484 HB3 SER 59 HB3 SER 59 8.962 -9.440 -12.033 485 HG SER 59 HG SER 59 10.167 -11.013 -12.716 486 H LYS 60 H LYS 60 9.224 -7.021 -11.121 487 HA LYS 60 HA LYS 60 7.907 -5.590 -9.238 488 HB2 LYS 60 HB2 LYS 60 7.046 -4.216 -11.058 489 HB3 LYS 60 HB3 LYS 60 8.722 -4.719 -11.265 490 HG2 LYS 60 HG2 LYS 60 7.618 -6.639 -12.749 491 HG3 LYS 60 HG3 LYS 60 6.280 -5.514 -12.880 492 HD2 LYS 60 HD2 LYS 60 8.996 -4.337 -13.407 493 HD3 LYS 60 HD3 LYS 60 8.593 -5.630 -14.451 494 HE2 LYS 60 HE2 LYS 60 8.150 -3.306 -15.264 495 HE3 LYS 60 HE3 LYS 60 6.890 -4.508 -15.543 496 HZ1 LYS 60 HZ1 LYS 60 5.508 -3.478 -14.040 497 HZ2 LYS 60 HZ2 LYS 60 6.748 -2.642 -13.263 498 HZ3 LYS 60 HZ3 LYS 60 6.270 -2.218 -14.734 499 H LYS 61 H LYS 61 6.348 -8.208 -11.048 500 HA LYS 61 HA LYS 61 3.675 -7.353 -10.424 501 HB2 LYS 61 HB2 LYS 61 4.827 -10.029 -11.309 502 HB3 LYS 61 HB3 LYS 61 3.176 -9.894 -10.693 503 HG2 LYS 61 HG2 LYS 61 2.799 -9.594 -12.925 504 HG3 LYS 61 HG3 LYS 61 2.833 -7.959 -12.320 505 HD2 LYS 61 HD2 LYS 61 5.394 -8.063 -13.112 506 HD3 LYS 61 HD3 LYS 61 4.783 -9.406 -14.098 507 HE2 LYS 61 HE2 LYS 61 2.936 -7.771 -14.876 508 HE3 LYS 61 HE3 LYS 61 3.863 -6.495 -14.072 509 HZ1 LYS 61 HZ1 LYS 61 5.763 -7.284 -15.550 510 HZ2 LYS 61 HZ2 LYS 61 4.624 -8.103 -16.408 511 HZ3 LYS 61 HZ3 LYS 61 4.551 -6.474 -16.305 512 H SER 62 H SER 62 5.862 -9.690 -8.669 513 HA SER 62 HA SER 62 4.086 -10.176 -6.542 514 HB2 SER 62 HB2 SER 62 6.951 -10.534 -7.095 515 HB3 SER 62 HB3 SER 62 6.679 -10.062 -5.419 516 HG SER 62 HG SER 62 5.630 -11.823 -5.000 517 H LEU 63 H LEU 63 6.427 -7.496 -7.026 518 HA LEU 63 HA LEU 63 6.270 -6.253 -4.532 519 HB2 LEU 63 HB2 LEU 63 7.660 -5.715 -6.723 520 HB3 LEU 63 HB3 LEU 63 6.325 -4.659 -7.103 521 HG LEU 63 HG LEU 63 6.783 -3.788 -4.591 522 HD11 LEU 63 HD11 LEU 63 9.038 -3.848 -3.930 523 HD12 LEU 63 HD12 LEU 63 8.715 -5.524 -4.443 524 HD13 LEU 63 HD13 LEU 63 9.593 -4.429 -5.507 525 HD21 LEU 63 HD21 LEU 63 8.341 -2.058 -5.568 526 HD22 LEU 63 HD22 LEU 63 8.425 -3.000 -7.056 527 HD23 LEU 63 HD23 LEU 63 6.894 -2.283 -6.535 528 H ARG 64 H ARG 64 4.252 -5.620 -7.442 529 HA ARG 64 HA ARG 64 2.519 -3.840 -6.060 530 HB2 ARG 64 HB2 ARG 64 2.854 -3.858 -8.529 531 HB3 ARG 64 HB3 ARG 64 2.044 -5.408 -8.649 532 HG2 ARG 64 HG2 ARG 64 0.698 -3.391 -9.312 533 HG3 ARG 64 HG3 ARG 64 -0.084 -4.447 -8.147 534 HD2 ARG 64 HD2 ARG 64 0.025 -2.934 -6.423 535 HD3 ARG 64 HD3 ARG 64 1.507 -2.177 -7.017 536 HE ARG 64 HE ARG 64 -0.336 -1.499 -8.919 537 HH11 ARG 64 HH11 ARG 64 0.024 -1.000 -5.441 538 HH12 ARG 64 HH12 ARG 64 -1.106 0.307 -5.352 539 HH21 ARG 64 HH21 ARG 64 -1.747 0.370 -8.837 540 HH22 ARG 64 HH22 ARG 64 -1.939 1.248 -7.343 541 H GLU 65 H GLU 65 2.136 -7.327 -6.822 542 HA GLU 65 HA GLU 65 -0.534 -7.648 -5.965 543 HB2 GLU 65 HB2 GLU 65 1.914 -9.463 -5.999 544 HB3 GLU 65 HB3 GLU 65 0.359 -10.054 -5.415 545 HG2 GLU 65 HG2 GLU 65 0.617 -8.772 -8.152 546 HG3 GLU 65 HG3 GLU 65 0.952 -10.477 -7.890 547 H ALA 66 H ALA 66 2.502 -7.565 -4.146 548 HA ALA 66 HA ALA 66 1.289 -8.292 -1.619 549 HB1 ALA 66 HB1 ALA 66 3.948 -6.974 -2.255 550 HB2 ALA 66 HB2 ALA 66 3.507 -7.810 -0.749 551 HB3 ALA 66 HB3 ALA 66 3.684 -8.730 -2.252 552 H LEU 67 H LEU 67 2.527 -5.176 -3.041 553 HA LEU 67 HA LEU 67 1.876 -3.560 -0.856 554 HB2 LEU 67 HB2 LEU 67 3.018 -3.097 -3.273 555 HB3 LEU 67 HB3 LEU 67 1.453 -2.357 -3.565 556 HG LEU 67 HG LEU 67 3.458 -1.704 -1.353 557 HD11 LEU 67 HD11 LEU 67 2.522 -0.018 -3.716 558 HD12 LEU 67 HD12 LEU 67 3.786 0.391 -2.551 559 HD13 LEU 67 HD13 LEU 67 4.043 -0.946 -3.667 560 HD21 LEU 67 HD21 LEU 67 2.027 0.310 -0.889 561 HD22 LEU 67 HD22 LEU 67 0.742 -0.418 -1.872 562 HD23 LEU 67 HD23 LEU 67 1.307 -1.215 -0.382 563 H SER 68 H SER 68 -0.377 -4.593 -3.536 564 HA SER 68 HA SER 68 -2.439 -2.870 -2.737 565 HB2 SER 68 HB2 SER 68 -3.962 -4.744 -3.725 566 HB3 SER 68 HB3 SER 68 -2.898 -3.757 -4.718 567 HG SER 68 HG SER 68 -2.635 -6.452 -3.992 568 H TYR 69 H TYR 69 -1.422 -5.935 -1.231 569 HA TYR 69 HA TYR 69 -3.787 -6.282 0.348 570 HB2 TYR 69 HB2 TYR 69 -1.035 -7.453 0.356 571 HB3 TYR 69 HB3 TYR 69 -1.837 -7.396 1.902 572 HD1 TYR 69 HD1 TYR 69 -4.264 -8.262 2.066 573 HD2 TYR 69 HD2 TYR 69 -1.507 -9.299 -1.097 574 HE1 TYR 69 HE1 TYR 69 -5.560 -10.321 1.622 575 HE2 TYR 69 HE2 TYR 69 -2.835 -11.340 -1.574 576 HH TYR 69 HH TYR 69 -4.616 -12.747 -0.810 577 H TYR 70 H TYR 70 -0.886 -4.221 0.813 578 HA TYR 70 HA TYR 70 -1.419 -3.709 3.626 579 HB2 TYR 70 HB2 TYR 70 0.445 -2.688 1.574 580 HB3 TYR 70 HB3 TYR 70 -0.188 -1.421 2.608 581 HD1 TYR 70 HD1 TYR 70 0.762 -5.012 3.313 582 HD2 TYR 70 HD2 TYR 70 1.458 -0.837 4.168 583 HE1 TYR 70 HE1 TYR 70 2.490 -5.639 5.001 584 HE2 TYR 70 HE2 TYR 70 3.212 -1.488 5.779 585 HH TYR 70 HH TYR 70 4.480 -4.647 6.125 586 H SER 71 H SER 71 -2.279 -2.110 0.556 587 HA SER 71 HA SER 71 -3.991 -0.146 1.840 588 HB2 SER 71 HB2 SER 71 -4.906 -0.023 -0.613 589 HB3 SER 71 HB3 SER 71 -3.321 0.612 -0.154 590 HG SER 71 HG SER 71 -3.714 -2.011 -1.182 591 H ALA 72 H ALA 72 -4.469 -3.397 1.779 592 HA ALA 72 HA ALA 72 -7.429 -3.229 1.583 593 HB1 ALA 72 HB1 ALA 72 -7.418 -5.503 0.982 594 HB2 ALA 72 HB2 ALA 72 -6.116 -4.817 0.005 595 HB3 ALA 72 HB3 ALA 72 -5.737 -5.753 1.472 596 H SER 73 H SER 73 -4.961 -2.969 3.707 597 HA SER 73 HA SER 73 -5.588 -4.924 5.713 598 HB2 SER 73 HB2 SER 73 -4.197 -3.575 7.233 599 HB3 SER 73 HB3 SER 73 -3.418 -3.892 5.692 600 HG SER 73 HG SER 73 -3.781 -1.811 5.072 601 HA PRO 74 HA PRO 74 -9.216 -3.399 7.469 602 HB2 PRO 74 HB2 PRO 74 -8.800 -3.558 10.239 603 HB3 PRO 74 HB3 PRO 74 -9.372 -4.873 9.155 604 HG2 PRO 74 HG2 PRO 74 -6.655 -4.382 10.317 605 HG3 PRO 74 HG3 PRO 74 -7.410 -5.936 9.861 606 HD2 PRO 74 HD2 PRO 74 -5.475 -4.615 8.394 607 HD3 PRO 74 HD3 PRO 74 -6.626 -5.752 7.679 608 H ALA 75 H ALA 75 -6.442 -2.085 9.405 609 HA ALA 75 HA ALA 75 -7.697 0.246 10.252 610 HB1 ALA 75 HB1 ALA 75 -4.799 -0.215 9.510 611 HB2 ALA 75 HB2 ALA 75 -5.394 1.114 10.522 612 HB3 ALA 75 HB3 ALA 75 -5.554 -0.567 11.083 613 H TYR 76 H TYR 76 -5.845 -0.173 7.169 614 HA TYR 76 HA TYR 76 -5.947 2.539 6.372 615 HB2 TYR 76 HB2 TYR 76 -4.532 0.842 5.268 616 HB3 TYR 76 HB3 TYR 76 -5.942 -0.052 4.751 617 HD1 TYR 76 HD1 TYR 76 -3.485 2.427 3.733 618 HD2 TYR 76 HD2 TYR 76 -7.530 1.037 3.052 619 HE1 TYR 76 HE1 TYR 76 -3.444 3.361 1.480 620 HE2 TYR 76 HE2 TYR 76 -7.517 2.064 0.830 621 HH TYR 76 HH TYR 76 -6.259 3.166 -0.748 622 H LEU 77 H LEU 77 -8.322 -0.055 5.793 623 HA LEU 77 HA LEU 77 -10.069 1.719 4.286 624 HB2 LEU 77 HB2 LEU 77 -10.596 -1.019 5.488 625 HB3 LEU 77 HB3 LEU 77 -11.600 -0.203 4.295 626 HG LEU 77 HG LEU 77 -8.674 -0.842 3.710 627 HD11 LEU 77 HD11 LEU 77 -11.063 -2.624 3.403 628 HD12 LEU 77 HD12 LEU 77 -9.485 -2.917 2.633 629 HD13 LEU 77 HD13 LEU 77 -9.638 -2.893 4.399 630 HD21 LEU 77 HD21 LEU 77 -9.586 0.751 2.184 631 HD22 LEU 77 HD22 LEU 77 -9.394 -0.807 1.375 632 HD23 LEU 77 HD23 LEU 77 -11.006 -0.243 1.901 633 H SER 78 H SER 78 -10.200 0.234 7.528 634 HA SER 78 HA SER 78 -12.570 1.331 8.480 635 HB2 SER 78 HB2 SER 78 -11.101 -0.498 9.436 636 HB3 SER 78 HB3 SER 78 -10.069 0.762 10.120 637 HG SER 78 HG SER 78 -11.464 1.004 11.674 638 H CYS 79 H CYS 79 -9.472 2.915 8.083 639 HA CYS 79 HA CYS 79 -9.974 5.122 9.860 640 HB2 CYS 79 HB2 CYS 79 -7.757 4.245 9.127 641 HB3 CYS 79 HB3 CYS 79 -8.087 4.812 7.479 642 HG CYS 79 HG CYS 79 -7.852 6.514 10.319 643 H GLN 80 H GLN 80 -11.211 4.305 6.779 644 HA GLN 80 HA GLN 80 -11.670 5.958 4.975 645 HB2 GLN 80 HB2 GLN 80 -14.164 5.688 5.105 646 HB3 GLN 80 HB3 GLN 80 -13.214 4.230 5.086 647 HG2 GLN 80 HG2 GLN 80 -13.623 3.732 7.361 648 HG3 GLN 80 HG3 GLN 80 -14.166 5.361 7.731 649 HE21 GLN 80 HE21 GLN 80 -16.146 6.039 6.146 650 HE22 GLN 80 HE22 GLN 80 -17.419 4.838 6.066 651 H LYS 81 H LYS 81 -10.749 8.059 5.635 652 HA LYS 81 HA LYS 81 -12.876 9.918 6.349 653 HB2 LYS 81 HB2 LYS 81 -11.499 11.226 7.755 654 HB3 LYS 81 HB3 LYS 81 -11.694 9.595 8.369 655 HG2 LYS 81 HG2 LYS 81 -9.332 9.131 7.378 656 HG3 LYS 81 HG3 LYS 81 -9.240 10.877 7.081 657 HD2 LYS 81 HD2 LYS 81 -8.121 10.386 9.151 658 HD3 LYS 81 HD3 LYS 81 -9.596 11.305 9.499 659 HE2 LYS 81 HE2 LYS 81 -10.757 9.130 10.043 660 HE3 LYS 81 HE3 LYS 81 -9.254 8.274 9.728 661 HZ1 LYS 81 HZ1 LYS 81 -9.796 10.237 11.846 662 HZ2 LYS 81 HZ2 LYS 81 -9.479 8.651 12.029 663 HZ3 LYS 81 HZ3 LYS 81 -8.262 9.619 11.537 664 HA PRO 82 HA PRO 82 -11.031 11.645 2.602 665 HB2 PRO 82 HB2 PRO 82 -12.810 13.663 2.201 666 HB3 PRO 82 HB3 PRO 82 -13.223 11.956 1.902 667 HG2 PRO 82 HG2 PRO 82 -13.889 13.644 4.316 668 HG3 PRO 82 HG3 PRO 82 -14.930 12.502 3.414 669 HD2 PRO 82 HD2 PRO 82 -13.559 11.870 5.763 670 HD3 PRO 82 HD3 PRO 82 -13.995 10.644 4.537 671 H ASP 83 H ASP 83 -10.419 14.108 2.185 672 HA ASP 83 HA ASP 83 -9.062 15.896 2.832 673 HB2 ASP 83 HB2 ASP 83 -11.183 16.705 3.675 674 HB3 ASP 83 HB3 ASP 83 -10.877 15.965 5.251 675 H THR 84 H THR 84 -7.480 13.950 3.019 676 HA THR 84 HA THR 84 -6.132 14.239 5.656 677 HB THR 84 HB THR 84 -7.403 11.993 5.097 678 HG1 THR 84 HG1 THR 84 -6.241 12.201 6.920 679 HG21 THR 84 HG21 THR 84 -6.109 11.702 2.887 680 HG22 THR 84 HG22 THR 84 -4.692 11.316 3.887 681 HG23 THR 84 HG23 THR 84 -6.172 10.329 4.010 682 H ALA 85 H ALA 85 -5.835 14.515 2.261 683 HA ALA 85 HA ALA 85 -4.132 15.160 0.893 684 HB1 ALA 85 HB1 ALA 85 -2.665 15.999 3.412 685 HB2 ALA 85 HB2 ALA 85 -2.302 16.485 1.744 686 HB3 ALA 85 HB3 ALA 85 -3.827 16.975 2.505 687 H ARG 86 H ARG 86 -3.661 13.304 -0.065 688 HA ARG 86 HA ARG 86 -1.992 11.309 1.268 689 HB2 ARG 86 HB2 ARG 86 -2.573 11.441 -1.705 690 HB3 ARG 86 HB3 ARG 86 -2.148 10.034 -0.748 691 HG2 ARG 86 HG2 ARG 86 -4.345 10.155 0.379 692 HG3 ARG 86 HG3 ARG 86 -4.784 11.597 -0.525 693 HD2 ARG 86 HD2 ARG 86 -4.070 8.952 -1.822 694 HD3 ARG 86 HD3 ARG 86 -5.711 9.449 -1.431 695 HE ARG 86 HE ARG 86 -4.629 11.552 -2.921 696 HH11 ARG 86 HH11 ARG 86 -5.386 8.110 -3.371 697 HH12 ARG 86 HH12 ARG 86 -5.914 8.292 -5.015 698 HH21 ARG 86 HH21 ARG 86 -5.151 11.740 -5.286 699 HH22 ARG 86 HH22 ARG 86 -5.689 10.337 -6.097 700 H VAL 87 H VAL 87 0.115 10.584 0.099 701 HA VAL 87 HA VAL 87 1.661 12.808 -0.995 702 HB VAL 87 HB VAL 87 3.537 12.107 0.596 703 HG11 VAL 87 HG11 VAL 87 1.133 13.469 1.867 704 HG12 VAL 87 HG12 VAL 87 2.812 13.530 2.448 705 HG13 VAL 87 HG13 VAL 87 2.399 14.245 0.889 706 HG21 VAL 87 HG21 VAL 87 2.955 11.120 2.730 707 HG22 VAL 87 HG22 VAL 87 1.255 10.961 2.274 708 HG23 VAL 87 HG23 VAL 87 2.501 10.002 1.431 709 H ASP 88 H ASP 88 3.656 12.055 -1.982 710 HA ASP 88 HA ASP 88 3.357 9.383 -3.203 711 HB2 ASP 88 HB2 ASP 88 4.395 10.208 -5.070 712 HB3 ASP 88 HB3 ASP 88 3.415 11.579 -4.561 713 H ILE 89 H ILE 89 5.841 8.824 -4.055 714 HA ILE 89 HA ILE 89 7.125 7.722 -1.762 715 HB ILE 89 HB ILE 89 9.017 7.356 -3.518 716 HG12 ILE 89 HG12 ILE 89 6.858 8.131 -5.528 717 HG13 ILE 89 HG13 ILE 89 8.179 9.210 -5.083 718 HG21 ILE 89 HG21 ILE 89 7.875 5.467 -4.449 719 HG22 ILE 89 HG22 ILE 89 7.301 5.694 -2.788 720 HG23 ILE 89 HG23 ILE 89 6.292 6.217 -4.163 721 HD11 ILE 89 HD11 ILE 89 8.523 6.459 -6.355 722 HD12 ILE 89 HD12 ILE 89 8.707 8.041 -7.140 723 HD13 ILE 89 HD13 ILE 89 9.826 7.573 -5.876 724 H TYR 90 H TYR 90 7.556 10.823 -3.373 725 HA TYR 90 HA TYR 90 10.168 11.329 -2.127 726 HB2 TYR 90 HB2 TYR 90 8.311 13.167 -3.669 727 HB3 TYR 90 HB3 TYR 90 9.998 13.438 -3.325 728 HD1 TYR 90 HD1 TYR 90 10.738 10.343 -4.213 729 HD2 TYR 90 HD2 TYR 90 8.530 13.595 -6.017 730 HE1 TYR 90 HE1 TYR 90 11.411 9.583 -6.457 731 HE2 TYR 90 HE2 TYR 90 9.179 12.804 -8.251 732 HH TYR 90 HH TYR 90 9.972 10.846 -9.367 733 H GLY 91 H GLY 91 6.851 11.445 -1.263 734 HA2 GLY 91 HA2 GLY 91 5.949 12.036 0.764 735 HA3 GLY 91 HA3 GLY 91 7.395 12.963 1.189 736 H ASN 92 H ASN 92 6.373 13.842 -2.010 737 HA ASN 92 HA ASN 92 5.615 16.441 -0.966 738 HB2 ASN 92 HB2 ASN 92 5.056 17.057 -3.249 739 HB3 ASN 92 HB3 ASN 92 6.715 16.489 -3.095 740 HD21 ASN 92 HD21 ASN 92 7.315 14.851 -4.397 741 HD22 ASN 92 HD22 ASN 92 6.250 13.842 -5.310 742 H GLU 93 H GLU 93 3.574 17.433 -1.132 743 HA GLU 93 HA GLU 93 1.435 15.645 -0.486 744 HB2 GLU 93 HB2 GLU 93 2.016 18.608 -0.508 745 HB3 GLU 93 HB3 GLU 93 0.346 18.061 -0.453 746 HG2 GLU 93 HG2 GLU 93 0.778 16.678 1.527 747 HG3 GLU 93 HG3 GLU 93 2.499 17.074 1.458 748 H VAL 94 H VAL 94 -0.282 15.176 -1.493 749 HA VAL 94 HA VAL 94 -0.890 16.208 -4.137 750 HB VAL 94 HB VAL 94 -1.374 14.121 -5.066 751 HG11 VAL 94 HG11 VAL 94 0.914 13.205 -5.274 752 HG12 VAL 94 HG12 VAL 94 0.998 14.960 -5.194 753 HG13 VAL 94 HG13 VAL 94 1.423 14.006 -3.786 754 HG21 VAL 94 HG21 VAL 94 -1.999 13.079 -2.824 755 HG22 VAL 94 HG22 VAL 94 -1.243 12.031 -4.032 756 HG23 VAL 94 HG23 VAL 94 -0.271 12.651 -2.680 757 H ASP 95 H ASP 95 -3.419 15.248 -4.529 758 HA ASP 95 HA ASP 95 -4.739 16.941 -2.627 759 HB2 ASP 95 HB2 ASP 95 -6.269 15.004 -4.365 760 HB3 ASP 95 HB3 ASP 95 -6.675 16.649 -3.960 761 H VAL 96 H VAL 96 -7.078 15.984 -1.976 762 HA VAL 96 HA VAL 96 -6.494 13.732 -0.136 763 HB VAL 96 HB VAL 96 -7.968 14.739 1.343 764 HG11 VAL 96 HG11 VAL 96 -5.929 16.212 1.056 765 HG12 VAL 96 HG12 VAL 96 -6.851 17.236 -0.039 766 HG13 VAL 96 HG13 VAL 96 -7.344 17.063 1.644 767 HG21 VAL 96 HG21 VAL 96 -9.077 16.458 -0.936 768 HG22 VAL 96 HG22 VAL 96 -9.935 15.211 -0.007 769 HG23 VAL 96 HG23 VAL 96 -9.479 16.719 0.767 770 H VAL 97 H VAL 97 -8.258 12.366 0.429 771 HA VAL 97 HA VAL 97 -9.521 11.361 -2.026 772 HB VAL 97 HB VAL 97 -9.942 10.344 0.806 773 HG11 VAL 97 HG11 VAL 97 -10.529 8.220 -0.260 774 HG12 VAL 97 HG12 VAL 97 -11.622 9.495 -0.790 775 HG13 VAL 97 HG13 VAL 97 -10.328 8.947 -1.871 776 HG21 VAL 97 HG21 VAL 97 -8.206 8.616 0.115 777 HG22 VAL 97 HG22 VAL 97 -7.897 9.592 -1.336 778 HG23 VAL 97 HG23 VAL 97 -7.539 10.235 0.291 779 H THR 98 H THR 98 -11.786 11.342 -2.565 780 HA THR 98 HA THR 98 -13.251 13.646 -1.530 781 HB THR 98 HB THR 98 -14.987 12.789 -3.171 782 HG1 THR 98 HG1 THR 98 -13.616 11.272 -4.703 783 HG21 THR 98 HG21 THR 98 -13.276 14.519 -3.721 784 HG22 THR 98 HG22 THR 98 -12.205 13.233 -4.315 785 HG23 THR 98 HG23 THR 98 -13.762 13.550 -5.113 786 HA PRO 99 HA PRO 99 -15.493 11.511 1.601 787 HB2 PRO 99 HB2 PRO 99 -18.107 12.402 1.373 788 HB3 PRO 99 HB3 PRO 99 -16.769 13.369 2.062 789 HG2 PRO 99 HG2 PRO 99 -17.872 13.456 -0.759 790 HG3 PRO 99 HG3 PRO 99 -17.489 14.827 0.325 791 HD2 PRO 99 HD2 PRO 99 -15.758 14.040 -1.597 792 HD3 PRO 99 HD3 PRO 99 -15.144 14.542 0.002 793 H GLU 100 H GLU 100 -16.763 11.389 -1.657 794 HA GLU 100 HA GLU 100 -18.527 9.186 -1.442 795 HB2 GLU 100 HB2 GLU 100 -17.003 10.622 -3.631 796 HB3 GLU 100 HB3 GLU 100 -17.813 9.107 -4.005 797 HG2 GLU 100 HG2 GLU 100 -19.231 11.393 -2.617 798 HG3 GLU 100 HG3 GLU 100 -19.145 11.242 -4.386 799 H GLN 101 H GLN 101 -15.051 9.442 -2.449 800 HA GLN 101 HA GLN 101 -14.904 6.549 -2.761 801 HB2 GLN 101 HB2 GLN 101 -12.831 8.721 -3.024 802 HB3 GLN 101 HB3 GLN 101 -12.586 6.969 -3.340 803 HG2 GLN 101 HG2 GLN 101 -14.502 7.060 -4.974 804 HG3 GLN 101 HG3 GLN 101 -14.568 8.809 -4.777 805 HE21 GLN 101 HE21 GLN 101 -14.169 7.475 -7.308 806 HE22 GLN 101 HE22 GLN 101 -12.554 7.971 -7.825 807 H ALA 102 H ALA 102 -14.060 8.911 -0.247 808 HA ALA 102 HA ALA 102 -12.407 7.216 1.318 809 HB1 ALA 102 HB1 ALA 102 -12.533 9.643 1.727 810 HB2 ALA 102 HB2 ALA 102 -14.238 9.521 2.202 811 HB3 ALA 102 HB3 ALA 102 -12.978 8.757 3.190 812 H LYS 103 H LYS 103 -15.991 7.811 1.539 813 HA LYS 103 HA LYS 103 -16.325 5.822 3.573 814 HB2 LYS 103 HB2 LYS 103 -18.648 6.087 3.322 815 HB3 LYS 103 HB3 LYS 103 -17.959 7.680 3.027 816 HG2 LYS 103 HG2 LYS 103 -18.160 7.255 0.562 817 HG3 LYS 103 HG3 LYS 103 -18.969 5.720 0.897 818 HD2 LYS 103 HD2 LYS 103 -19.979 8.448 1.773 819 HD3 LYS 103 HD3 LYS 103 -20.495 7.574 0.316 820 HE2 LYS 103 HE2 LYS 103 -21.436 5.766 1.591 821 HE3 LYS 103 HE3 LYS 103 -20.726 6.368 3.098 822 HZ1 LYS 103 HZ1 LYS 103 -22.173 8.231 3.043 823 HZ2 LYS 103 HZ2 LYS 103 -22.816 7.802 1.581 824 HZ3 LYS 103 HZ3 LYS 103 -23.063 6.864 2.917 825 H TYR 104 H TYR 104 -16.160 5.538 0.082 826 HA TYR 104 HA TYR 104 -17.376 3.052 -0.249 827 HB2 TYR 104 HB2 TYR 104 -15.722 4.835 -1.869 828 HB3 TYR 104 HB3 TYR 104 -15.365 3.158 -2.197 829 HD1 TYR 104 HD1 TYR 104 -18.485 5.186 -1.513 830 HD2 TYR 104 HD2 TYR 104 -16.499 2.313 -4.027 831 HE1 TYR 104 HE1 TYR 104 -20.523 5.029 -2.917 832 HE2 TYR 104 HE2 TYR 104 -18.557 2.059 -5.377 833 HH TYR 104 HH TYR 104 -20.781 2.708 -5.660 834 H ALA 105 H ALA 105 -14.204 3.824 1.070 835 HA ALA 105 HA ALA 105 -12.738 1.451 0.668 836 HB1 ALA 105 HB1 ALA 105 -12.895 3.227 3.128 837 HB2 ALA 105 HB2 ALA 105 -11.583 2.118 2.718 838 HB3 ALA 105 HB3 ALA 105 -11.890 3.535 1.700 839 H TYR 106 H TYR 106 -15.487 2.073 2.868 840 HA TYR 106 HA TYR 106 -15.238 -0.113 4.557 841 HB2 TYR 106 HB2 TYR 106 -17.246 0.502 5.307 842 HB3 TYR 106 HB3 TYR 106 -17.023 1.921 4.329 843 HD1 TYR 106 HD1 TYR 106 -17.953 1.619 1.732 844 HD2 TYR 106 HD2 TYR 106 -19.071 -0.902 5.060 845 HE1 TYR 106 HE1 TYR 106 -19.982 0.884 0.509 846 HE2 TYR 106 HE2 TYR 106 -21.026 -1.703 3.807 847 HH TYR 106 HH TYR 106 -22.013 -0.456 0.666 848 H GLN 107 H GLN 107 -16.394 -0.087 1.211 849 HA GLN 107 HA GLN 107 -17.751 -2.553 1.135 850 HB2 GLN 107 HB2 GLN 107 -15.986 -1.224 -0.989 851 HB3 GLN 107 HB3 GLN 107 -17.026 -2.610 -1.285 852 HG2 GLN 107 HG2 GLN 107 -18.994 -1.222 -0.526 853 HG3 GLN 107 HG3 GLN 107 -17.919 0.190 -0.550 854 HE21 GLN 107 HE21 GLN 107 -16.403 -0.147 -2.928 855 HE22 GLN 107 HE22 GLN 107 -17.516 -0.273 -4.268 856 H ARG 108 H ARG 108 -14.331 -1.758 0.865 857 HA ARG 108 HA ARG 108 -13.430 -4.432 0.263 858 HB2 ARG 108 HB2 ARG 108 -11.759 -2.164 1.331 859 HB3 ARG 108 HB3 ARG 108 -11.264 -3.439 0.238 860 HG2 ARG 108 HG2 ARG 108 -13.058 -1.017 -0.357 861 HG3 ARG 108 HG3 ARG 108 -11.427 -1.326 -0.951 862 HD2 ARG 108 HD2 ARG 108 -13.959 -2.882 -1.657 863 HD3 ARG 108 HD3 ARG 108 -13.076 -1.796 -2.720 864 HE ARG 108 HE ARG 108 -12.602 -4.555 -2.226 865 HH11 ARG 108 HH11 ARG 108 -10.903 -1.557 -3.184 866 HH12 ARG 108 HH12 ARG 108 -9.692 -2.446 -4.059 867 HH21 ARG 108 HH21 ARG 108 -10.766 -5.639 -3.069 868 HH22 ARG 108 HH22 ARG 108 -9.566 -4.728 -3.935 869 H TYR 109 H TYR 109 -13.929 -2.528 3.236 870 HA TYR 109 HA TYR 109 -12.325 -4.238 4.939 871 HB2 TYR 109 HB2 TYR 109 -12.927 -1.919 5.507 872 HB3 TYR 109 HB3 TYR 109 -14.622 -2.327 5.570 873 HD1 TYR 109 HD1 TYR 109 -15.504 -3.943 7.339 874 HD2 TYR 109 HD2 TYR 109 -11.483 -2.342 7.426 875 HE1 TYR 109 HE1 TYR 109 -15.308 -4.598 9.686 876 HE2 TYR 109 HE2 TYR 109 -11.292 -2.986 9.803 877 HH TYR 109 HH TYR 109 -13.987 -4.583 11.555 878 H GLN 110 H GLN 110 -15.900 -3.851 4.410 879 HA GLN 110 HA GLN 110 -16.579 -6.083 5.955 880 HB2 GLN 110 HB2 GLN 110 -18.790 -5.888 5.114 881 HB3 GLN 110 HB3 GLN 110 -18.154 -4.255 5.285 882 HG2 GLN 110 HG2 GLN 110 -17.714 -4.188 2.846 883 HG3 GLN 110 HG3 GLN 110 -18.356 -5.817 2.664 884 HE21 GLN 110 HE21 GLN 110 -19.472 -3.977 1.068 885 HE22 GLN 110 HE22 GLN 110 -20.920 -3.222 1.738 886 H GLU 111 H GLU 111 -15.515 -5.890 2.589 887 HA GLU 111 HA GLU 111 -16.550 -8.343 1.660 888 HB2 GLU 111 HB2 GLU 111 -14.186 -6.644 0.938 889 HB3 GLU 111 HB3 GLU 111 -14.229 -8.280 0.291 890 HG2 GLU 111 HG2 GLU 111 -16.772 -6.680 0.080 891 HG3 GLU 111 HG3 GLU 111 -15.429 -6.195 -0.940 892 H ARG 112 H ARG 112 -13.655 -7.797 3.636 893 HA ARG 112 HA ARG 112 -13.367 -10.767 3.810 894 HB2 ARG 112 HB2 ARG 112 -11.256 -8.648 4.274 895 HB3 ARG 112 HB3 ARG 112 -11.062 -10.401 4.399 896 HG2 ARG 112 HG2 ARG 112 -12.153 -10.177 1.863 897 HG3 ARG 112 HG3 ARG 112 -11.256 -8.662 1.984 898 HD2 ARG 112 HD2 ARG 112 -9.201 -10.051 2.542 899 HD3 ARG 112 HD3 ARG 112 -10.157 -11.500 2.237 900 HE ARG 112 HE ARG 112 -9.081 -9.557 0.352 901 HH11 ARG 112 HH11 ARG 112 -11.389 -12.207 0.740 902 HH12 ARG 112 HH12 ARG 112 -11.673 -12.488 -0.928 903 HH21 ARG 112 HH21 ARG 112 -9.323 -9.932 -1.945 904 HH22 ARG 112 HH22 ARG 112 -10.364 -11.189 -2.522 905 H TYR 113 H TYR 113 -13.241 -7.806 5.837 906 HA TYR 113 HA TYR 113 -13.401 -9.404 8.265 907 HB2 TYR 113 HB2 TYR 113 -13.246 -6.400 7.868 908 HB3 TYR 113 HB3 TYR 113 -12.966 -7.279 9.359 909 HD1 TYR 113 HD1 TYR 113 -11.316 -5.706 6.684 910 HD2 TYR 113 HD2 TYR 113 -11.107 -9.243 9.123 911 HE1 TYR 113 HE1 TYR 113 -8.910 -5.965 6.106 912 HE2 TYR 113 HE2 TYR 113 -8.698 -9.457 8.643 913 HH TYR 113 HH TYR 113 -7.274 -8.128 6.080 914 H GLY 114 H GLY 114 -15.822 -9.082 6.312 915 HA2 GLY 114 HA2 GLY 114 -17.830 -8.695 8.416 916 HA3 GLY 114 HA3 GLY 114 -17.926 -7.639 6.994 917 H ASN 115 H ASN 115 -20.099 -9.046 7.086 918 HA ASN 115 HA ASN 115 -19.886 -11.050 4.966 919 HB2 ASN 115 HB2 ASN 115 -20.954 -11.771 7.730 920 HB3 ASN 115 HB3 ASN 115 -21.361 -12.673 6.274 921 HD21 ASN 115 HD21 ASN 115 -19.492 -13.666 5.001 922 HD22 ASN 115 HD22 ASN 115 -18.054 -14.091 5.902 923 H LYS 116 H LYS 116 -20.950 -9.073 3.982 924 HA LYS 116 HA LYS 116 -23.847 -9.289 4.117 925 HB2 LYS 116 HB2 LYS 116 -22.987 -7.672 5.950 926 HB3 LYS 116 HB3 LYS 116 -22.431 -6.624 4.642 927 HG2 LYS 116 HG2 LYS 116 -24.722 -6.288 3.895 928 HG3 LYS 116 HG3 LYS 116 -25.315 -7.560 4.993 929 HD2 LYS 116 HD2 LYS 116 -24.701 -6.230 6.945 930 HD3 LYS 116 HD3 LYS 116 -23.885 -5.039 5.910 931 HE2 LYS 116 HE2 LYS 116 -26.083 -4.539 4.814 932 HE3 LYS 116 HE3 LYS 116 -26.874 -5.636 5.956 933 HZ1 LYS 116 HZ1 LYS 116 -26.130 -4.192 7.759 934 HZ2 LYS 116 HZ2 LYS 116 -25.304 -3.253 6.710 935 HZ3 LYS 116 HZ3 LYS 116 -26.944 -3.291 6.650 936 H LYS 117 H LYS 117 -24.686 -7.564 2.405 937 HA LYS 117 HA LYS 117 -24.821 -6.734 0.387 938 HB2 LYS 117 HB2 LYS 117 -22.496 -5.684 1.087 939 HB3 LYS 117 HB3 LYS 117 -21.837 -6.778 -0.128 940 HG2 LYS 117 HG2 LYS 117 -23.268 -5.733 -1.856 941 HG3 LYS 117 HG3 LYS 117 -24.056 -4.749 -0.607 942 HD2 LYS 117 HD2 LYS 117 -21.835 -3.716 -0.096 943 HD3 LYS 117 HD3 LYS 117 -21.156 -4.543 -1.500 944 HE2 LYS 117 HE2 LYS 117 -23.453 -2.524 -1.475 945 HE3 LYS 117 HE3 LYS 117 -21.780 -2.179 -1.943 946 HZ1 LYS 117 HZ1 LYS 117 -23.610 -3.996 -3.390 947 HZ2 LYS 117 HZ2 LYS 117 -23.163 -2.488 -3.831 948 HZ3 LYS 117 HZ3 LYS 117 -22.029 -3.677 -3.796 949 H SER 118 H SER 118 -24.684 -7.309 -1.893 950 HA SER 118 HA SER 118 -23.772 -10.060 -2.492 951 HB2 SER 118 HB2 SER 118 -26.109 -10.258 -1.719 952 HB3 SER 118 HB3 SER 118 -26.623 -9.015 -2.871 953 HG SER 118 HG SER 118 -26.764 -10.504 -4.323 954 H GLN 119 H GLN 119 -25.706 -7.403 -3.968 955 HA GLN 119 HA GLN 119 -25.500 -6.221 -5.840 956 HB2 GLN 119 HB2 GLN 119 -23.342 -5.557 -4.781 957 HB3 GLN 119 HB3 GLN 119 -22.528 -6.678 -5.885 958 HG2 GLN 119 HG2 GLN 119 -24.394 -4.473 -6.839 959 HG3 GLN 119 HG3 GLN 119 -22.693 -4.171 -6.541 960 HE21 GLN 119 HE21 GLN 119 -25.002 -5.749 -8.717 961 HE22 GLN 119 HE22 GLN 119 -23.825 -6.109 -9.960 962 H ASP 120 H ASP 120 -26.688 -8.093 -6.388 963 HA ASP 120 HA ASP 120 -25.624 -10.272 -7.934 964 HB2 ASP 120 HB2 ASP 120 -28.447 -9.131 -7.817 965 HB3 ASP 120 HB3 ASP 120 -27.952 -10.624 -8.643 966 H LEU 121 H LEU 121 -25.486 -10.452 -10.107 967 HA LEU 121 HA LEU 121 -26.160 -8.184 -11.874 968 HB2 LEU 121 HB2 LEU 121 -23.875 -8.512 -12.962 969 HB3 LEU 121 HB3 LEU 121 -23.956 -7.676 -11.428 970 HG LEU 121 HG LEU 121 -23.171 -9.732 -10.244 971 HD11 LEU 121 HD11 LEU 121 -22.917 -10.851 -13.066 972 HD12 LEU 121 HD12 LEU 121 -22.141 -11.545 -11.631 973 HD13 LEU 121 HD13 LEU 121 -23.897 -11.493 -11.725 974 HD21 LEU 121 HD21 LEU 121 -21.615 -8.015 -10.809 975 HD22 LEU 121 HD22 LEU 121 -20.841 -9.589 -11.090 976 HD23 LEU 121 HD23 LEU 121 -21.431 -8.632 -12.470 977 H LYS 122 H LYS 122 -25.755 -8.925 -14.266 978 HA LYS 122 HA LYS 122 -26.113 -11.656 -14.985 979 HB2 LYS 122 HB2 LYS 122 -28.440 -11.311 -15.948 980 HB3 LYS 122 HB3 LYS 122 -28.388 -11.493 -14.198 981 HG2 LYS 122 HG2 LYS 122 -28.691 -9.133 -13.823 982 HG3 LYS 122 HG3 LYS 122 -28.427 -8.764 -15.521 983 HD2 LYS 122 HD2 LYS 122 -30.504 -9.956 -16.119 984 HD3 LYS 122 HD3 LYS 122 -30.837 -10.192 -14.387 985 HE2 LYS 122 HE2 LYS 122 -31.375 -7.965 -14.061 986 HE3 LYS 122 HE3 LYS 122 -30.001 -7.441 -15.032 987 HZ1 LYS 122 HZ1 LYS 122 -31.756 -6.715 -16.206 988 HZ2 LYS 122 HZ2 LYS 122 -31.316 -8.054 -17.006 989 HZ3 LYS 122 HZ3 LYS 122 -32.645 -8.127 -16.056 Start of MODEL 19 1 H1 GLY 1 H GLY 1 34.164 -8.263 3.579 2 HA2 GLY 1 HA2 GLY 1 32.520 -8.111 5.459 3 HA3 GLY 1 HA3 GLY 1 31.957 -7.311 3.968 4 H SER 2 H SER 2 30.298 -8.580 6.134 5 HA SER 2 HA SER 2 29.187 -10.998 4.904 6 HB2 SER 2 HB2 SER 2 27.701 -10.618 7.047 7 HB3 SER 2 HB3 SER 2 29.356 -11.228 7.188 8 HG SER 2 HG SER 2 28.993 -9.613 8.674 9 H ASN 3 H ASN 3 28.627 -7.565 5.057 10 HA ASN 3 HA ASN 3 27.043 -6.159 4.392 11 HB2 ASN 3 HB2 ASN 3 26.794 -8.118 2.113 12 HB3 ASN 3 HB3 ASN 3 26.252 -6.439 2.100 13 HD21 ASN 3 HD21 ASN 3 28.209 -7.543 0.254 14 HD22 ASN 3 HD22 ASN 3 29.636 -6.569 0.507 15 H GLN 4 H GLN 4 26.031 -7.984 6.348 16 HA GLN 4 HA GLN 4 23.375 -8.855 5.673 17 HB2 GLN 4 HB2 GLN 4 24.843 -9.796 7.489 18 HB3 GLN 4 HB3 GLN 4 24.661 -8.283 8.385 19 HG2 GLN 4 HG2 GLN 4 22.174 -8.714 8.476 20 HG3 GLN 4 HG3 GLN 4 22.464 -10.286 7.722 21 HE21 GLN 4 HE21 GLN 4 21.864 -8.893 10.711 22 HE22 GLN 4 HE22 GLN 4 22.893 -9.881 11.728 23 H GLN 5 H GLN 5 21.455 -7.753 5.858 24 HA GLN 5 HA GLN 5 21.499 -4.894 6.782 25 HB2 GLN 5 HB2 GLN 5 20.550 -6.020 4.324 26 HB3 GLN 5 HB3 GLN 5 19.120 -5.628 5.262 27 HG2 GLN 5 HG2 GLN 5 19.607 -3.702 3.972 28 HG3 GLN 5 HG3 GLN 5 20.067 -3.309 5.629 29 HE21 GLN 5 HE21 GLN 5 21.215 -3.752 2.338 30 HE22 GLN 5 HE22 GLN 5 22.882 -3.312 2.662 31 H LEU 6 H LEU 6 18.851 -4.421 7.462 32 HA LEU 6 HA LEU 6 18.637 -6.109 9.856 33 HB2 LEU 6 HB2 LEU 6 16.879 -3.847 8.807 34 HB3 LEU 6 HB3 LEU 6 16.506 -4.785 10.238 35 HG LEU 6 HG LEU 6 18.973 -3.040 9.884 36 HD11 LEU 6 HD11 LEU 6 16.788 -1.841 10.179 37 HD12 LEU 6 HD12 LEU 6 16.525 -2.739 11.678 38 HD13 LEU 6 HD13 LEU 6 17.886 -1.600 11.539 39 HD21 LEU 6 HD21 LEU 6 18.030 -4.795 12.190 40 HD22 LEU 6 HD22 LEU 6 19.591 -4.877 11.347 41 HD23 LEU 6 HD23 LEU 6 19.212 -3.499 12.388 42 H ASN 7 H ASN 7 16.633 -5.430 7.009 43 HA ASN 7 HA ASN 7 14.954 -6.413 5.950 44 HB2 ASN 7 HB2 ASN 7 16.636 -8.787 6.741 45 HB3 ASN 7 HB3 ASN 7 15.227 -8.979 5.713 46 HD21 ASN 7 HD21 ASN 7 18.545 -8.463 5.623 47 HD22 ASN 7 HD22 ASN 7 18.651 -7.862 3.968 48 H ALA 8 H ALA 8 13.223 -8.262 6.046 49 HA ALA 8 HA ALA 8 12.120 -8.350 8.844 50 HB1 ALA 8 HB1 ALA 8 10.910 -6.828 7.309 51 HB2 ALA 8 HB2 ALA 8 10.551 -8.212 6.247 52 HB3 ALA 8 HB3 ALA 8 9.934 -8.172 7.917 53 H THR 9 H THR 9 13.207 -10.207 6.238 54 HA THR 9 HA THR 9 13.264 -12.304 5.572 55 HB THR 9 HB THR 9 12.947 -13.054 8.469 56 HG1 THR 9 HG1 THR 9 15.381 -12.225 7.301 57 HG21 THR 9 HG21 THR 9 13.190 -14.966 6.994 58 HG22 THR 9 HG22 THR 9 14.603 -14.240 6.215 59 HG23 THR 9 HG23 THR 9 14.684 -14.739 7.921 60 H LYS 10 H LYS 10 11.025 -12.785 8.260 61 HA LYS 10 HA LYS 10 9.452 -14.801 7.106 62 HB2 LYS 10 HB2 LYS 10 9.825 -13.784 9.554 63 HB3 LYS 10 HB3 LYS 10 8.380 -12.874 9.177 64 HG2 LYS 10 HG2 LYS 10 7.011 -14.757 9.157 65 HG3 LYS 10 HG3 LYS 10 8.292 -15.835 8.605 66 HD2 LYS 10 HD2 LYS 10 8.095 -14.725 11.422 67 HD3 LYS 10 HD3 LYS 10 7.593 -16.349 10.889 68 HE2 LYS 10 HE2 LYS 10 9.970 -16.715 10.057 69 HE3 LYS 10 HE3 LYS 10 10.414 -15.189 10.836 70 HZ1 LYS 10 HZ1 LYS 10 9.635 -16.183 12.949 71 HZ2 LYS 10 HZ2 LYS 10 9.422 -17.614 12.176 72 HZ3 LYS 10 HZ3 LYS 10 10.910 -16.974 12.292 73 H LYS 11 H LYS 11 7.297 -14.750 6.379 74 HA LYS 11 HA LYS 11 5.738 -14.223 4.910 75 HB2 LYS 11 HB2 LYS 11 5.639 -11.997 6.894 76 HB3 LYS 11 HB3 LYS 11 4.712 -11.784 5.404 77 HG2 LYS 11 HG2 LYS 11 3.261 -13.485 5.808 78 HG3 LYS 11 HG3 LYS 11 4.420 -14.476 6.683 79 HD2 LYS 11 HD2 LYS 11 3.182 -11.978 7.895 80 HD3 LYS 11 HD3 LYS 11 2.490 -13.591 8.015 81 HE2 LYS 11 HE2 LYS 11 4.703 -14.411 8.939 82 HE3 LYS 11 HE3 LYS 11 5.221 -12.715 9.036 83 HZ1 LYS 11 HZ1 LYS 11 2.869 -13.889 10.401 84 HZ2 LYS 11 HZ2 LYS 11 4.295 -13.481 11.124 85 HZ3 LYS 11 HZ3 LYS 11 3.319 -12.317 10.492 86 H ASP 12 H ASP 12 6.777 -14.350 3.017 87 HA ASP 12 HA ASP 12 8.637 -12.523 1.987 88 HB2 ASP 12 HB2 ASP 12 7.800 -14.941 1.230 89 HB3 ASP 12 HB3 ASP 12 6.782 -14.017 0.140 90 H LYS 13 H LYS 13 5.109 -12.430 1.961 91 HA LYS 13 HA LYS 13 4.796 -10.372 -0.033 92 HB2 LYS 13 HB2 LYS 13 3.081 -11.046 2.418 93 HB3 LYS 13 HB3 LYS 13 2.547 -10.093 1.043 94 HG2 LYS 13 HG2 LYS 13 3.341 -13.043 0.872 95 HG3 LYS 13 HG3 LYS 13 1.712 -12.473 1.217 96 HD2 LYS 13 HD2 LYS 13 1.505 -12.748 -1.055 97 HD3 LYS 13 HD3 LYS 13 1.987 -11.061 -1.006 98 HE2 LYS 13 HE2 LYS 13 3.306 -12.111 -2.697 99 HE3 LYS 13 HE3 LYS 13 4.397 -11.833 -1.328 100 HZ1 LYS 13 HZ1 LYS 13 3.150 -14.379 -2.152 101 HZ2 LYS 13 HZ2 LYS 13 4.728 -14.004 -2.138 102 HZ3 LYS 13 HZ3 LYS 13 3.938 -14.212 -0.707 103 H LEU 14 H LEU 14 4.958 -10.307 3.565 104 HA LEU 14 HA LEU 14 4.883 -7.427 3.647 105 HB2 LEU 14 HB2 LEU 14 5.852 -9.425 5.722 106 HB3 LEU 14 HB3 LEU 14 5.481 -7.725 6.019 107 HG LEU 14 HG LEU 14 3.471 -9.865 5.163 108 HD11 LEU 14 HD11 LEU 14 2.599 -9.713 7.409 109 HD12 LEU 14 HD12 LEU 14 4.349 -10.038 7.512 110 HD13 LEU 14 HD13 LEU 14 3.730 -8.407 7.816 111 HD21 LEU 14 HD21 LEU 14 2.980 -7.007 6.037 112 HD22 LEU 14 HD22 LEU 14 2.836 -7.589 4.354 113 HD23 LEU 14 HD23 LEU 14 1.747 -8.203 5.590 114 H GLN 15 H GLN 15 7.528 -9.800 3.367 115 HA GLN 15 HA GLN 15 9.585 -8.152 4.223 116 HB2 GLN 15 HB2 GLN 15 9.670 -10.662 3.537 117 HB3 GLN 15 HB3 GLN 15 10.009 -10.062 1.901 118 HG2 GLN 15 HG2 GLN 15 11.842 -8.636 2.990 119 HG3 GLN 15 HG3 GLN 15 11.599 -9.570 4.457 120 HE21 GLN 15 HE21 GLN 15 11.614 -12.278 3.628 121 HE22 GLN 15 HE22 GLN 15 13.153 -12.511 2.809 122 H VAL 16 H VAL 16 8.198 -8.220 0.877 123 HA VAL 16 HA VAL 16 10.166 -6.349 -0.068 124 HB VAL 16 HB VAL 16 9.001 -6.254 -2.098 125 HG11 VAL 16 HG11 VAL 16 8.289 -9.047 -1.127 126 HG12 VAL 16 HG12 VAL 16 8.831 -8.529 -2.735 127 HG13 VAL 16 HG13 VAL 16 9.952 -8.518 -1.361 128 HG21 VAL 16 HG21 VAL 16 6.714 -5.745 -1.502 129 HG22 VAL 16 HG22 VAL 16 6.720 -7.247 -2.438 130 HG23 VAL 16 HG23 VAL 16 6.533 -7.314 -0.684 131 H ILE 17 H ILE 17 6.976 -5.925 1.422 132 HA ILE 17 HA ILE 17 6.808 -3.118 0.817 133 HB ILE 17 HB ILE 17 5.313 -4.548 3.026 134 HG12 ILE 17 HG12 ILE 17 4.413 -4.329 0.103 135 HG13 ILE 17 HG13 ILE 17 5.088 -5.789 0.812 136 HG21 ILE 17 HG21 ILE 17 4.682 -2.099 1.286 137 HG22 ILE 17 HG22 ILE 17 3.620 -2.773 2.538 138 HG23 ILE 17 HG23 ILE 17 5.169 -2.073 2.990 139 HD11 ILE 17 HD11 ILE 17 2.441 -4.529 1.430 140 HD12 ILE 17 HD12 ILE 17 2.854 -6.209 1.018 141 HD13 ILE 17 HD13 ILE 17 3.255 -5.610 2.607 142 H ASP 18 H ASP 18 7.793 -5.052 3.603 143 HA ASP 18 HA ASP 18 8.383 -2.940 5.400 144 HB2 ASP 18 HB2 ASP 18 9.423 -5.783 5.156 145 HB3 ASP 18 HB3 ASP 18 9.874 -4.710 6.462 146 H TRP 19 H TRP 19 10.149 -4.270 2.640 147 HA TRP 19 HA TRP 19 12.706 -2.998 3.231 148 HB2 TRP 19 HB2 TRP 19 12.811 -4.987 1.947 149 HB3 TRP 19 HB3 TRP 19 11.556 -4.461 0.847 150 HD1 TRP 19 HD1 TRP 19 12.345 -3.633 -1.382 151 HE1 TRP 19 HE1 TRP 19 14.496 -2.677 -2.387 152 HE3 TRP 19 HE3 TRP 19 15.215 -3.395 2.864 153 HZ2 TRP 19 HZ2 TRP 19 17.097 -1.812 -1.468 154 HZ3 TRP 19 HZ3 TRP 19 17.479 -2.392 2.777 155 HH2 TRP 19 HH2 TRP 19 18.422 -1.592 0.613 156 H LEU 20 H LEU 20 10.096 -2.361 0.750 157 HA LEU 20 HA LEU 20 11.303 0.081 -0.133 158 HB2 LEU 20 HB2 LEU 20 9.358 0.422 -1.434 159 HB3 LEU 20 HB3 LEU 20 9.739 -1.280 -1.455 160 HG LEU 20 HG LEU 20 7.988 -1.335 0.554 161 HD11 LEU 20 HD11 LEU 20 6.885 0.928 -1.129 162 HD12 LEU 20 HD12 LEU 20 6.081 0.121 0.231 163 HD13 LEU 20 HD13 LEU 20 7.508 1.116 0.521 164 HD21 LEU 20 HD21 LEU 20 6.247 -2.034 -0.966 165 HD22 LEU 20 HD22 LEU 20 7.058 -1.229 -2.310 166 HD23 LEU 20 HD23 LEU 20 7.807 -2.638 -1.525 167 H ILE 21 H ILE 21 9.146 -0.511 2.617 168 HA ILE 21 HA ILE 21 8.407 2.194 3.090 169 HB ILE 21 HB ILE 21 8.774 -0.305 4.766 170 HG12 ILE 21 HG12 ILE 21 6.336 1.479 4.425 171 HG13 ILE 21 HG13 ILE 21 6.747 0.232 3.260 172 HG21 ILE 21 HG21 ILE 21 8.160 2.415 5.987 173 HG22 ILE 21 HG22 ILE 21 7.905 0.848 6.787 174 HG23 ILE 21 HG23 ILE 21 9.532 1.352 6.352 175 HD11 ILE 21 HD11 ILE 21 6.602 -1.482 5.082 176 HD12 ILE 21 HD12 ILE 21 6.073 -0.206 6.198 177 HD13 ILE 21 HD13 ILE 21 5.094 -0.602 4.785 178 H GLU 22 H GLU 22 11.350 0.359 3.973 179 HA GLU 22 HA GLU 22 12.503 2.486 5.483 180 HB2 GLU 22 HB2 GLU 22 12.946 -0.135 5.488 181 HB3 GLU 22 HB3 GLU 22 14.148 0.288 4.268 182 HG2 GLU 22 HG2 GLU 22 15.386 0.471 6.238 183 HG3 GLU 22 HG3 GLU 22 14.886 2.144 6.028 184 H ASN 23 H ASN 23 12.483 1.715 2.069 185 HA ASN 23 HA ASN 23 14.932 2.960 1.341 186 HB2 ASN 23 HB2 ASN 23 14.435 2.226 -0.648 187 HB3 ASN 23 HB3 ASN 23 12.987 1.495 -0.009 188 HD21 ASN 23 HD21 ASN 23 10.882 2.776 -0.420 189 HD22 ASN 23 HD22 ASN 23 10.943 3.781 -1.876 190 H PHE 24 H PHE 24 11.682 4.239 1.270 191 HA PHE 24 HA PHE 24 12.876 6.989 1.171 192 HB2 PHE 24 HB2 PHE 24 10.506 6.005 -0.263 193 HB3 PHE 24 HB3 PHE 24 10.461 7.653 0.325 194 HD1 PHE 24 HD1 PHE 24 13.184 8.779 -0.023 195 HD2 PHE 24 HD2 PHE 24 10.838 6.187 -2.520 196 HE1 PHE 24 HE1 PHE 24 14.353 9.634 -2.007 197 HE2 PHE 24 HE2 PHE 24 12.109 6.948 -4.515 198 HZ PHE 24 HZ PHE 24 13.848 8.714 -4.257 199 HA PRO 25 HA PRO 25 10.873 7.242 5.228 200 HB2 PRO 25 HB2 PRO 25 12.624 8.937 6.429 201 HB3 PRO 25 HB3 PRO 25 13.082 7.260 6.056 202 HG2 PRO 25 HG2 PRO 25 13.620 9.717 4.345 203 HG3 PRO 25 HG3 PRO 25 14.804 8.513 4.941 204 HD2 PRO 25 HD2 PRO 25 13.734 8.303 2.499 205 HD3 PRO 25 HD3 PRO 25 14.020 6.836 3.495 206 H ASN 26 H ASN 26 10.271 9.013 2.611 207 HA ASN 26 HA ASN 26 9.901 11.672 3.778 208 HB2 ASN 26 HB2 ASN 26 9.263 10.403 1.140 209 HB3 ASN 26 HB3 ASN 26 8.453 11.893 1.616 210 HD21 ASN 26 HD21 ASN 26 11.377 10.577 0.594 211 HD22 ASN 26 HD22 ASN 26 12.364 12.042 0.550 212 H ALA 27 H ALA 27 8.086 8.689 3.405 213 HA ALA 27 HA ALA 27 5.937 9.341 5.153 214 HB1 ALA 27 HB1 ALA 27 4.172 9.305 3.232 215 HB2 ALA 27 HB2 ALA 27 5.079 10.807 3.394 216 HB3 ALA 27 HB3 ALA 27 5.535 9.672 2.130 217 H PHE 28 H PHE 28 5.593 7.233 5.843 218 HA PHE 28 HA PHE 28 4.493 5.227 4.238 219 HB2 PHE 28 HB2 PHE 28 7.460 5.109 4.401 220 HB3 PHE 28 HB3 PHE 28 6.656 3.650 4.934 221 HD1 PHE 28 HD1 PHE 28 4.593 2.856 3.359 222 HD2 PHE 28 HD2 PHE 28 8.000 5.174 2.075 223 HE1 PHE 28 HE1 PHE 28 4.166 2.198 0.998 224 HE2 PHE 28 HE2 PHE 28 7.547 4.535 -0.267 225 HZ PHE 28 HZ PHE 28 5.599 3.067 -0.814 226 H PHE 29 H PHE 29 3.984 3.241 5.618 227 HA PHE 29 HA PHE 29 4.486 3.589 8.494 228 HB2 PHE 29 HB2 PHE 29 1.731 3.417 7.242 229 HB3 PHE 29 HB3 PHE 29 2.075 3.100 8.947 230 HD1 PHE 29 HD1 PHE 29 1.594 5.697 6.399 231 HD2 PHE 29 HD2 PHE 29 2.987 4.962 10.410 232 HE1 PHE 29 HE1 PHE 29 1.548 8.146 6.874 233 HE2 PHE 29 HE2 PHE 29 2.910 7.392 10.877 234 HZ PHE 29 HZ PHE 29 2.218 8.985 9.111 235 H LYS 30 H LYS 30 4.253 1.664 9.613 236 HA LYS 30 HA LYS 30 4.581 -0.744 7.911 237 HB2 LYS 30 HB2 LYS 30 5.094 -0.244 10.879 238 HB3 LYS 30 HB3 LYS 30 5.246 -1.803 10.068 239 HG2 LYS 30 HG2 LYS 30 7.416 -1.013 10.226 240 HG3 LYS 30 HG3 LYS 30 6.987 -0.782 8.535 241 HD2 LYS 30 HD2 LYS 30 6.760 1.617 8.885 242 HD3 LYS 30 HD3 LYS 30 6.879 1.438 10.634 243 HE2 LYS 30 HE2 LYS 30 9.086 0.739 8.649 244 HE3 LYS 30 HE3 LYS 30 8.959 2.285 9.484 245 HZ1 LYS 30 HZ1 LYS 30 9.209 1.080 11.591 246 HZ2 LYS 30 HZ2 LYS 30 9.474 -0.328 10.779 247 HZ3 LYS 30 HZ3 LYS 30 10.513 0.918 10.598 248 H LYS 31 H LYS 31 2.840 -0.004 10.988 249 HA LYS 31 HA LYS 31 1.056 -2.255 10.518 250 HB2 LYS 31 HB2 LYS 31 1.290 -0.114 12.635 251 HB3 LYS 31 HB3 LYS 31 -0.140 -1.164 12.571 252 HG2 LYS 31 HG2 LYS 31 1.274 -3.173 12.714 253 HG3 LYS 31 HG3 LYS 31 2.734 -2.160 12.778 254 HD2 LYS 31 HD2 LYS 31 2.018 -1.166 14.878 255 HD3 LYS 31 HD3 LYS 31 0.439 -1.954 14.776 256 HE2 LYS 31 HE2 LYS 31 1.822 -3.073 16.398 257 HE3 LYS 31 HE3 LYS 31 1.461 -4.164 15.059 258 HZ1 LYS 31 HZ1 LYS 31 3.990 -2.648 15.255 259 HZ2 LYS 31 HZ2 LYS 31 3.803 -4.134 15.897 260 HZ3 LYS 31 HZ3 LYS 31 3.677 -3.920 14.267 261 H GLY 32 H GLY 32 -1.218 -2.212 10.363 262 HA2 GLY 32 HA2 GLY 32 -2.244 -0.510 8.334 263 HA3 GLY 32 HA3 GLY 32 -3.158 -1.658 9.318 264 H ASN 33 H ASN 33 -2.995 -0.590 11.847 265 HA ASN 33 HA ASN 33 -4.922 1.416 11.904 266 HB2 ASN 33 HB2 ASN 33 -4.773 1.447 14.195 267 HB3 ASN 33 HB3 ASN 33 -4.147 -0.156 13.833 268 HD21 ASN 33 HD21 ASN 33 -1.485 0.325 13.164 269 HD22 ASN 33 HD22 ASN 33 -0.696 0.965 14.613 270 H GLN 34 H GLN 34 -1.655 2.005 11.210 271 HA GLN 34 HA GLN 34 -1.878 4.904 11.854 272 HB2 GLN 34 HB2 GLN 34 0.634 4.865 11.929 273 HB3 GLN 34 HB3 GLN 34 -0.153 3.995 13.250 274 HG2 GLN 34 HG2 GLN 34 0.314 1.853 12.218 275 HG3 GLN 34 HG3 GLN 34 0.851 2.631 10.734 276 HE21 GLN 34 HE21 GLN 34 1.786 3.224 14.228 277 HE22 GLN 34 HE22 GLN 34 3.469 2.991 13.928 278 H VAL 35 H VAL 35 -2.006 2.632 9.382 279 HA VAL 35 HA VAL 35 -0.359 3.915 7.420 280 HB VAL 35 HB VAL 35 -1.398 1.543 7.516 281 HG11 VAL 35 HG11 VAL 35 -3.546 2.638 5.690 282 HG12 VAL 35 HG12 VAL 35 -3.426 1.054 6.513 283 HG13 VAL 35 HG13 VAL 35 -3.842 2.511 7.418 284 HG21 VAL 35 HG21 VAL 35 0.110 2.281 5.744 285 HG22 VAL 35 HG22 VAL 35 -1.158 1.209 5.136 286 HG23 VAL 35 HG23 VAL 35 -1.271 2.954 4.842 287 H LYS 36 H LYS 36 -1.074 5.103 5.414 288 HA LYS 36 HA LYS 36 -3.582 6.608 5.654 289 HB2 LYS 36 HB2 LYS 36 -0.872 7.788 6.075 290 HB3 LYS 36 HB3 LYS 36 -1.760 8.538 4.757 291 HG2 LYS 36 HG2 LYS 36 -3.753 8.695 6.415 292 HG3 LYS 36 HG3 LYS 36 -2.573 8.390 7.677 293 HD2 LYS 36 HD2 LYS 36 -2.513 10.650 5.620 294 HD3 LYS 36 HD3 LYS 36 -3.091 10.829 7.266 295 HE2 LYS 36 HE2 LYS 36 -0.247 9.928 6.681 296 HE3 LYS 36 HE3 LYS 36 -0.696 11.638 6.653 297 HZ1 LYS 36 HZ1 LYS 36 -1.367 11.452 8.947 298 HZ2 LYS 36 HZ2 LYS 36 -0.951 9.837 8.985 299 HZ3 LYS 36 HZ3 LYS 36 0.172 10.996 8.799 300 HA PRO 37 HA PRO 37 -3.463 5.741 1.348 301 HB2 PRO 37 HB2 PRO 37 -4.831 7.779 0.147 302 HB3 PRO 37 HB3 PRO 37 -5.617 6.575 1.216 303 HG2 PRO 37 HG2 PRO 37 -4.684 9.366 1.938 304 HG3 PRO 37 HG3 PRO 37 -6.236 8.566 2.328 305 HD2 PRO 37 HD2 PRO 37 -4.119 8.694 4.075 306 HD3 PRO 37 HD3 PRO 37 -5.251 7.310 4.049 307 H LEU 38 H LEU 38 -1.748 5.813 0.038 308 HA LEU 38 HA LEU 38 0.080 8.150 -0.005 309 HB2 LEU 38 HB2 LEU 38 0.194 5.326 -1.124 310 HB3 LEU 38 HB3 LEU 38 1.421 6.546 -1.439 311 HG LEU 38 HG LEU 38 0.709 5.775 1.403 312 HD11 LEU 38 HD11 LEU 38 2.830 4.510 -0.382 313 HD12 LEU 38 HD12 LEU 38 2.606 4.198 1.342 314 HD13 LEU 38 HD13 LEU 38 1.344 3.727 0.194 315 HD21 LEU 38 HD21 LEU 38 3.315 6.847 0.239 316 HD22 LEU 38 HD22 LEU 38 2.101 7.878 0.975 317 HD23 LEU 38 HD23 LEU 38 2.923 6.644 1.942 318 H LYS 39 H LYS 39 0.943 8.781 -2.193 319 HA LYS 39 HA LYS 39 -1.003 9.915 -3.807 320 HB2 LYS 39 HB2 LYS 39 1.316 10.612 -3.704 321 HB3 LYS 39 HB3 LYS 39 1.877 9.129 -4.468 322 HG2 LYS 39 HG2 LYS 39 -0.091 10.899 -5.922 323 HG3 LYS 39 HG3 LYS 39 1.586 11.423 -5.809 324 HD2 LYS 39 HD2 LYS 39 1.060 8.651 -6.733 325 HD3 LYS 39 HD3 LYS 39 0.752 9.965 -7.883 326 HE2 LYS 39 HE2 LYS 39 3.353 9.872 -6.385 327 HE3 LYS 39 HE3 LYS 39 3.060 8.646 -7.624 328 HZ1 LYS 39 HZ1 LYS 39 4.240 10.435 -8.530 329 HZ2 LYS 39 HZ2 LYS 39 2.773 10.370 -9.246 330 HZ3 LYS 39 HZ3 LYS 39 3.053 11.554 -8.144 331 H ILE 40 H ILE 40 -1.832 9.465 -5.904 332 HA ILE 40 HA ILE 40 -2.856 6.892 -6.225 333 HB ILE 40 HB ILE 40 -3.927 8.898 -7.096 334 HG12 ILE 40 HG12 ILE 40 -4.498 8.160 -9.398 335 HG13 ILE 40 HG13 ILE 40 -3.170 7.006 -9.376 336 HG21 ILE 40 HG21 ILE 40 -3.080 10.141 -9.004 337 HG22 ILE 40 HG22 ILE 40 -1.813 10.124 -7.764 338 HG23 ILE 40 HG23 ILE 40 -1.688 9.039 -9.139 339 HD11 ILE 40 HD11 ILE 40 -5.572 6.979 -7.489 340 HD12 ILE 40 HD12 ILE 40 -5.354 5.939 -8.910 341 HD13 ILE 40 HD13 ILE 40 -4.271 5.763 -7.528 342 H GLY 41 H GLY 41 -2.052 5.103 -7.018 343 HA2 GLY 41 HA2 GLY 41 -0.561 3.569 -7.996 344 HA3 GLY 41 HA3 GLY 41 -0.431 4.775 -9.283 345 H ILE 42 H ILE 42 0.652 5.469 -5.957 346 HA ILE 42 HA ILE 42 3.114 6.442 -6.539 347 HB ILE 42 HB ILE 42 1.923 6.635 -4.396 348 HG12 ILE 42 HG12 ILE 42 4.744 5.602 -3.978 349 HG13 ILE 42 HG13 ILE 42 4.340 7.178 -4.685 350 HG21 ILE 42 HG21 ILE 42 2.081 4.848 -2.676 351 HG22 ILE 42 HG22 ILE 42 1.194 4.283 -4.089 352 HG23 ILE 42 HG23 ILE 42 2.881 3.788 -3.825 353 HD11 ILE 42 HD11 ILE 42 3.753 6.201 -1.877 354 HD12 ILE 42 HD12 ILE 42 4.813 7.527 -2.376 355 HD13 ILE 42 HD13 ILE 42 3.059 7.703 -2.561 356 H PHE 43 H PHE 43 2.296 2.994 -6.470 357 HA PHE 43 HA PHE 43 4.860 1.901 -5.970 358 HB2 PHE 43 HB2 PHE 43 3.320 0.195 -6.148 359 HB3 PHE 43 HB3 PHE 43 2.375 1.028 -7.371 360 HD1 PHE 43 HD1 PHE 43 2.945 0.936 -9.753 361 HD2 PHE 43 HD2 PHE 43 5.200 -1.338 -6.872 362 HE1 PHE 43 HE1 PHE 43 4.074 -0.261 -11.579 363 HE2 PHE 43 HE2 PHE 43 6.331 -2.541 -8.692 364 HZ PHE 43 HZ PHE 43 5.840 -1.971 -11.052 365 H ASP 44 H ASP 44 3.450 3.462 -8.894 366 HA ASP 44 HA ASP 44 5.517 2.591 -10.661 367 HB2 ASP 44 HB2 ASP 44 3.111 3.819 -10.967 368 HB3 ASP 44 HB3 ASP 44 4.176 5.194 -11.222 369 H ASP 45 H ASP 45 5.342 5.233 -8.421 370 HA ASP 45 HA ASP 45 7.595 6.782 -9.483 371 HB2 ASP 45 HB2 ASP 45 5.949 6.895 -6.902 372 HB3 ASP 45 HB3 ASP 45 7.347 7.913 -7.225 373 H LEU 46 H LEU 46 6.853 4.743 -6.802 374 HA LEU 46 HA LEU 46 9.265 4.635 -5.328 375 HB2 LEU 46 HB2 LEU 46 7.046 4.370 -4.493 376 HB3 LEU 46 HB3 LEU 46 6.700 3.034 -5.576 377 HG LEU 46 HG LEU 46 6.771 2.396 -3.286 378 HD11 LEU 46 HD11 LEU 46 7.273 0.743 -5.060 379 HD12 LEU 46 HD12 LEU 46 9.010 0.989 -4.775 380 HD13 LEU 46 HD13 LEU 46 8.001 0.362 -3.487 381 HD21 LEU 46 HD21 LEU 46 8.772 3.982 -2.715 382 HD22 LEU 46 HD22 LEU 46 8.540 2.476 -1.833 383 HD23 LEU 46 HD23 LEU 46 9.741 2.548 -3.132 384 H ILE 47 H ILE 47 7.878 2.400 -7.765 385 HA ILE 47 HA ILE 47 9.738 0.294 -7.418 386 HB ILE 47 HB ILE 47 7.598 0.156 -8.653 387 HG12 ILE 47 HG12 ILE 47 9.604 -1.487 -8.864 388 HG13 ILE 47 HG13 ILE 47 8.207 -1.656 -9.903 389 HG21 ILE 47 HG21 ILE 47 9.029 1.512 -10.999 390 HG22 ILE 47 HG22 ILE 47 7.407 0.772 -11.013 391 HG23 ILE 47 HG23 ILE 47 7.740 2.189 -10.016 392 HD11 ILE 47 HD11 ILE 47 10.693 -0.209 -10.870 393 HD12 ILE 47 HD12 ILE 47 10.439 -1.931 -11.049 394 HD13 ILE 47 HD13 ILE 47 9.312 -0.786 -11.807 395 H ASP 48 H ASP 48 9.913 3.292 -9.292 396 HA ASP 48 HA ASP 48 12.041 2.706 -10.935 397 HB2 ASP 48 HB2 ASP 48 10.474 4.863 -10.500 398 HB3 ASP 48 HB3 ASP 48 11.927 5.436 -9.687 399 H PHE 49 H PHE 49 12.009 3.421 -7.531 400 HA PHE 49 HA PHE 49 14.875 3.869 -7.249 401 HB2 PHE 49 HB2 PHE 49 12.946 4.706 -5.764 402 HB3 PHE 49 HB3 PHE 49 13.036 3.111 -4.994 403 HD1 PHE 49 HD1 PHE 49 14.393 6.450 -5.208 404 HD2 PHE 49 HD2 PHE 49 15.369 2.418 -4.003 405 HE1 PHE 49 HE1 PHE 49 16.250 7.308 -3.817 406 HE2 PHE 49 HE2 PHE 49 17.201 3.284 -2.604 407 HZ PHE 49 HZ PHE 49 17.623 5.752 -2.472 408 H TYR 50 H TYR 50 12.641 1.082 -6.893 409 HA TYR 50 HA TYR 50 14.463 -0.747 -5.634 410 HB2 TYR 50 HB2 TYR 50 12.483 -1.781 -5.481 411 HB3 TYR 50 HB3 TYR 50 11.775 -0.880 -6.795 412 HD1 TYR 50 HD1 TYR 50 13.331 -4.093 -5.884 413 HD2 TYR 50 HD2 TYR 50 12.019 -1.606 -9.118 414 HE1 TYR 50 HE1 TYR 50 13.468 -6.022 -7.426 415 HE2 TYR 50 HE2 TYR 50 12.284 -3.474 -10.704 416 HH TYR 50 HH TYR 50 13.132 -5.598 -10.973 417 H GLU 51 H GLU 51 14.104 0.381 -8.952 418 HA GLU 51 HA GLU 51 15.672 -1.701 -10.171 419 HB2 GLU 51 HB2 GLU 51 14.927 1.083 -11.131 420 HB3 GLU 51 HB3 GLU 51 15.653 -0.162 -12.151 421 HG2 GLU 51 HG2 GLU 51 13.209 -1.006 -10.707 422 HG3 GLU 51 HG3 GLU 51 12.953 0.310 -11.833 423 H ARG 52 H ARG 52 16.589 0.835 -8.053 424 HA ARG 52 HA ARG 52 19.155 1.514 -9.345 425 HB2 ARG 52 HB2 ARG 52 18.182 1.999 -6.488 426 HB3 ARG 52 HB3 ARG 52 19.586 2.732 -7.215 427 HG2 ARG 52 HG2 ARG 52 16.788 3.233 -8.326 428 HG3 ARG 52 HG3 ARG 52 17.455 4.117 -6.953 429 HD2 ARG 52 HD2 ARG 52 19.518 4.416 -8.672 430 HD3 ARG 52 HD3 ARG 52 18.204 4.248 -9.848 431 HE ARG 52 HE ARG 52 17.233 6.061 -7.992 432 HH11 ARG 52 HH11 ARG 52 20.121 5.966 -10.054 433 HH12 ARG 52 HH12 ARG 52 20.277 7.684 -10.113 434 HH21 ARG 52 HH21 ARG 52 17.636 8.314 -7.811 435 HH22 ARG 52 HH22 ARG 52 19.011 8.984 -8.641 436 H LEU 53 H LEU 53 17.958 -0.924 -6.888 437 HA LEU 53 HA LEU 53 20.086 -1.497 -5.435 438 HB2 LEU 53 HB2 LEU 53 17.842 -3.056 -6.757 439 HB3 LEU 53 HB3 LEU 53 18.909 -3.772 -5.575 440 HG LEU 53 HG LEU 53 18.366 -2.150 -3.969 441 HD11 LEU 53 HD11 LEU 53 16.398 -0.662 -3.944 442 HD12 LEU 53 HD12 LEU 53 17.908 -0.116 -4.661 443 HD13 LEU 53 HD13 LEU 53 16.594 -0.629 -5.705 444 HD21 LEU 53 HD21 LEU 53 17.042 -4.244 -4.160 445 HD22 LEU 53 HD22 LEU 53 16.110 -2.952 -3.399 446 HD23 LEU 53 HD23 LEU 53 15.831 -3.355 -5.115 447 H ASP 54 H ASP 54 21.801 -2.705 -5.610 448 HA ASP 54 HA ASP 54 23.022 -3.180 -8.202 449 HB2 ASP 54 HB2 ASP 54 24.464 -2.689 -6.334 450 HB3 ASP 54 HB3 ASP 54 23.755 -3.990 -5.369 451 H THR 55 H THR 55 21.244 -5.158 -5.874 452 HA THR 55 HA THR 55 21.023 -7.347 -7.847 453 HB THR 55 HB THR 55 21.768 -7.783 -4.924 454 HG1 THR 55 HG1 THR 55 23.520 -6.969 -6.344 455 HG21 THR 55 HG21 THR 55 20.424 -9.608 -5.939 456 HG22 THR 55 HG22 THR 55 21.573 -9.698 -7.294 457 HG23 THR 55 HG23 THR 55 22.090 -10.136 -5.662 458 HA PRO 56 HA PRO 56 17.008 -6.069 -6.034 459 HB2 PRO 56 HB2 PRO 56 15.508 -6.662 -8.247 460 HB3 PRO 56 HB3 PRO 56 16.375 -5.104 -8.040 461 HG2 PRO 56 HG2 PRO 56 17.130 -7.553 -9.641 462 HG3 PRO 56 HG3 PRO 56 17.310 -5.837 -10.098 463 HD2 PRO 56 HD2 PRO 56 19.348 -7.390 -9.101 464 HD3 PRO 56 HD3 PRO 56 19.275 -5.623 -8.842 465 HA PRO 57 HA PRO 57 16.796 -10.585 -5.387 466 HB2 PRO 57 HB2 PRO 57 15.393 -10.702 -3.029 467 HB3 PRO 57 HB3 PRO 57 17.124 -10.287 -3.144 468 HG2 PRO 57 HG2 PRO 57 14.773 -8.414 -2.875 469 HG3 PRO 57 HG3 PRO 57 16.342 -8.354 -2.026 470 HD2 PRO 57 HD2 PRO 57 15.721 -6.832 -4.252 471 HD3 PRO 57 HD3 PRO 57 17.373 -7.356 -3.840 472 H PHE 58 H PHE 58 13.886 -8.531 -5.092 473 HA PHE 58 HA PHE 58 12.136 -10.796 -5.844 474 HB2 PHE 58 HB2 PHE 58 11.569 -8.073 -4.638 475 HB3 PHE 58 HB3 PHE 58 10.339 -9.277 -5.014 476 HD1 PHE 58 HD1 PHE 58 10.578 -11.615 -3.895 477 HD2 PHE 58 HD2 PHE 58 12.613 -8.067 -2.501 478 HE1 PHE 58 HE1 PHE 58 10.835 -12.617 -1.678 479 HE2 PHE 58 HE2 PHE 58 12.889 -9.102 -0.271 480 HZ PHE 58 HZ PHE 58 11.937 -11.366 0.174 481 H SER 59 H SER 59 10.222 -10.194 -7.226 482 HA SER 59 HA SER 59 11.144 -8.850 -9.686 483 HB2 SER 59 HB2 SER 59 10.351 -11.005 -10.135 484 HB3 SER 59 HB3 SER 59 9.039 -10.899 -8.959 485 HG SER 59 HG SER 59 8.450 -10.806 -11.213 486 H LYS 60 H LYS 60 9.636 -7.467 -10.819 487 HA LYS 60 HA LYS 60 8.483 -5.300 -9.247 488 HB2 LYS 60 HB2 LYS 60 8.043 -6.115 -12.152 489 HB3 LYS 60 HB3 LYS 60 7.577 -4.566 -11.450 490 HG2 LYS 60 HG2 LYS 60 9.891 -3.967 -11.077 491 HG3 LYS 60 HG3 LYS 60 10.458 -5.563 -11.513 492 HD2 LYS 60 HD2 LYS 60 10.925 -4.197 -13.377 493 HD3 LYS 60 HD3 LYS 60 9.588 -5.253 -13.832 494 HE2 LYS 60 HE2 LYS 60 8.019 -3.309 -13.336 495 HE3 LYS 60 HE3 LYS 60 9.460 -2.313 -13.056 496 HZ1 LYS 60 HZ1 LYS 60 8.657 -3.571 -15.597 497 HZ2 LYS 60 HZ2 LYS 60 8.731 -1.986 -15.260 498 HZ3 LYS 60 HZ3 LYS 60 10.136 -2.821 -15.344 499 H LYS 61 H LYS 61 7.273 -8.346 -10.545 500 HA LYS 61 HA LYS 61 4.437 -7.823 -10.294 501 HB2 LYS 61 HB2 LYS 61 5.479 -9.697 -11.616 502 HB3 LYS 61 HB3 LYS 61 6.007 -10.431 -10.107 503 HG2 LYS 61 HG2 LYS 61 4.063 -11.623 -10.594 504 HG3 LYS 61 HG3 LYS 61 3.521 -10.457 -9.411 505 HD2 LYS 61 HD2 LYS 61 1.863 -10.524 -11.088 506 HD3 LYS 61 HD3 LYS 61 2.716 -9.002 -11.378 507 HE2 LYS 61 HE2 LYS 61 3.978 -9.975 -13.220 508 HE3 LYS 61 HE3 LYS 61 3.444 -11.604 -12.794 509 HZ1 LYS 61 HZ1 LYS 61 2.203 -10.843 -14.649 510 HZ2 LYS 61 HZ2 LYS 61 1.196 -10.964 -13.388 511 HZ3 LYS 61 HZ3 LYS 61 1.718 -9.468 -13.908 512 H SER 62 H SER 62 6.792 -9.609 -8.156 513 HA SER 62 HA SER 62 5.111 -10.012 -6.055 514 HB2 SER 62 HB2 SER 62 8.037 -9.345 -5.625 515 HB3 SER 62 HB3 SER 62 7.060 -10.622 -4.879 516 HG SER 62 HG SER 62 8.213 -11.715 -6.346 517 H LEU 63 H LEU 63 7.227 -7.137 -6.569 518 HA LEU 63 HA LEU 63 6.569 -5.896 -4.128 519 HB2 LEU 63 HB2 LEU 63 8.426 -5.371 -5.699 520 HB3 LEU 63 HB3 LEU 63 7.315 -4.450 -6.701 521 HG LEU 63 HG LEU 63 7.571 -3.873 -3.720 522 HD11 LEU 63 HD11 LEU 63 9.397 -2.350 -4.024 523 HD12 LEU 63 HD12 LEU 63 9.918 -3.896 -4.690 524 HD13 LEU 63 HD13 LEU 63 9.415 -2.570 -5.780 525 HD21 LEU 63 HD21 LEU 63 7.112 -2.064 -6.133 526 HD22 LEU 63 HD22 LEU 63 5.832 -2.652 -5.022 527 HD23 LEU 63 HD23 LEU 63 7.092 -1.570 -4.440 528 H ARG 64 H ARG 64 5.019 -5.278 -7.367 529 HA ARG 64 HA ARG 64 3.070 -3.519 -6.240 530 HB2 ARG 64 HB2 ARG 64 3.745 -3.636 -8.652 531 HB3 ARG 64 HB3 ARG 64 2.936 -5.182 -8.792 532 HG2 ARG 64 HG2 ARG 64 1.648 -3.360 -9.759 533 HG3 ARG 64 HG3 ARG 64 0.764 -4.146 -8.469 534 HD2 ARG 64 HD2 ARG 64 0.659 -2.278 -7.185 535 HD3 ARG 64 HD3 ARG 64 2.284 -1.785 -7.570 536 HE ARG 64 HE ARG 64 1.134 -1.240 -9.910 537 HH11 ARG 64 HH11 ARG 64 -0.221 -0.493 -6.691 538 HH12 ARG 64 HH12 ARG 64 -0.899 1.001 -7.205 539 HH21 ARG 64 HH21 ARG 64 0.392 0.886 -10.494 540 HH22 ARG 64 HH22 ARG 64 -0.638 1.720 -9.404 541 H GLU 65 H GLU 65 3.001 -7.092 -6.650 542 HA GLU 65 HA GLU 65 0.175 -7.287 -6.116 543 HB2 GLU 65 HB2 GLU 65 2.508 -9.244 -6.051 544 HB3 GLU 65 HB3 GLU 65 0.863 -9.735 -5.644 545 HG2 GLU 65 HG2 GLU 65 1.398 -8.328 -8.280 546 HG3 GLU 65 HG3 GLU 65 1.718 -10.043 -8.083 547 H ALA 66 H ALA 66 3.138 -7.411 -4.086 548 HA ALA 66 HA ALA 66 1.681 -8.166 -1.706 549 HB1 ALA 66 HB1 ALA 66 4.432 -6.957 -2.063 550 HB2 ALA 66 HB2 ALA 66 3.778 -7.667 -0.576 551 HB3 ALA 66 HB3 ALA 66 4.063 -8.702 -1.982 552 H LEU 67 H LEU 67 2.978 -5.005 -2.978 553 HA LEU 67 HA LEU 67 2.274 -3.426 -0.785 554 HB2 LEU 67 HB2 LEU 67 3.347 -2.946 -3.302 555 HB3 LEU 67 HB3 LEU 67 1.818 -2.103 -3.410 556 HG LEU 67 HG LEU 67 3.910 -1.739 -1.208 557 HD11 LEU 67 HD11 LEU 67 4.760 -1.028 -3.417 558 HD12 LEU 67 HD12 LEU 67 3.336 0.016 -3.639 559 HD13 LEU 67 HD13 LEU 67 4.514 0.354 -2.349 560 HD21 LEU 67 HD21 LEU 67 2.699 0.418 -0.771 561 HD22 LEU 67 HD22 LEU 67 1.410 -0.131 -1.869 562 HD23 LEU 67 HD23 LEU 67 1.749 -1.024 -0.376 563 H SER 68 H SER 68 0.241 -4.702 -3.384 564 HA SER 68 HA SER 68 -2.091 -3.233 -3.086 565 HB2 SER 68 HB2 SER 68 -1.542 -5.110 -4.753 566 HB3 SER 68 HB3 SER 68 -1.983 -6.251 -3.482 567 HG SER 68 HG SER 68 -4.043 -5.396 -3.444 568 H TYR 69 H TYR 69 -0.779 -5.777 -0.922 569 HA TYR 69 HA TYR 69 -3.293 -6.118 0.484 570 HB2 TYR 69 HB2 TYR 69 -0.583 -7.293 0.680 571 HB3 TYR 69 HB3 TYR 69 -1.372 -7.037 2.228 572 HD1 TYR 69 HD1 TYR 69 -2.986 -8.572 3.012 573 HD2 TYR 69 HD2 TYR 69 -2.078 -8.418 -1.217 574 HE1 TYR 69 HE1 TYR 69 -4.542 -10.437 2.612 575 HE2 TYR 69 HE2 TYR 69 -3.657 -10.294 -1.615 576 HH TYR 69 HH TYR 69 -5.870 -11.387 0.870 577 H TYR 70 H TYR 70 -0.548 -3.881 0.809 578 HA TYR 70 HA TYR 70 -1.364 -3.024 3.488 579 HB2 TYR 70 HB2 TYR 70 0.713 -2.201 1.509 580 HB3 TYR 70 HB3 TYR 70 0.072 -0.941 2.555 581 HD1 TYR 70 HD1 TYR 70 0.820 -4.581 3.232 582 HD2 TYR 70 HD2 TYR 70 1.645 -0.472 4.281 583 HE1 TYR 70 HE1 TYR 70 2.444 -5.319 4.896 584 HE2 TYR 70 HE2 TYR 70 3.280 -1.241 5.957 585 HH TYR 70 HH TYR 70 4.827 -3.963 6.172 586 H SER 71 H SER 71 -1.768 -1.745 0.089 587 HA SER 71 HA SER 71 -3.415 0.417 0.955 588 HB2 SER 71 HB2 SER 71 -4.051 0.383 -1.522 589 HB3 SER 71 HB3 SER 71 -2.378 0.746 -1.052 590 HG SER 71 HG SER 71 -2.877 -0.910 -2.827 591 H ALA 72 H ALA 72 -4.168 -2.932 0.541 592 HA ALA 72 HA ALA 72 -7.100 -2.361 0.548 593 HB1 ALA 72 HB1 ALA 72 -6.253 -3.752 -1.358 594 HB2 ALA 72 HB2 ALA 72 -5.674 -4.945 -0.165 595 HB3 ALA 72 HB3 ALA 72 -7.404 -4.601 -0.315 596 H SER 73 H SER 73 -4.866 -2.473 2.744 597 HA SER 73 HA SER 73 -5.544 -4.753 4.387 598 HB2 SER 73 HB2 SER 73 -4.204 -2.099 5.022 599 HB3 SER 73 HB3 SER 73 -4.611 -3.252 6.297 600 HG SER 73 HG SER 73 -3.254 -4.152 4.013 601 HA PRO 74 HA PRO 74 -9.491 -3.557 5.803 602 HB2 PRO 74 HB2 PRO 74 -9.401 -4.331 8.497 603 HB3 PRO 74 HB3 PRO 74 -9.816 -5.380 7.105 604 HG2 PRO 74 HG2 PRO 74 -7.214 -5.084 8.564 605 HG3 PRO 74 HG3 PRO 74 -7.944 -6.562 7.844 606 HD2 PRO 74 HD2 PRO 74 -5.916 -5.222 6.648 607 HD3 PRO 74 HD3 PRO 74 -7.213 -6.015 5.699 608 H ALA 75 H ALA 75 -6.945 -2.721 8.264 609 HA ALA 75 HA ALA 75 -8.325 -0.531 9.335 610 HB1 ALA 75 HB1 ALA 75 -6.429 -1.619 10.417 611 HB2 ALA 75 HB2 ALA 75 -5.343 -1.045 9.125 612 HB3 ALA 75 HB3 ALA 75 -6.119 0.116 10.228 613 H TYR 76 H TYR 76 -6.508 -0.703 6.295 614 HA TYR 76 HA TYR 76 -6.027 2.147 6.035 615 HB2 TYR 76 HB2 TYR 76 -4.752 0.454 4.696 616 HB3 TYR 76 HB3 TYR 76 -6.225 -0.076 3.936 617 HD1 TYR 76 HD1 TYR 76 -3.380 1.930 3.468 618 HD2 TYR 76 HD2 TYR 76 -7.596 1.726 2.523 619 HE1 TYR 76 HE1 TYR 76 -3.016 3.364 1.496 620 HE2 TYR 76 HE2 TYR 76 -7.257 3.202 0.628 621 HH TYR 76 HH TYR 76 -5.690 4.145 -0.777 622 H LEU 77 H LEU 77 -8.405 -0.150 4.722 623 HA LEU 77 HA LEU 77 -10.038 1.788 3.411 624 HB2 LEU 77 HB2 LEU 77 -10.669 -1.030 4.355 625 HB3 LEU 77 HB3 LEU 77 -11.581 -0.134 3.151 626 HG LEU 77 HG LEU 77 -8.651 -0.848 2.733 627 HD11 LEU 77 HD11 LEU 77 -9.882 -2.902 3.196 628 HD12 LEU 77 HD12 LEU 77 -11.094 -2.466 1.973 629 HD13 LEU 77 HD13 LEU 77 -9.424 -2.820 1.487 630 HD21 LEU 77 HD21 LEU 77 -9.140 -0.623 0.379 631 HD22 LEU 77 HD22 LEU 77 -10.832 -0.217 0.720 632 HD23 LEU 77 HD23 LEU 77 -9.517 0.881 1.215 633 H SER 78 H SER 78 -10.557 -0.030 6.483 634 HA SER 78 HA SER 78 -13.047 1.022 7.114 635 HB2 SER 78 HB2 SER 78 -11.414 -0.862 8.160 636 HB3 SER 78 HB3 SER 78 -11.123 0.403 9.337 637 HG SER 78 HG SER 78 -12.870 -1.157 9.666 638 H CYS 79 H CYS 79 -9.906 2.527 7.605 639 HA CYS 79 HA CYS 79 -11.071 4.701 9.252 640 HB2 CYS 79 HB2 CYS 79 -8.260 3.825 8.634 641 HB3 CYS 79 HB3 CYS 79 -8.666 5.275 9.575 642 HG CYS 79 HG CYS 79 -9.542 2.136 10.154 643 H GLN 80 H GLN 80 -11.106 4.251 5.989 644 HA GLN 80 HA GLN 80 -9.735 6.438 4.946 645 HB2 GLN 80 HB2 GLN 80 -12.189 4.921 4.035 646 HB3 GLN 80 HB3 GLN 80 -11.773 6.402 3.223 647 HG2 GLN 80 HG2 GLN 80 -9.411 4.624 3.667 648 HG3 GLN 80 HG3 GLN 80 -10.645 3.942 2.652 649 HE21 GLN 80 HE21 GLN 80 -8.831 7.169 2.986 650 HE22 GLN 80 HE22 GLN 80 -8.727 7.313 1.250 651 H LYS 81 H LYS 81 -9.853 8.393 5.037 652 HA LYS 81 HA LYS 81 -12.203 9.989 5.864 653 HB2 LYS 81 HB2 LYS 81 -9.319 10.117 6.825 654 HB3 LYS 81 HB3 LYS 81 -10.415 11.495 6.942 655 HG2 LYS 81 HG2 LYS 81 -11.905 10.329 8.434 656 HG3 LYS 81 HG3 LYS 81 -11.041 8.795 8.206 657 HD2 LYS 81 HD2 LYS 81 -8.994 9.784 9.174 658 HD3 LYS 81 HD3 LYS 81 -9.839 11.327 9.398 659 HE2 LYS 81 HE2 LYS 81 -11.475 10.156 10.889 660 HE3 LYS 81 HE3 LYS 81 -10.535 8.662 10.713 661 HZ1 LYS 81 HZ1 LYS 81 -9.568 11.209 11.851 662 HZ2 LYS 81 HZ2 LYS 81 -9.972 9.863 12.715 663 HZ3 LYS 81 HZ3 LYS 81 -8.651 9.850 11.726 664 HA PRO 82 HA PRO 82 -10.591 11.596 1.879 665 HB2 PRO 82 HB2 PRO 82 -12.646 13.319 1.282 666 HB3 PRO 82 HB3 PRO 82 -12.787 11.553 1.108 667 HG2 PRO 82 HG2 PRO 82 -13.719 13.297 3.366 668 HG3 PRO 82 HG3 PRO 82 -14.601 11.946 2.585 669 HD2 PRO 82 HD2 PRO 82 -13.251 11.698 4.967 670 HD3 PRO 82 HD3 PRO 82 -13.439 10.350 3.808 671 H ASP 83 H ASP 83 -10.465 14.098 1.120 672 HA ASP 83 HA ASP 83 -9.261 16.011 1.480 673 HB2 ASP 83 HB2 ASP 83 -11.501 16.679 2.212 674 HB3 ASP 83 HB3 ASP 83 -11.028 16.353 3.887 675 H THR 84 H THR 84 -8.029 13.668 2.537 676 HA THR 84 HA THR 84 -6.641 14.555 4.974 677 HB THR 84 HB THR 84 -7.543 12.315 4.879 678 HG1 THR 84 HG1 THR 84 -4.878 12.820 5.234 679 HG21 THR 84 HG21 THR 84 -6.563 10.570 3.477 680 HG22 THR 84 HG22 THR 84 -7.360 11.794 2.478 681 HG23 THR 84 HG23 THR 84 -5.577 11.771 2.615 682 H ALA 85 H ALA 85 -6.023 14.800 1.597 683 HA ALA 85 HA ALA 85 -4.178 15.424 0.387 684 HB1 ALA 85 HB1 ALA 85 -2.588 16.941 1.374 685 HB2 ALA 85 HB2 ALA 85 -4.258 17.365 1.814 686 HB3 ALA 85 HB3 ALA 85 -3.198 16.573 2.999 687 H ARG 86 H ARG 86 -3.468 13.646 -0.423 688 HA ARG 86 HA ARG 86 -1.858 11.755 1.158 689 HB2 ARG 86 HB2 ARG 86 -2.197 11.857 -1.855 690 HB3 ARG 86 HB3 ARG 86 -1.672 10.483 -0.917 691 HG2 ARG 86 HG2 ARG 86 -3.887 10.083 -0.102 692 HG3 ARG 86 HG3 ARG 86 -4.488 11.647 -0.657 693 HD2 ARG 86 HD2 ARG 86 -3.414 9.530 -2.560 694 HD3 ARG 86 HD3 ARG 86 -5.107 9.659 -2.090 695 HE ARG 86 HE ARG 86 -3.811 12.090 -3.172 696 HH11 ARG 86 HH11 ARG 86 -6.228 9.486 -3.826 697 HH12 ARG 86 HH12 ARG 86 -7.049 10.527 -4.958 698 HH21 ARG 86 HH21 ARG 86 -4.583 12.953 -5.107 699 HH22 ARG 86 HH22 ARG 86 -6.221 12.538 -5.573 700 H VAL 87 H VAL 87 0.356 11.161 0.216 701 HA VAL 87 HA VAL 87 1.878 13.380 -0.923 702 HB VAL 87 HB VAL 87 3.685 12.849 0.793 703 HG11 VAL 87 HG11 VAL 87 2.442 14.940 0.877 704 HG12 VAL 87 HG12 VAL 87 1.149 14.192 1.833 705 HG13 VAL 87 HG13 VAL 87 2.789 14.361 2.503 706 HG21 VAL 87 HG21 VAL 87 2.713 10.744 1.701 707 HG22 VAL 87 HG22 VAL 87 3.012 11.945 2.961 708 HG23 VAL 87 HG23 VAL 87 1.363 11.681 2.403 709 H ASP 88 H ASP 88 3.861 12.637 -1.840 710 HA ASP 88 HA ASP 88 3.724 9.849 -2.810 711 HB2 ASP 88 HB2 ASP 88 4.952 10.565 -4.730 712 HB3 ASP 88 HB3 ASP 88 3.529 11.568 -4.511 713 H ILE 89 H ILE 89 6.301 9.464 -3.635 714 HA ILE 89 HA ILE 89 7.669 8.732 -1.209 715 HB ILE 89 HB ILE 89 9.470 8.075 -2.907 716 HG12 ILE 89 HG12 ILE 89 7.367 8.567 -5.042 717 HG13 ILE 89 HG13 ILE 89 8.549 9.796 -4.622 718 HG21 ILE 89 HG21 ILE 89 6.723 6.914 -3.481 719 HG22 ILE 89 HG22 ILE 89 8.303 6.114 -3.622 720 HG23 ILE 89 HG23 ILE 89 7.668 6.549 -2.022 721 HD11 ILE 89 HD11 ILE 89 9.262 7.039 -5.592 722 HD12 ILE 89 HD12 ILE 89 9.329 8.586 -6.509 723 HD13 ILE 89 HD13 ILE 89 10.401 8.350 -5.142 724 H TYR 90 H TYR 90 7.803 11.596 -3.260 725 HA TYR 90 HA TYR 90 10.508 12.331 -2.436 726 HB2 TYR 90 HB2 TYR 90 8.335 13.759 -4.013 727 HB3 TYR 90 HB3 TYR 90 9.917 14.415 -3.689 728 HD1 TYR 90 HD1 TYR 90 8.085 11.724 -5.574 729 HD2 TYR 90 HD2 TYR 90 11.833 13.800 -4.972 730 HE1 TYR 90 HE1 TYR 90 8.901 10.827 -7.677 731 HE2 TYR 90 HE2 TYR 90 12.664 12.884 -7.093 732 HH TYR 90 HH TYR 90 12.003 11.858 -9.099 733 H GLY 91 H GLY 91 7.284 12.474 -1.222 734 HA2 GLY 91 HA2 GLY 91 6.620 13.264 0.870 735 HA3 GLY 91 HA3 GLY 91 8.025 14.344 0.944 736 H ASN 92 H ASN 92 6.650 14.625 -2.188 737 HA ASN 92 HA ASN 92 5.680 17.280 -1.579 738 HB2 ASN 92 HB2 ASN 92 5.324 15.558 -4.067 739 HB3 ASN 92 HB3 ASN 92 4.917 17.267 -3.941 740 HD21 ASN 92 HD21 ASN 92 7.273 15.355 -5.259 741 HD22 ASN 92 HD22 ASN 92 8.620 16.454 -4.986 742 H GLU 93 H GLU 93 3.589 18.028 -1.440 743 HA GLU 93 HA GLU 93 1.561 16.169 -0.610 744 HB2 GLU 93 HB2 GLU 93 1.981 19.157 -0.871 745 HB3 GLU 93 HB3 GLU 93 0.343 18.535 -0.734 746 HG2 GLU 93 HG2 GLU 93 0.831 17.413 1.358 747 HG3 GLU 93 HG3 GLU 93 2.558 17.785 1.196 748 H VAL 94 H VAL 94 -0.208 15.605 -1.700 749 HA VAL 94 HA VAL 94 -0.598 16.545 -4.453 750 HB VAL 94 HB VAL 94 -1.086 14.427 -5.324 751 HG11 VAL 94 HG11 VAL 94 1.642 14.344 -3.973 752 HG12 VAL 94 HG12 VAL 94 1.153 13.505 -5.455 753 HG13 VAL 94 HG13 VAL 94 1.222 15.261 -5.436 754 HG21 VAL 94 HG21 VAL 94 -1.857 13.347 -3.245 755 HG22 VAL 94 HG22 VAL 94 -0.778 12.335 -4.225 756 HG23 VAL 94 HG23 VAL 94 -0.144 13.123 -2.768 757 H ASP 95 H ASP 95 -3.009 15.548 -5.099 758 HA ASP 95 HA ASP 95 -4.622 17.195 -3.355 759 HB2 ASP 95 HB2 ASP 95 -5.481 15.260 -5.560 760 HB3 ASP 95 HB3 ASP 95 -6.520 16.468 -4.812 761 H VAL 96 H VAL 96 -6.981 16.051 -2.943 762 HA VAL 96 HA VAL 96 -6.325 13.877 -1.038 763 HB VAL 96 HB VAL 96 -8.126 14.712 0.222 764 HG11 VAL 96 HG11 VAL 96 -7.046 17.355 -0.790 765 HG12 VAL 96 HG12 VAL 96 -7.360 16.836 0.873 766 HG13 VAL 96 HG13 VAL 96 -5.968 16.227 -0.010 767 HG21 VAL 96 HG21 VAL 96 -9.869 15.210 -1.451 768 HG22 VAL 96 HG22 VAL 96 -9.566 16.680 -0.520 769 HG23 VAL 96 HG23 VAL 96 -8.883 16.526 -2.127 770 H VAL 97 H VAL 97 -7.879 12.385 -0.530 771 HA VAL 97 HA VAL 97 -8.957 11.033 -2.890 772 HB VAL 97 HB VAL 97 -9.625 10.336 0.004 773 HG11 VAL 97 HG11 VAL 97 -9.325 8.658 -2.544 774 HG12 VAL 97 HG12 VAL 97 -9.808 8.048 -0.950 775 HG13 VAL 97 HG13 VAL 97 -10.862 9.173 -1.830 776 HG21 VAL 97 HG21 VAL 97 -7.702 8.780 0.011 777 HG22 VAL 97 HG22 VAL 97 -7.165 9.447 -1.539 778 HG23 VAL 97 HG23 VAL 97 -7.160 10.456 -0.070 779 H THR 98 H THR 98 -11.061 11.375 -3.726 780 HA THR 98 HA THR 98 -12.454 13.644 -2.792 781 HB THR 98 HB THR 98 -14.007 13.239 -4.523 782 HG1 THR 98 HG1 THR 98 -14.337 11.243 -5.433 783 HG21 THR 98 HG21 THR 98 -12.750 12.729 -6.496 784 HG22 THR 98 HG22 THR 98 -11.680 13.602 -5.394 785 HG23 THR 98 HG23 THR 98 -11.526 11.840 -5.587 786 HA PRO 99 HA PRO 99 -14.883 12.167 0.485 787 HB2 PRO 99 HB2 PRO 99 -17.429 13.156 0.071 788 HB3 PRO 99 HB3 PRO 99 -16.026 14.119 0.622 789 HG2 PRO 99 HG2 PRO 99 -17.070 13.808 -2.195 790 HG3 PRO 99 HG3 PRO 99 -16.649 15.310 -1.301 791 HD2 PRO 99 HD2 PRO 99 -14.896 14.225 -3.001 792 HD3 PRO 99 HD3 PRO 99 -14.323 14.847 -1.431 793 H GLU 100 H GLU 100 -16.434 11.586 -2.676 794 HA GLU 100 HA GLU 100 -17.941 9.307 -1.683 795 HB2 GLU 100 HB2 GLU 100 -17.408 10.424 -4.463 796 HB3 GLU 100 HB3 GLU 100 -18.405 8.997 -4.152 797 HG2 GLU 100 HG2 GLU 100 -19.814 10.383 -2.567 798 HG3 GLU 100 HG3 GLU 100 -18.875 11.813 -3.036 799 H GLN 101 H GLN 101 -14.760 9.725 -3.328 800 HA GLN 101 HA GLN 101 -14.573 6.860 -3.827 801 HB2 GLN 101 HB2 GLN 101 -12.559 9.101 -4.167 802 HB3 GLN 101 HB3 GLN 101 -12.230 7.411 -4.515 803 HG2 GLN 101 HG2 GLN 101 -14.134 7.314 -6.106 804 HG3 GLN 101 HG3 GLN 101 -14.528 8.987 -5.775 805 HE21 GLN 101 HE21 GLN 101 -11.645 7.001 -6.943 806 HE22 GLN 101 HE22 GLN 101 -11.173 8.254 -8.063 807 H ALA 102 H ALA 102 -13.601 9.000 -1.175 808 HA ALA 102 HA ALA 102 -11.671 7.130 -0.067 809 HB1 ALA 102 HB1 ALA 102 -11.857 8.503 1.976 810 HB2 ALA 102 HB2 ALA 102 -11.729 9.558 0.548 811 HB3 ALA 102 HB3 ALA 102 -13.299 9.309 1.339 812 H LYS 103 H LYS 103 -15.077 7.935 0.744 813 HA LYS 103 HA LYS 103 -15.336 5.859 2.633 814 HB2 LYS 103 HB2 LYS 103 -17.693 6.309 2.615 815 HB3 LYS 103 HB3 LYS 103 -16.862 7.853 2.425 816 HG2 LYS 103 HG2 LYS 103 -17.276 7.753 -0.033 817 HG3 LYS 103 HG3 LYS 103 -18.188 6.249 0.176 818 HD2 LYS 103 HD2 LYS 103 -18.913 8.920 1.436 819 HD3 LYS 103 HD3 LYS 103 -19.631 8.226 -0.038 820 HE2 LYS 103 HE2 LYS 103 -20.431 6.269 1.222 821 HE3 LYS 103 HE3 LYS 103 -19.662 6.874 2.697 822 HZ1 LYS 103 HZ1 LYS 103 -21.891 8.130 1.251 823 HZ2 LYS 103 HZ2 LYS 103 -21.936 7.411 2.735 824 HZ3 LYS 103 HZ3 LYS 103 -21.119 8.807 2.573 825 H TYR 104 H TYR 104 -15.652 5.730 -0.867 826 HA TYR 104 HA TYR 104 -17.173 3.452 -1.266 827 HB2 TYR 104 HB2 TYR 104 -16.374 4.846 -3.074 828 HB3 TYR 104 HB3 TYR 104 -14.708 4.494 -2.694 829 HD1 TYR 104 HD1 TYR 104 -17.691 3.300 -4.472 830 HD2 TYR 104 HD2 TYR 104 -13.669 2.314 -3.204 831 HE1 TYR 104 HE1 TYR 104 -17.546 1.575 -6.236 832 HE2 TYR 104 HE2 TYR 104 -13.543 0.587 -4.930 833 HH TYR 104 HH TYR 104 -14.500 -0.072 -6.963 834 H ALA 105 H ALA 105 -13.912 3.716 0.056 835 HA ALA 105 HA ALA 105 -12.828 1.185 -0.321 836 HB1 ALA 105 HB1 ALA 105 -11.683 3.107 0.683 837 HB2 ALA 105 HB2 ALA 105 -12.764 3.031 2.104 838 HB3 ALA 105 HB3 ALA 105 -11.630 1.719 1.787 839 H TYR 106 H TYR 106 -15.500 2.194 1.856 840 HA TYR 106 HA TYR 106 -15.493 0.040 3.626 841 HB2 TYR 106 HB2 TYR 106 -17.441 0.873 4.392 842 HB3 TYR 106 HB3 TYR 106 -16.974 2.277 3.472 843 HD1 TYR 106 HD1 TYR 106 -17.955 2.249 0.882 844 HD2 TYR 106 HD2 TYR 106 -19.577 -0.002 4.192 845 HE1 TYR 106 HE1 TYR 106 -20.132 2.090 -0.277 846 HE2 TYR 106 HE2 TYR 106 -21.635 -0.366 2.959 847 HH TYR 106 HH TYR 106 -22.860 0.184 1.075 848 H GLN 107 H GLN 107 -16.708 0.198 0.306 849 HA GLN 107 HA GLN 107 -18.171 -2.264 0.345 850 HB2 GLN 107 HB2 GLN 107 -16.777 -0.813 -1.933 851 HB3 GLN 107 HB3 GLN 107 -17.869 -2.199 -2.106 852 HG2 GLN 107 HG2 GLN 107 -19.595 -0.713 -0.835 853 HG3 GLN 107 HG3 GLN 107 -18.526 0.630 -1.314 854 HE21 GLN 107 HE21 GLN 107 -18.200 1.004 -3.668 855 HE22 GLN 107 HE22 GLN 107 -19.461 0.473 -4.761 856 H ARG 108 H ARG 108 -14.787 -1.393 -0.297 857 HA ARG 108 HA ARG 108 -14.013 -4.039 -1.258 858 HB2 ARG 108 HB2 ARG 108 -12.119 -1.927 -0.167 859 HB3 ARG 108 HB3 ARG 108 -11.800 -3.160 -1.381 860 HG2 ARG 108 HG2 ARG 108 -13.537 -0.667 -1.710 861 HG3 ARG 108 HG3 ARG 108 -11.933 -0.906 -2.380 862 HD2 ARG 108 HD2 ARG 108 -14.126 -2.874 -3.112 863 HD3 ARG 108 HD3 ARG 108 -14.150 -1.262 -3.795 864 HE ARG 108 HE ARG 108 -11.560 -2.592 -4.119 865 HH11 ARG 108 HH11 ARG 108 -14.864 -2.400 -5.407 866 HH12 ARG 108 HH12 ARG 108 -14.395 -2.814 -7.022 867 HH21 ARG 108 HH21 ARG 108 -10.945 -3.123 -6.362 868 HH22 ARG 108 HH22 ARG 108 -12.147 -3.018 -7.583 869 H TYR 109 H TYR 109 -13.879 -2.254 1.838 870 HA TYR 109 HA TYR 109 -12.454 -4.185 3.322 871 HB2 TYR 109 HB2 TYR 109 -12.950 -1.996 4.223 872 HB3 TYR 109 HB3 TYR 109 -14.680 -2.278 4.176 873 HD1 TYR 109 HD1 TYR 109 -15.786 -3.923 5.725 874 HD2 TYR 109 HD2 TYR 109 -11.614 -2.882 6.105 875 HE1 TYR 109 HE1 TYR 109 -15.670 -5.168 7.829 876 HE2 TYR 109 HE2 TYR 109 -11.540 -4.077 8.265 877 HH TYR 109 HH TYR 109 -12.691 -5.983 9.453 878 H GLN 110 H GLN 110 -15.985 -3.830 2.893 879 HA GLN 110 HA GLN 110 -16.596 -6.171 4.360 880 HB2 GLN 110 HB2 GLN 110 -18.866 -5.991 3.635 881 HB3 GLN 110 HB3 GLN 110 -18.218 -4.445 4.155 882 HG2 GLN 110 HG2 GLN 110 -17.843 -3.931 1.695 883 HG3 GLN 110 HG3 GLN 110 -18.782 -5.377 1.313 884 HE21 GLN 110 HE21 GLN 110 -20.426 -4.045 0.229 885 HE22 GLN 110 HE22 GLN 110 -21.522 -3.063 1.182 886 H GLU 111 H GLU 111 -15.549 -5.793 1.087 887 HA GLU 111 HA GLU 111 -16.782 -8.131 -0.010 888 HB2 GLU 111 HB2 GLU 111 -15.670 -7.627 -1.782 889 HB3 GLU 111 HB3 GLU 111 -15.371 -6.099 -1.031 890 HG2 GLU 111 HG2 GLU 111 -13.357 -6.446 -1.895 891 HG3 GLU 111 HG3 GLU 111 -13.050 -7.305 -0.405 892 H ARG 112 H ARG 112 -13.799 -7.597 1.420 893 HA ARG 112 HA ARG 112 -13.181 -10.528 1.737 894 HB2 ARG 112 HB2 ARG 112 -11.547 -8.000 1.753 895 HB3 ARG 112 HB3 ARG 112 -10.884 -9.373 2.621 896 HG2 ARG 112 HG2 ARG 112 -11.844 -9.662 -0.247 897 HG3 ARG 112 HG3 ARG 112 -10.205 -9.133 0.146 898 HD2 ARG 112 HD2 ARG 112 -9.734 -11.172 1.343 899 HD3 ARG 112 HD3 ARG 112 -11.416 -11.687 1.268 900 HE ARG 112 HE ARG 112 -11.239 -11.923 -1.133 901 HH11 ARG 112 HH11 ARG 112 -8.061 -11.756 0.517 902 HH12 ARG 112 HH12 ARG 112 -7.365 -13.044 -0.415 903 HH21 ARG 112 HH21 ARG 112 -10.217 -13.498 -2.466 904 HH22 ARG 112 HH22 ARG 112 -8.615 -14.033 -2.125 905 H TYR 113 H TYR 113 -13.694 -7.805 3.916 906 HA TYR 113 HA TYR 113 -13.188 -9.558 6.262 907 HB2 TYR 113 HB2 TYR 113 -12.922 -6.546 6.073 908 HB3 TYR 113 HB3 TYR 113 -12.471 -7.575 7.421 909 HD1 TYR 113 HD1 TYR 113 -11.193 -5.869 4.601 910 HD2 TYR 113 HD2 TYR 113 -10.784 -9.557 6.791 911 HE1 TYR 113 HE1 TYR 113 -8.970 -6.261 3.504 912 HE2 TYR 113 HE2 TYR 113 -8.636 -10.001 5.678 913 HH TYR 113 HH TYR 113 -6.981 -9.006 4.454 914 H GLY 114 H GLY 114 -15.698 -8.999 4.583 915 HA2 GLY 114 HA2 GLY 114 -17.517 -8.786 6.872 916 HA3 GLY 114 HA3 GLY 114 -17.674 -7.506 5.653 917 H ASN 115 H ASN 115 -19.884 -8.637 5.524 918 HA ASN 115 HA ASN 115 -19.853 -10.332 3.176 919 HB2 ASN 115 HB2 ASN 115 -21.162 -12.185 4.205 920 HB3 ASN 115 HB3 ASN 115 -19.492 -12.112 4.740 921 HD21 ASN 115 HD21 ASN 115 -19.023 -11.619 7.013 922 HD22 ASN 115 HD22 ASN 115 -20.324 -11.573 8.164 923 H LYS 116 H LYS 116 -21.715 -10.086 2.009 924 HA LYS 116 HA LYS 116 -24.229 -9.272 3.068 925 HB2 LYS 116 HB2 LYS 116 -24.367 -7.280 1.697 926 HB3 LYS 116 HB3 LYS 116 -23.185 -7.101 2.967 927 HG2 LYS 116 HG2 LYS 116 -22.436 -5.978 1.001 928 HG3 LYS 116 HG3 LYS 116 -21.355 -7.337 1.295 929 HD2 LYS 116 HD2 LYS 116 -22.198 -8.551 -0.560 930 HD3 LYS 116 HD3 LYS 116 -23.712 -7.609 -0.595 931 HE2 LYS 116 HE2 LYS 116 -22.520 -5.653 -1.415 932 HE3 LYS 116 HE3 LYS 116 -20.983 -6.525 -1.348 933 HZ1 LYS 116 HZ1 LYS 116 -21.950 -8.111 -2.982 934 HZ2 LYS 116 HZ2 LYS 116 -23.321 -7.249 -3.006 935 HZ3 LYS 116 HZ3 LYS 116 -21.909 -6.595 -3.583 936 H LYS 117 H LYS 117 -25.724 -9.030 0.988 937 HA LYS 117 HA LYS 117 -25.015 -10.167 -1.481 938 HB2 LYS 117 HB2 LYS 117 -24.869 -12.295 -0.159 939 HB3 LYS 117 HB3 LYS 117 -26.507 -12.057 0.426 940 HG2 LYS 117 HG2 LYS 117 -27.432 -12.454 -1.775 941 HG3 LYS 117 HG3 LYS 117 -25.844 -12.250 -2.533 942 HD2 LYS 117 HD2 LYS 117 -26.326 -14.566 -2.551 943 HD3 LYS 117 HD3 LYS 117 -25.080 -14.327 -1.331 944 HE2 LYS 117 HE2 LYS 117 -26.828 -14.403 0.453 945 HE3 LYS 117 HE3 LYS 117 -28.078 -14.615 -0.786 946 HZ1 LYS 117 HZ1 LYS 117 -26.953 -16.675 -1.433 947 HZ2 LYS 117 HZ2 LYS 117 -25.856 -16.473 -0.223 948 HZ3 LYS 117 HZ3 LYS 117 -27.450 -16.723 0.141 949 H SER 118 H SER 118 -27.307 -10.632 -2.624 950 HA SER 118 HA SER 118 -29.481 -9.067 -1.422 951 HB2 SER 118 HB2 SER 118 -29.979 -7.954 -3.535 952 HB3 SER 118 HB3 SER 118 -28.494 -7.361 -2.785 953 HG SER 118 HG SER 118 -28.721 -7.914 -5.182 954 H GLN 119 H GLN 119 -29.067 -10.342 -4.673 955 HA GLN 119 HA GLN 119 -30.094 -11.987 -5.844 956 HB2 GLN 119 HB2 GLN 119 -29.737 -13.547 -3.262 957 HB3 GLN 119 HB3 GLN 119 -30.261 -14.250 -4.792 958 HG2 GLN 119 HG2 GLN 119 -27.603 -12.778 -4.431 959 HG3 GLN 119 HG3 GLN 119 -27.814 -14.523 -4.313 960 HE21 GLN 119 HE21 GLN 119 -27.299 -11.899 -6.574 961 HE22 GLN 119 HE22 GLN 119 -27.651 -12.763 -8.025 962 H ASP 120 H ASP 120 -31.647 -10.186 -5.572 963 HA ASP 120 HA ASP 120 -34.325 -11.049 -4.693 964 HB2 ASP 120 HB2 ASP 120 -34.063 -9.277 -3.259 965 HB3 ASP 120 HB3 ASP 120 -32.692 -8.635 -4.159 966 H LEU 121 H LEU 121 -35.886 -10.660 -6.255 967 HA LEU 121 HA LEU 121 -35.427 -9.163 -8.588 968 HB2 LEU 121 HB2 LEU 121 -35.580 -10.951 -10.205 969 HB3 LEU 121 HB3 LEU 121 -34.242 -11.295 -9.142 970 HG LEU 121 HG LEU 121 -35.169 -13.308 -9.483 971 HD11 LEU 121 HD11 LEU 121 -34.861 -13.075 -7.082 972 HD12 LEU 121 HD12 LEU 121 -36.598 -12.719 -6.907 973 HD13 LEU 121 HD13 LEU 121 -36.072 -14.289 -7.524 974 HD21 LEU 121 HD21 LEU 121 -37.429 -14.017 -9.646 975 HD22 LEU 121 HD22 LEU 121 -38.041 -12.496 -8.991 976 HD23 LEU 121 HD23 LEU 121 -37.286 -12.529 -10.595 977 H LYS 122 H LYS 122 -37.530 -9.330 -10.039 978 HA LYS 122 HA LYS 122 -39.906 -10.476 -9.137 979 HB2 LYS 122 HB2 LYS 122 -41.083 -8.387 -8.562 980 HB3 LYS 122 HB3 LYS 122 -39.816 -8.730 -7.377 981 HG2 LYS 122 HG2 LYS 122 -38.296 -7.129 -8.647 982 HG3 LYS 122 HG3 LYS 122 -39.683 -6.717 -9.678 983 HD2 LYS 122 HD2 LYS 122 -40.921 -5.922 -7.702 984 HD3 LYS 122 HD3 LYS 122 -39.551 -6.402 -6.654 985 HE2 LYS 122 HE2 LYS 122 -38.052 -4.939 -8.040 986 HE3 LYS 122 HE3 LYS 122 -39.472 -4.375 -8.937 987 HZ1 LYS 122 HZ1 LYS 122 -38.877 -2.868 -7.159 988 HZ2 LYS 122 HZ2 LYS 122 -40.350 -3.548 -6.831 989 HZ3 LYS 122 HZ3 LYS 122 -38.997 -4.073 -6.041 Start of MODEL 20 1 H1 GLY 1 H GLY 1 31.905 -3.540 1.460 2 HA2 GLY 1 HA2 GLY 1 33.526 -5.882 2.333 3 HA3 GLY 1 HA3 GLY 1 32.910 -4.590 3.409 4 H SER 2 H SER 2 31.346 -5.724 4.701 5 HA SER 2 HA SER 2 29.605 -7.712 3.623 6 HB2 SER 2 HB2 SER 2 28.549 -6.889 6.007 7 HB3 SER 2 HB3 SER 2 29.880 -8.042 5.874 8 HG SER 2 HG SER 2 30.142 -6.139 7.352 9 H ASN 3 H ASN 3 27.177 -7.411 3.717 10 HA ASN 3 HA ASN 3 26.266 -4.622 3.241 11 HB2 ASN 3 HB2 ASN 3 25.909 -6.926 1.294 12 HB3 ASN 3 HB3 ASN 3 24.868 -5.504 1.318 13 HD21 ASN 3 HD21 ASN 3 28.023 -6.724 0.425 14 HD22 ASN 3 HD22 ASN 3 28.599 -5.254 -0.331 15 H GLN 4 H GLN 4 24.715 -7.842 2.899 16 HA GLN 4 HA GLN 4 23.129 -8.920 4.023 17 HB2 GLN 4 HB2 GLN 4 24.688 -7.914 6.044 18 HB3 GLN 4 HB3 GLN 4 23.121 -7.270 6.504 19 HG2 GLN 4 HG2 GLN 4 23.635 -10.203 5.849 20 HG3 GLN 4 HG3 GLN 4 23.870 -9.533 7.464 21 HE21 GLN 4 HE21 GLN 4 22.027 -8.806 8.669 22 HE22 GLN 4 HE22 GLN 4 20.386 -9.303 8.226 23 H GLN 5 H GLN 5 20.715 -8.649 4.856 24 HA GLN 5 HA GLN 5 19.593 -6.021 4.421 25 HB2 GLN 5 HB2 GLN 5 19.871 -6.854 2.107 26 HB3 GLN 5 HB3 GLN 5 18.949 -8.301 2.495 27 HG2 GLN 5 HG2 GLN 5 16.911 -7.048 2.700 28 HG3 GLN 5 HG3 GLN 5 17.762 -5.512 2.802 29 HE21 GLN 5 HE21 GLN 5 15.670 -6.864 0.900 30 HE22 GLN 5 HE22 GLN 5 16.246 -6.357 -0.684 31 H LEU 6 H LEU 6 17.234 -6.081 4.740 32 HA LEU 6 HA LEU 6 16.470 -7.360 7.149 33 HB2 LEU 6 HB2 LEU 6 15.210 -5.619 5.059 34 HB3 LEU 6 HB3 LEU 6 14.067 -6.656 5.874 35 HG LEU 6 HG LEU 6 14.271 -4.415 6.880 36 HD11 LEU 6 HD11 LEU 6 13.465 -6.384 8.150 37 HD12 LEU 6 HD12 LEU 6 15.116 -6.643 8.783 38 HD13 LEU 6 HD13 LEU 6 14.212 -5.159 9.174 39 HD21 LEU 6 HD21 LEU 6 16.716 -4.133 6.489 40 HD22 LEU 6 HD22 LEU 6 16.229 -3.760 8.144 41 HD23 LEU 6 HD23 LEU 6 17.047 -5.289 7.805 42 H ASN 7 H ASN 7 15.873 -8.288 3.789 43 HA ASN 7 HA ASN 7 14.880 -10.011 2.799 44 HB2 ASN 7 HB2 ASN 7 16.913 -10.967 4.152 45 HB3 ASN 7 HB3 ASN 7 15.676 -11.766 5.116 46 HD21 ASN 7 HD21 ASN 7 16.977 -11.371 1.830 47 HD22 ASN 7 HD22 ASN 7 16.382 -12.866 1.144 48 H ALA 8 H ALA 8 13.489 -12.315 3.608 49 HA ALA 8 HA ALA 8 10.930 -11.095 4.411 50 HB1 ALA 8 HB1 ALA 8 10.845 -12.518 2.428 51 HB2 ALA 8 HB2 ALA 8 11.644 -13.842 3.301 52 HB3 ALA 8 HB3 ALA 8 10.012 -13.321 3.770 53 H THR 9 H THR 9 11.058 -10.788 6.575 54 HA THR 9 HA THR 9 12.366 -12.374 8.455 55 HB THR 9 HB THR 9 9.731 -10.918 8.926 56 HG1 THR 9 HG1 THR 9 10.732 -9.026 8.947 57 HG21 THR 9 HG21 THR 9 10.704 -12.034 10.888 58 HG22 THR 9 HG22 THR 9 12.234 -11.161 10.631 59 HG23 THR 9 HG23 THR 9 10.761 -10.277 11.066 60 H LYS 10 H LYS 10 9.132 -12.655 7.072 61 HA LYS 10 HA LYS 10 8.761 -15.451 7.817 62 HB2 LYS 10 HB2 LYS 10 8.225 -14.434 9.956 63 HB3 LYS 10 HB3 LYS 10 7.224 -13.201 9.167 64 HG2 LYS 10 HG2 LYS 10 5.522 -14.860 8.604 65 HG3 LYS 10 HG3 LYS 10 6.576 -16.167 9.162 66 HD2 LYS 10 HD2 LYS 10 4.927 -15.722 10.809 67 HD3 LYS 10 HD3 LYS 10 6.509 -15.252 11.436 68 HE2 LYS 10 HE2 LYS 10 4.513 -13.240 10.286 69 HE3 LYS 10 HE3 LYS 10 4.477 -13.769 11.966 70 HZ1 LYS 10 HZ1 LYS 10 6.840 -13.027 12.115 71 HZ2 LYS 10 HZ2 LYS 10 6.650 -12.219 10.704 72 HZ3 LYS 10 HZ3 LYS 10 5.732 -11.847 12.001 73 H LYS 11 H LYS 11 7.281 -12.440 6.787 74 HA LYS 11 HA LYS 11 5.395 -13.798 4.879 75 HB2 LYS 11 HB2 LYS 11 5.374 -11.067 6.225 76 HB3 LYS 11 HB3 LYS 11 4.190 -11.546 5.021 77 HG2 LYS 11 HG2 LYS 11 4.560 -13.058 7.640 78 HG3 LYS 11 HG3 LYS 11 3.496 -11.667 7.505 79 HD2 LYS 11 HD2 LYS 11 2.061 -12.722 5.946 80 HD3 LYS 11 HD3 LYS 11 3.217 -14.030 5.647 81 HE2 LYS 11 HE2 LYS 11 2.966 -14.788 7.995 82 HE3 LYS 11 HE3 LYS 11 1.785 -13.494 8.286 83 HZ1 LYS 11 HZ1 LYS 11 1.401 -15.593 6.249 84 HZ2 LYS 11 HZ2 LYS 11 0.839 -15.701 7.802 85 HZ3 LYS 11 HZ3 LYS 11 0.277 -14.533 6.821 86 H ASP 12 H ASP 12 5.926 -13.747 2.867 87 HA ASP 12 HA ASP 12 8.062 -12.229 1.733 88 HB2 ASP 12 HB2 ASP 12 5.733 -13.814 0.600 89 HB3 ASP 12 HB3 ASP 12 6.907 -13.018 -0.426 90 H LYS 13 H LYS 13 4.531 -11.734 1.892 91 HA LYS 13 HA LYS 13 4.461 -9.646 -0.125 92 HB2 LYS 13 HB2 LYS 13 2.535 -10.255 2.129 93 HB3 LYS 13 HB3 LYS 13 2.190 -9.183 0.779 94 HG2 LYS 13 HG2 LYS 13 2.879 -12.130 0.376 95 HG3 LYS 13 HG3 LYS 13 1.241 -11.600 0.674 96 HD2 LYS 13 HD2 LYS 13 2.894 -10.503 -1.625 97 HD3 LYS 13 HD3 LYS 13 1.947 -11.972 -1.770 98 HE2 LYS 13 HE2 LYS 13 0.673 -9.363 -0.885 99 HE3 LYS 13 HE3 LYS 13 0.897 -9.767 -2.597 100 HZ1 LYS 13 HZ1 LYS 13 -0.757 -11.242 -0.650 101 HZ2 LYS 13 HZ2 LYS 13 -1.267 -10.410 -1.984 102 HZ3 LYS 13 HZ3 LYS 13 -0.447 -11.774 -2.198 103 H LEU 14 H LEU 14 4.581 -9.689 3.474 104 HA LEU 14 HA LEU 14 4.653 -6.845 3.671 105 HB2 LEU 14 HB2 LEU 14 5.828 -8.890 5.593 106 HB3 LEU 14 HB3 LEU 14 5.497 -7.200 5.954 107 HG LEU 14 HG LEU 14 3.385 -9.268 5.211 108 HD11 LEU 14 HD11 LEU 14 2.744 -9.248 7.551 109 HD12 LEU 14 HD12 LEU 14 4.501 -9.530 7.508 110 HD13 LEU 14 HD13 LEU 14 3.886 -7.935 7.916 111 HD21 LEU 14 HD21 LEU 14 1.764 -7.569 5.979 112 HD22 LEU 14 HD22 LEU 14 3.082 -6.415 6.237 113 HD23 LEU 14 HD23 LEU 14 2.674 -6.977 4.590 114 H GLN 15 H GLN 15 7.249 -9.203 3.027 115 HA GLN 15 HA GLN 15 9.443 -7.605 3.710 116 HB2 GLN 15 HB2 GLN 15 9.720 -9.923 3.099 117 HB3 GLN 15 HB3 GLN 15 9.088 -9.651 1.496 118 HG2 GLN 15 HG2 GLN 15 11.078 -8.172 0.975 119 HG3 GLN 15 HG3 GLN 15 11.733 -8.604 2.552 120 HE21 GLN 15 HE21 GLN 15 10.039 -10.703 0.107 121 HE22 GLN 15 HE22 GLN 15 11.389 -11.817 -0.034 122 H VAL 16 H VAL 16 7.803 -7.617 0.441 123 HA VAL 16 HA VAL 16 9.655 -5.629 -0.502 124 HB VAL 16 HB VAL 16 8.311 -5.469 -2.485 125 HG11 VAL 16 HG11 VAL 16 8.464 -7.751 -3.242 126 HG12 VAL 16 HG12 VAL 16 9.794 -7.467 -2.107 127 HG13 VAL 16 HG13 VAL 16 8.360 -8.384 -1.591 128 HG21 VAL 16 HG21 VAL 16 6.024 -5.442 -1.756 129 HG22 VAL 16 HG22 VAL 16 6.226 -6.906 -2.730 130 HG23 VAL 16 HG23 VAL 16 6.184 -7.042 -0.981 131 H ILE 17 H ILE 17 6.530 -5.344 1.140 132 HA ILE 17 HA ILE 17 6.285 -2.519 0.598 133 HB ILE 17 HB ILE 17 4.937 -3.998 2.864 134 HG12 ILE 17 HG12 ILE 17 3.852 -3.769 0.005 135 HG13 ILE 17 HG13 ILE 17 4.576 -5.226 0.664 136 HG21 ILE 17 HG21 ILE 17 4.767 -1.500 2.783 137 HG22 ILE 17 HG22 ILE 17 4.067 -1.599 1.165 138 HG23 ILE 17 HG23 ILE 17 3.194 -2.260 2.562 139 HD11 ILE 17 HD11 ILE 17 1.967 -3.965 1.446 140 HD12 ILE 17 HD12 ILE 17 2.343 -5.648 1.032 141 HD13 ILE 17 HD13 ILE 17 2.852 -5.030 2.589 142 H ASP 18 H ASP 18 7.567 -4.492 3.237 143 HA ASP 18 HA ASP 18 8.150 -2.428 5.110 144 HB2 ASP 18 HB2 ASP 18 8.022 -4.884 5.543 145 HB3 ASP 18 HB3 ASP 18 9.561 -5.093 4.695 146 H TRP 19 H TRP 19 9.898 -3.701 2.304 147 HA TRP 19 HA TRP 19 12.369 -2.292 2.796 148 HB2 TRP 19 HB2 TRP 19 12.407 -4.246 1.400 149 HB3 TRP 19 HB3 TRP 19 11.126 -3.640 0.369 150 HD1 TRP 19 HD1 TRP 19 11.748 -2.182 -1.663 151 HE1 TRP 19 HE1 TRP 19 13.961 -1.360 -2.722 152 HE3 TRP 19 HE3 TRP 19 15.020 -3.411 2.092 153 HZ2 TRP 19 HZ2 TRP 19 16.755 -1.469 -2.165 154 HZ3 TRP 19 HZ3 TRP 19 17.445 -3.029 1.793 155 HH2 TRP 19 HH2 TRP 19 18.325 -2.096 -0.335 156 H LEU 20 H LEU 20 9.638 -1.676 0.429 157 HA LEU 20 HA LEU 20 10.678 0.792 -0.407 158 HB2 LEU 20 HB2 LEU 20 8.644 1.259 -1.473 159 HB3 LEU 20 HB3 LEU 20 9.065 -0.441 -1.667 160 HG LEU 20 HG LEU 20 7.398 -0.666 0.413 161 HD11 LEU 20 HD11 LEU 20 6.859 1.750 0.609 162 HD12 LEU 20 HD12 LEU 20 6.281 1.747 -1.061 163 HD13 LEU 20 HD13 LEU 20 5.438 0.801 0.189 164 HD21 LEU 20 HD21 LEU 20 6.436 -0.375 -2.427 165 HD22 LEU 20 HD22 LEU 20 7.178 -1.836 -1.706 166 HD23 LEU 20 HD23 LEU 20 5.618 -1.263 -1.117 167 H ILE 21 H ILE 21 8.695 0.112 2.425 168 HA ILE 21 HA ILE 21 7.829 2.729 3.067 169 HB ILE 21 HB ILE 21 8.375 0.153 4.553 170 HG12 ILE 21 HG12 ILE 21 5.823 1.812 4.440 171 HG13 ILE 21 HG13 ILE 21 6.242 0.647 3.206 172 HG21 ILE 21 HG21 ILE 21 7.570 2.667 6.045 173 HG22 ILE 21 HG22 ILE 21 7.653 0.994 6.694 174 HG23 ILE 21 HG23 ILE 21 9.110 1.791 6.223 175 HD11 ILE 21 HD11 ILE 21 6.297 -1.144 5.000 176 HD12 ILE 21 HD12 ILE 21 5.712 0.071 6.153 177 HD13 ILE 21 HD13 ILE 21 4.713 -0.379 4.793 178 H GLU 22 H GLU 22 10.797 0.969 3.930 179 HA GLU 22 HA GLU 22 11.950 3.210 5.341 180 HB2 GLU 22 HB2 GLU 22 12.052 0.864 6.055 181 HB3 GLU 22 HB3 GLU 22 13.032 0.474 4.664 182 HG2 GLU 22 HG2 GLU 22 14.889 1.759 5.494 183 HG3 GLU 22 HG3 GLU 22 13.846 2.622 6.644 184 H ASN 23 H ASN 23 12.203 1.908 2.122 185 HA ASN 23 HA ASN 23 14.729 3.045 1.359 186 HB2 ASN 23 HB2 ASN 23 12.499 1.654 0.040 187 HB3 ASN 23 HB3 ASN 23 13.020 2.992 -0.941 188 HD21 ASN 23 HD21 ASN 23 15.021 0.770 1.140 189 HD22 ASN 23 HD22 ASN 23 15.936 0.181 -0.222 190 H PHE 24 H PHE 24 11.394 4.286 1.001 191 HA PHE 24 HA PHE 24 12.522 7.028 0.551 192 HB2 PHE 24 HB2 PHE 24 10.223 5.665 -0.786 193 HB3 PHE 24 HB3 PHE 24 10.264 7.431 -0.621 194 HD1 PHE 24 HD1 PHE 24 13.312 7.834 -1.235 195 HD2 PHE 24 HD2 PHE 24 10.086 5.689 -3.142 196 HE1 PHE 24 HE1 PHE 24 14.414 8.111 -3.410 197 HE2 PHE 24 HE2 PHE 24 11.224 5.939 -5.318 198 HZ PHE 24 HZ PHE 24 13.389 7.178 -5.466 199 HA PRO 25 HA PRO 25 10.155 6.864 4.482 200 HB2 PRO 25 HB2 PRO 25 11.945 8.223 6.060 201 HB3 PRO 25 HB3 PRO 25 12.154 6.521 5.570 202 HG2 PRO 25 HG2 PRO 25 13.313 8.996 4.248 203 HG3 PRO 25 HG3 PRO 25 14.206 7.553 4.836 204 HD2 PRO 25 HD2 PRO 25 13.411 7.826 2.275 205 HD3 PRO 25 HD3 PRO 25 13.381 6.228 3.078 206 H ASN 26 H ASN 26 9.827 8.867 2.172 207 HA ASN 26 HA ASN 26 9.707 11.483 3.528 208 HB2 ASN 26 HB2 ASN 26 8.754 10.502 0.843 209 HB3 ASN 26 HB3 ASN 26 8.332 12.096 1.434 210 HD21 ASN 26 HD21 ASN 26 11.161 10.144 0.444 211 HD22 ASN 26 HD22 ASN 26 12.246 11.513 0.325 212 H ALA 27 H ALA 27 7.618 8.706 3.173 213 HA ALA 27 HA ALA 27 5.621 9.649 4.970 214 HB1 ALA 27 HB1 ALA 27 3.792 9.577 3.040 215 HB2 ALA 27 HB2 ALA 27 4.769 11.049 3.142 216 HB3 ALA 27 HB3 ALA 27 5.161 9.836 1.920 217 H PHE 28 H PHE 28 5.252 7.555 5.874 218 HA PHE 28 HA PHE 28 3.926 5.562 4.564 219 HB2 PHE 28 HB2 PHE 28 6.842 5.265 4.175 220 HB3 PHE 28 HB3 PHE 28 6.099 3.881 4.927 221 HD1 PHE 28 HD1 PHE 28 3.560 3.392 3.787 222 HD2 PHE 28 HD2 PHE 28 7.008 5.108 1.825 223 HE1 PHE 28 HE1 PHE 28 2.584 2.819 1.584 224 HE2 PHE 28 HE2 PHE 28 5.985 4.528 -0.380 225 HZ PHE 28 HZ PHE 28 3.809 3.392 -0.505 226 H PHE 29 H PHE 29 3.838 3.444 6.032 227 HA PHE 29 HA PHE 29 4.684 3.837 8.784 228 HB2 PHE 29 HB2 PHE 29 1.764 3.898 7.928 229 HB3 PHE 29 HB3 PHE 29 2.287 3.545 9.572 230 HD1 PHE 29 HD1 PHE 29 1.411 6.186 7.299 231 HD2 PHE 29 HD2 PHE 29 3.965 5.279 10.659 232 HE1 PHE 29 HE1 PHE 29 1.812 8.625 7.671 233 HE2 PHE 29 HE2 PHE 29 4.295 7.701 11.056 234 HZ PHE 29 HZ PHE 29 3.249 9.358 9.554 235 H LYS 30 H LYS 30 4.247 1.806 10.056 236 HA LYS 30 HA LYS 30 3.832 -0.569 8.277 237 HB2 LYS 30 HB2 LYS 30 5.463 -0.476 10.812 238 HB3 LYS 30 HB3 LYS 30 5.251 -1.852 9.756 239 HG2 LYS 30 HG2 LYS 30 6.858 -1.176 8.319 240 HG3 LYS 30 HG3 LYS 30 6.235 0.458 8.300 241 HD2 LYS 30 HD2 LYS 30 8.330 0.788 9.167 242 HD3 LYS 30 HD3 LYS 30 7.346 0.780 10.626 243 HE2 LYS 30 HE2 LYS 30 8.073 -1.586 11.051 244 HE3 LYS 30 HE3 LYS 30 8.946 -1.581 9.509 245 HZ1 LYS 30 HZ1 LYS 30 10.439 -1.162 11.378 246 HZ2 LYS 30 HZ2 LYS 30 10.403 0.096 10.347 247 HZ3 LYS 30 HZ3 LYS 30 9.628 0.205 11.789 248 H LYS 31 H LYS 31 3.266 0.703 11.646 249 HA LYS 31 HA LYS 31 1.994 -1.584 12.581 250 HB2 LYS 31 HB2 LYS 31 2.661 0.994 13.604 251 HB3 LYS 31 HB3 LYS 31 0.947 0.786 13.860 252 HG2 LYS 31 HG2 LYS 31 2.039 -0.095 15.800 253 HG3 LYS 31 HG3 LYS 31 1.377 -1.454 14.891 254 HD2 LYS 31 HD2 LYS 31 3.793 -1.576 13.818 255 HD3 LYS 31 HD3 LYS 31 4.281 -0.596 15.199 256 HE2 LYS 31 HE2 LYS 31 3.353 -2.321 16.735 257 HE3 LYS 31 HE3 LYS 31 2.775 -3.244 15.343 258 HZ1 LYS 31 HZ1 LYS 31 5.555 -2.841 16.200 259 HZ2 LYS 31 HZ2 LYS 31 4.742 -4.227 16.000 260 HZ3 LYS 31 HZ3 LYS 31 5.205 -3.389 14.674 261 H GLY 32 H GLY 32 0.469 0.524 10.276 262 HA2 GLY 32 HA2 GLY 32 -1.684 0.107 9.364 263 HA3 GLY 32 HA3 GLY 32 -1.984 -1.050 10.654 264 H ASN 33 H ASN 33 -1.753 0.267 12.978 265 HA ASN 33 HA ASN 33 -4.070 1.777 13.268 266 HB2 ASN 33 HB2 ASN 33 -3.208 2.432 15.494 267 HB3 ASN 33 HB3 ASN 33 -3.087 0.717 15.152 268 HD21 ASN 33 HD21 ASN 33 -0.695 3.482 14.407 269 HD22 ASN 33 HD22 ASN 33 0.518 2.716 15.389 270 H GLN 34 H GLN 34 -1.000 2.949 12.185 271 HA GLN 34 HA GLN 34 -1.979 5.759 12.302 272 HB2 GLN 34 HB2 GLN 34 0.347 6.490 12.453 273 HB3 GLN 34 HB3 GLN 34 -0.106 5.469 13.817 274 HG2 GLN 34 HG2 GLN 34 1.017 3.519 12.743 275 HG3 GLN 34 HG3 GLN 34 1.438 4.527 11.378 276 HE21 GLN 34 HE21 GLN 34 2.277 6.925 13.156 277 HE22 GLN 34 HE22 GLN 34 3.777 6.369 13.826 278 H VAL 35 H VAL 35 -1.918 3.327 10.159 279 HA VAL 35 HA VAL 35 -0.386 4.439 8.003 280 HB VAL 35 HB VAL 35 -1.214 2.031 8.439 281 HG11 VAL 35 HG11 VAL 35 -3.555 2.861 6.694 282 HG12 VAL 35 HG12 VAL 35 -3.241 1.277 7.463 283 HG13 VAL 35 HG13 VAL 35 -3.715 2.684 8.433 284 HG21 VAL 35 HG21 VAL 35 -1.365 3.110 5.614 285 HG22 VAL 35 HG22 VAL 35 0.114 2.655 6.496 286 HG23 VAL 35 HG23 VAL 35 -1.091 1.430 6.099 287 H LYS 36 H LYS 36 -1.105 5.556 6.113 288 HA LYS 36 HA LYS 36 -3.821 6.721 6.188 289 HB2 LYS 36 HB2 LYS 36 -3.220 8.847 6.507 290 HB3 LYS 36 HB3 LYS 36 -1.850 8.146 7.317 291 HG2 LYS 36 HG2 LYS 36 -1.896 9.344 4.543 292 HG3 LYS 36 HG3 LYS 36 -1.157 9.994 5.999 293 HD2 LYS 36 HD2 LYS 36 0.382 7.970 6.028 294 HD3 LYS 36 HD3 LYS 36 -0.228 7.554 4.428 295 HE2 LYS 36 HE2 LYS 36 1.260 10.071 5.219 296 HE3 LYS 36 HE3 LYS 36 1.822 8.776 4.155 297 HZ1 LYS 36 HZ1 LYS 36 -0.267 9.495 2.776 298 HZ2 LYS 36 HZ2 LYS 36 -0.149 10.878 3.674 299 HZ3 LYS 36 HZ3 LYS 36 1.101 10.454 2.757 300 HA PRO 37 HA PRO 37 -3.519 6.010 1.868 301 HB2 PRO 37 HB2 PRO 37 -4.751 8.052 0.563 302 HB3 PRO 37 HB3 PRO 37 -5.647 6.970 1.622 303 HG2 PRO 37 HG2 PRO 37 -4.613 9.713 2.315 304 HG3 PRO 37 HG3 PRO 37 -6.202 8.954 2.659 305 HD2 PRO 37 HD2 PRO 37 -4.118 9.101 4.458 306 HD3 PRO 37 HD3 PRO 37 -5.342 7.804 4.488 307 H LEU 38 H LEU 38 -2.480 6.313 -0.024 308 HA LEU 38 HA LEU 38 -0.334 8.416 -0.194 309 HB2 LEU 38 HB2 LEU 38 -0.248 5.555 -1.237 310 HB3 LEU 38 HB3 LEU 38 0.993 6.772 -1.385 311 HG LEU 38 HG LEU 38 1.757 5.301 0.182 312 HD11 LEU 38 HD11 LEU 38 0.613 7.474 1.957 313 HD12 LEU 38 HD12 LEU 38 2.140 6.574 2.161 314 HD13 LEU 38 HD13 LEU 38 1.953 7.711 0.821 315 HD21 LEU 38 HD21 LEU 38 -0.271 4.095 0.680 316 HD22 LEU 38 HD22 LEU 38 0.682 4.471 2.126 317 HD23 LEU 38 HD23 LEU 38 -0.787 5.390 1.774 318 H LYS 39 H LYS 39 0.367 8.894 -2.441 319 HA LYS 39 HA LYS 39 -1.632 9.659 -4.162 320 HB2 LYS 39 HB2 LYS 39 0.502 10.603 -4.374 321 HB3 LYS 39 HB3 LYS 39 1.299 9.066 -4.598 322 HG2 LYS 39 HG2 LYS 39 -0.625 9.800 -6.822 323 HG3 LYS 39 HG3 LYS 39 0.750 10.878 -6.587 324 HD2 LYS 39 HD2 LYS 39 2.285 8.894 -6.680 325 HD3 LYS 39 HD3 LYS 39 0.891 7.888 -7.023 326 HE2 LYS 39 HE2 LYS 39 1.631 8.235 -9.152 327 HE3 LYS 39 HE3 LYS 39 0.517 9.603 -9.022 328 HZ1 LYS 39 HZ1 LYS 39 3.452 9.710 -8.597 329 HZ2 LYS 39 HZ2 LYS 39 2.704 10.175 -9.963 330 HZ3 LYS 39 HZ3 LYS 39 2.456 11.030 -8.626 331 H ILE 40 H ILE 40 -2.459 9.058 -5.994 332 HA ILE 40 HA ILE 40 -3.309 6.355 -6.381 333 HB ILE 40 HB ILE 40 -3.473 8.983 -7.899 334 HG12 ILE 40 HG12 ILE 40 -4.913 8.712 -5.906 335 HG13 ILE 40 HG13 ILE 40 -5.796 8.985 -7.398 336 HG21 ILE 40 HG21 ILE 40 -3.344 7.452 -9.661 337 HG22 ILE 40 HG22 ILE 40 -4.594 6.392 -8.973 338 HG23 ILE 40 HG23 ILE 40 -4.975 8.057 -9.539 339 HD11 ILE 40 HD11 ILE 40 -5.499 6.291 -5.987 340 HD12 ILE 40 HD12 ILE 40 -6.935 7.323 -6.008 341 HD13 ILE 40 HD13 ILE 40 -6.391 6.565 -7.506 342 H GLY 41 H GLY 41 -1.934 4.779 -7.076 343 HA2 GLY 41 HA2 GLY 41 -0.573 3.720 -8.636 344 HA3 GLY 41 HA3 GLY 41 -0.369 5.242 -9.503 345 H ILE 42 H ILE 42 0.384 5.272 -6.036 346 HA ILE 42 HA ILE 42 2.929 6.237 -6.340 347 HB ILE 42 HB ILE 42 1.715 6.452 -4.314 348 HG12 ILE 42 HG12 ILE 42 4.048 4.623 -3.548 349 HG13 ILE 42 HG13 ILE 42 4.319 6.156 -4.339 350 HG21 ILE 42 HG21 ILE 42 0.434 4.352 -4.215 351 HG22 ILE 42 HG22 ILE 42 1.926 3.420 -3.937 352 HG23 ILE 42 HG23 ILE 42 1.341 4.560 -2.719 353 HD11 ILE 42 HD11 ILE 42 4.588 6.481 -1.981 354 HD12 ILE 42 HD12 ILE 42 3.109 7.322 -2.475 355 HD13 ILE 42 HD13 ILE 42 3.027 5.745 -1.637 356 H PHE 43 H PHE 43 1.991 2.832 -6.568 357 HA PHE 43 HA PHE 43 4.527 1.630 -6.154 358 HB2 PHE 43 HB2 PHE 43 2.879 0.011 -6.356 359 HB3 PHE 43 HB3 PHE 43 1.965 0.922 -7.546 360 HD1 PHE 43 HD1 PHE 43 2.489 0.840 -9.949 361 HD2 PHE 43 HD2 PHE 43 4.658 -1.575 -7.128 362 HE1 PHE 43 HE1 PHE 43 3.530 -0.420 -11.817 363 HE2 PHE 43 HE2 PHE 43 5.681 -2.845 -8.989 364 HZ PHE 43 HZ PHE 43 5.118 -2.265 -11.346 365 H ASP 44 H ASP 44 3.121 3.252 -9.017 366 HA ASP 44 HA ASP 44 5.086 2.421 -10.918 367 HB2 ASP 44 HB2 ASP 44 2.790 3.262 -11.366 368 HB3 ASP 44 HB3 ASP 44 3.277 4.858 -10.826 369 H ASP 45 H ASP 45 5.006 4.999 -8.541 370 HA ASP 45 HA ASP 45 7.179 6.557 -9.738 371 HB2 ASP 45 HB2 ASP 45 5.683 6.616 -7.076 372 HB3 ASP 45 HB3 ASP 45 7.059 7.647 -7.445 373 H LEU 46 H LEU 46 6.702 4.299 -7.081 374 HA LEU 46 HA LEU 46 9.410 4.338 -6.046 375 HB2 LEU 46 HB2 LEU 46 7.577 4.053 -4.576 376 HB3 LEU 46 HB3 LEU 46 6.884 2.745 -5.510 377 HG LEU 46 HG LEU 46 7.821 2.101 -3.360 378 HD11 LEU 46 HD11 LEU 46 9.398 0.522 -5.359 379 HD12 LEU 46 HD12 LEU 46 8.535 0.021 -3.916 380 HD13 LEU 46 HD13 LEU 46 7.617 0.519 -5.351 381 HD21 LEU 46 HD21 LEU 46 10.237 1.815 -2.973 382 HD22 LEU 46 HD22 LEU 46 10.604 2.601 -4.503 383 HD23 LEU 46 HD23 LEU 46 9.830 3.512 -3.223 384 H ILE 47 H ILE 47 7.605 2.176 -8.288 385 HA ILE 47 HA ILE 47 9.350 -0.002 -8.044 386 HB ILE 47 HB ILE 47 7.157 0.069 -9.276 387 HG12 ILE 47 HG12 ILE 47 8.938 -1.800 -9.280 388 HG13 ILE 47 HG13 ILE 47 7.525 -1.872 -10.314 389 HG21 ILE 47 HG21 ILE 47 7.188 0.560 -11.704 390 HG22 ILE 47 HG22 ILE 47 7.531 1.989 -10.723 391 HG23 ILE 47 HG23 ILE 47 8.856 1.188 -11.570 392 HD11 ILE 47 HD11 ILE 47 9.707 -2.549 -11.354 393 HD12 ILE 47 HD12 ILE 47 8.726 -1.381 -12.266 394 HD13 ILE 47 HD13 ILE 47 10.157 -0.847 -11.373 395 H ASP 48 H ASP 48 9.781 3.048 -9.683 396 HA ASP 48 HA ASP 48 11.854 2.454 -11.426 397 HB2 ASP 48 HB2 ASP 48 10.680 4.637 -11.183 398 HB3 ASP 48 HB3 ASP 48 11.491 4.918 -9.661 399 H PHE 49 H PHE 49 11.906 3.275 -8.022 400 HA PHE 49 HA PHE 49 14.733 3.219 -7.580 401 HB2 PHE 49 HB2 PHE 49 12.902 4.248 -6.119 402 HB3 PHE 49 HB3 PHE 49 12.645 2.634 -5.472 403 HD1 PHE 49 HD1 PHE 49 12.999 4.317 -3.431 404 HD2 PHE 49 HD2 PHE 49 16.204 2.929 -5.982 405 HE1 PHE 49 HE1 PHE 49 14.660 4.876 -1.702 406 HE2 PHE 49 HE2 PHE 49 17.808 3.360 -4.192 407 HZ PHE 49 HZ PHE 49 17.063 4.360 -2.043 408 H TYR 50 H TYR 50 12.237 0.669 -7.539 409 HA TYR 50 HA TYR 50 13.865 -1.394 -6.362 410 HB2 TYR 50 HB2 TYR 50 11.738 -2.125 -6.226 411 HB3 TYR 50 HB3 TYR 50 11.199 -1.249 -7.632 412 HD1 TYR 50 HD1 TYR 50 12.108 -4.533 -6.390 413 HD2 TYR 50 HD2 TYR 50 11.794 -2.143 -9.961 414 HE1 TYR 50 HE1 TYR 50 11.994 -6.595 -7.767 415 HE2 TYR 50 HE2 TYR 50 11.791 -4.170 -11.343 416 HH TYR 50 HH TYR 50 12.229 -6.543 -11.274 417 H GLU 51 H GLU 51 13.646 0.015 -9.562 418 HA GLU 51 HA GLU 51 15.011 -2.215 -10.878 419 HB2 GLU 51 HB2 GLU 51 14.550 0.632 -11.869 420 HB3 GLU 51 HB3 GLU 51 15.193 -0.718 -12.823 421 HG2 GLU 51 HG2 GLU 51 13.079 -2.014 -12.251 422 HG3 GLU 51 HG3 GLU 51 12.438 -0.520 -11.569 423 H ARG 52 H ARG 52 16.052 0.231 -8.763 424 HA ARG 52 HA ARG 52 18.772 0.488 -9.842 425 HB2 ARG 52 HB2 ARG 52 17.746 1.261 -7.080 426 HB3 ARG 52 HB3 ARG 52 19.267 1.716 -7.797 427 HG2 ARG 52 HG2 ARG 52 16.529 2.608 -8.794 428 HG3 ARG 52 HG3 ARG 52 17.630 3.547 -7.786 429 HD2 ARG 52 HD2 ARG 52 19.343 3.423 -9.636 430 HD3 ARG 52 HD3 ARG 52 18.106 2.694 -10.668 431 HE ARG 52 HE ARG 52 18.327 5.477 -9.752 432 HH11 ARG 52 HH11 ARG 52 15.932 3.123 -11.044 433 HH12 ARG 52 HH12 ARG 52 14.910 4.364 -11.632 434 HH21 ARG 52 HH21 ARG 52 16.818 7.027 -10.343 435 HH22 ARG 52 HH22 ARG 52 15.302 6.567 -11.064 436 H LEU 53 H LEU 53 17.001 -1.676 -7.728 437 HA LEU 53 HA LEU 53 18.987 -2.664 -6.023 438 HB2 LEU 53 HB2 LEU 53 16.912 -4.332 -7.494 439 HB3 LEU 53 HB3 LEU 53 17.718 -4.760 -5.996 440 HG LEU 53 HG LEU 53 15.815 -2.406 -6.280 441 HD11 LEU 53 HD11 LEU 53 14.135 -3.766 -5.167 442 HD12 LEU 53 HD12 LEU 53 14.660 -4.579 -6.644 443 HD13 LEU 53 HD13 LEU 53 15.266 -5.141 -5.066 444 HD21 LEU 53 HD21 LEU 53 17.015 -3.593 -3.825 445 HD22 LEU 53 HD22 LEU 53 17.254 -1.980 -4.554 446 HD23 LEU 53 HD23 LEU 53 15.668 -2.402 -3.932 447 H ASP 54 H ASP 54 20.857 -3.694 -6.456 448 HA ASP 54 HA ASP 54 21.844 -4.138 -9.092 449 HB2 ASP 54 HB2 ASP 54 23.180 -3.788 -6.989 450 HB3 ASP 54 HB3 ASP 54 22.688 -5.404 -6.471 451 H THR 55 H THR 55 19.900 -6.033 -6.977 452 HA THR 55 HA THR 55 19.542 -8.145 -8.863 453 HB THR 55 HB THR 55 21.473 -8.905 -7.920 454 HG1 THR 55 HG1 THR 55 20.826 -10.880 -7.677 455 HG21 THR 55 HG21 THR 55 21.584 -9.624 -5.654 456 HG22 THR 55 HG22 THR 55 21.104 -7.901 -5.755 457 HG23 THR 55 HG23 THR 55 19.881 -9.154 -5.414 458 HA PRO 56 HA PRO 56 15.685 -6.819 -6.901 459 HB2 PRO 56 HB2 PRO 56 14.007 -7.559 -8.930 460 HB3 PRO 56 HB3 PRO 56 14.930 -6.017 -8.933 461 HG2 PRO 56 HG2 PRO 56 15.523 -8.608 -10.356 462 HG3 PRO 56 HG3 PRO 56 15.700 -6.934 -10.971 463 HD2 PRO 56 HD2 PRO 56 17.776 -8.459 -9.974 464 HD3 PRO 56 HD3 PRO 56 17.747 -6.672 -9.881 465 HA PRO 57 HA PRO 57 15.314 -11.134 -5.574 466 HB2 PRO 57 HB2 PRO 57 13.372 -10.883 -3.624 467 HB3 PRO 57 HB3 PRO 57 15.086 -10.424 -3.421 468 HG2 PRO 57 HG2 PRO 57 12.722 -8.642 -4.036 469 HG3 PRO 57 HG3 PRO 57 14.084 -8.356 -2.915 470 HD2 PRO 57 HD2 PRO 57 13.965 -7.295 -5.452 471 HD3 PRO 57 HD3 PRO 57 15.502 -7.709 -4.639 472 H PHE 58 H PHE 58 12.039 -9.655 -5.483 473 HA PHE 58 HA PHE 58 10.998 -11.868 -7.150 474 HB2 PHE 58 HB2 PHE 58 9.693 -9.748 -5.391 475 HB3 PHE 58 HB3 PHE 58 8.786 -10.792 -6.469 476 HD1 PHE 58 HD1 PHE 58 9.471 -13.439 -6.268 477 HD2 PHE 58 HD2 PHE 58 9.648 -10.473 -3.128 478 HE1 PHE 58 HE1 PHE 58 9.153 -15.212 -4.577 479 HE2 PHE 58 HE2 PHE 58 9.310 -12.274 -1.442 480 HZ PHE 58 HZ PHE 58 9.053 -14.627 -2.162 481 H SER 59 H SER 59 9.048 -10.959 -8.568 482 HA SER 59 HA SER 59 10.274 -9.066 -10.494 483 HB2 SER 59 HB2 SER 59 7.740 -10.762 -10.678 484 HB3 SER 59 HB3 SER 59 8.529 -9.887 -12.003 485 HG SER 59 HG SER 59 10.152 -11.295 -12.028 486 H LYS 60 H LYS 60 8.914 -7.365 -11.278 487 HA LYS 60 HA LYS 60 7.845 -5.546 -9.583 488 HB2 LYS 60 HB2 LYS 60 6.763 -5.963 -12.391 489 HB3 LYS 60 HB3 LYS 60 6.904 -4.444 -11.498 490 HG2 LYS 60 HG2 LYS 60 9.387 -4.689 -11.522 491 HG3 LYS 60 HG3 LYS 60 9.246 -6.158 -12.482 492 HD2 LYS 60 HD2 LYS 60 8.276 -4.993 -14.346 493 HD3 LYS 60 HD3 LYS 60 8.252 -3.460 -13.439 494 HE2 LYS 60 HE2 LYS 60 10.685 -3.469 -13.245 495 HE3 LYS 60 HE3 LYS 60 10.795 -5.083 -13.977 496 HZ1 LYS 60 HZ1 LYS 60 10.053 -4.116 -16.059 497 HZ2 LYS 60 HZ2 LYS 60 9.797 -2.655 -15.327 498 HZ3 LYS 60 HZ3 LYS 60 11.292 -3.206 -15.472 499 H LYS 61 H LYS 61 5.990 -8.155 -11.024 500 HA LYS 61 HA LYS 61 3.403 -7.404 -10.326 501 HB2 LYS 61 HB2 LYS 61 4.218 -9.372 -11.735 502 HB3 LYS 61 HB3 LYS 61 4.487 -10.255 -10.227 503 HG2 LYS 61 HG2 LYS 61 2.046 -10.000 -9.695 504 HG3 LYS 61 HG3 LYS 61 1.832 -9.115 -11.223 505 HD2 LYS 61 HD2 LYS 61 2.696 -11.088 -12.469 506 HD3 LYS 61 HD3 LYS 61 2.807 -11.989 -10.935 507 HE2 LYS 61 HE2 LYS 61 0.378 -11.778 -10.617 508 HE3 LYS 61 HE3 LYS 61 0.257 -10.796 -12.086 509 HZ1 LYS 61 HZ1 LYS 61 -0.350 -13.045 -12.531 510 HZ2 LYS 61 HZ2 LYS 61 1.005 -12.710 -13.367 511 HZ3 LYS 61 HZ3 LYS 61 1.111 -13.632 -12.024 512 H SER 62 H SER 62 5.802 -9.214 -8.250 513 HA SER 62 HA SER 62 4.045 -9.628 -6.089 514 HB2 SER 62 HB2 SER 62 7.070 -9.292 -6.187 515 HB3 SER 62 HB3 SER 62 6.158 -9.819 -4.763 516 HG SER 62 HG SER 62 6.507 -11.680 -5.593 517 H LEU 63 H LEU 63 6.374 -6.898 -6.667 518 HA LEU 63 HA LEU 63 5.807 -5.555 -4.269 519 HB2 LEU 63 HB2 LEU 63 7.651 -5.201 -5.954 520 HB3 LEU 63 HB3 LEU 63 6.561 -4.163 -6.860 521 HG LEU 63 HG LEU 63 7.105 -3.723 -3.889 522 HD11 LEU 63 HD11 LEU 63 9.320 -3.874 -5.068 523 HD12 LEU 63 HD12 LEU 63 8.814 -2.555 -6.139 524 HD13 LEU 63 HD13 LEU 63 8.989 -2.283 -4.382 525 HD21 LEU 63 HD21 LEU 63 6.638 -1.400 -4.390 526 HD22 LEU 63 HD22 LEU 63 6.567 -1.723 -6.122 527 HD23 LEU 63 HD23 LEU 63 5.305 -2.359 -5.016 528 H ARG 64 H ARG 64 4.257 -5.065 -7.485 529 HA ARG 64 HA ARG 64 2.435 -3.133 -6.470 530 HB2 ARG 64 HB2 ARG 64 2.920 -3.471 -8.921 531 HB3 ARG 64 HB3 ARG 64 2.146 -5.032 -8.862 532 HG2 ARG 64 HG2 ARG 64 0.766 -3.328 -9.950 533 HG3 ARG 64 HG3 ARG 64 -0.013 -4.045 -8.553 534 HD2 ARG 64 HD2 ARG 64 -0.339 -2.082 -7.577 535 HD3 ARG 64 HD3 ARG 64 1.353 -1.625 -7.719 536 HE ARG 64 HE ARG 64 0.499 -1.180 -10.248 537 HH11 ARG 64 HH11 ARG 64 -0.746 -0.018 -7.113 538 HH12 ARG 64 HH12 ARG 64 -1.562 1.351 -7.791 539 HH21 ARG 64 HH21 ARG 64 -0.401 0.632 -11.092 540 HH22 ARG 64 HH22 ARG 64 -1.279 1.818 -10.179 541 H GLU 65 H GLU 65 2.169 -6.688 -6.639 542 HA GLU 65 HA GLU 65 -0.604 -6.807 -5.961 543 HB2 GLU 65 HB2 GLU 65 0.716 -8.626 -7.058 544 HB3 GLU 65 HB3 GLU 65 1.619 -8.861 -5.551 545 HG2 GLU 65 HG2 GLU 65 -0.121 -10.522 -5.668 546 HG3 GLU 65 HG3 GLU 65 -0.523 -9.385 -4.405 547 H ALA 66 H ALA 66 2.394 -7.103 -3.993 548 HA ALA 66 HA ALA 66 1.149 -7.562 -1.512 549 HB1 ALA 66 HB1 ALA 66 3.312 -6.937 -0.574 550 HB2 ALA 66 HB2 ALA 66 3.552 -7.955 -1.997 551 HB3 ALA 66 HB3 ALA 66 3.790 -6.193 -2.112 552 H LEU 67 H LEU 67 2.159 -4.436 -2.993 553 HA LEU 67 HA LEU 67 1.448 -2.835 -0.824 554 HB2 LEU 67 HB2 LEU 67 2.255 -2.409 -3.504 555 HB3 LEU 67 HB3 LEU 67 0.832 -1.408 -3.257 556 HG LEU 67 HG LEU 67 3.284 -1.458 -1.441 557 HD11 LEU 67 HD11 LEU 67 3.892 0.698 -2.482 558 HD12 LEU 67 HD12 LEU 67 3.859 -0.604 -3.675 559 HD13 LEU 67 HD13 LEU 67 2.516 0.560 -3.599 560 HD21 LEU 67 HD21 LEU 67 1.243 -0.647 -0.262 561 HD22 LEU 67 HD22 LEU 67 2.424 0.640 -0.498 562 HD23 LEU 67 HD23 LEU 67 0.997 0.559 -1.545 563 H SER 68 H SER 68 -0.705 -4.455 -3.066 564 HA SER 68 HA SER 68 -3.048 -2.881 -2.703 565 HB2 SER 68 HB2 SER 68 -2.333 -4.983 -4.281 566 HB3 SER 68 HB3 SER 68 -3.263 -5.861 -3.071 567 HG SER 68 HG SER 68 -4.555 -5.224 -4.746 568 H TYR 69 H TYR 69 -1.490 -5.369 -0.709 569 HA TYR 69 HA TYR 69 -3.879 -5.878 0.918 570 HB2 TYR 69 HB2 TYR 69 -1.085 -6.907 0.868 571 HB3 TYR 69 HB3 TYR 69 -1.821 -6.774 2.451 572 HD1 TYR 69 HD1 TYR 69 -2.973 -8.658 3.263 573 HD2 TYR 69 HD2 TYR 69 -2.855 -7.947 -1.009 574 HE1 TYR 69 HE1 TYR 69 -4.227 -10.743 2.878 575 HE2 TYR 69 HE2 TYR 69 -4.184 -10.004 -1.351 576 HH TYR 69 HH TYR 69 -4.824 -12.359 1.216 577 H TYR 70 H TYR 70 -0.997 -3.689 1.111 578 HA TYR 70 HA TYR 70 -1.643 -2.916 3.811 579 HB2 TYR 70 HB2 TYR 70 0.302 -2.063 1.802 580 HB3 TYR 70 HB3 TYR 70 -0.406 -0.689 2.633 581 HD1 TYR 70 HD1 TYR 70 0.891 -4.126 3.461 582 HD2 TYR 70 HD2 TYR 70 0.555 -0.004 4.675 583 HE1 TYR 70 HE1 TYR 70 2.492 -4.537 5.292 584 HE2 TYR 70 HE2 TYR 70 2.055 -0.443 6.585 585 HH TYR 70 HH TYR 70 3.960 -3.386 6.867 586 H SER 71 H SER 71 -2.628 -1.581 0.598 587 HA SER 71 HA SER 71 -4.225 0.486 1.818 588 HB2 SER 71 HB2 SER 71 -5.325 0.421 -0.531 589 HB3 SER 71 HB3 SER 71 -3.665 0.985 -0.336 590 HG SER 71 HG SER 71 -4.025 -0.565 -2.091 591 H ALA 72 H ALA 72 -4.809 -2.945 1.312 592 HA ALA 72 HA ALA 72 -7.714 -2.643 1.770 593 HB1 ALA 72 HB1 ALA 72 -6.037 -5.128 1.250 594 HB2 ALA 72 HB2 ALA 72 -7.804 -5.043 1.293 595 HB3 ALA 72 HB3 ALA 72 -6.926 -4.204 0.012 596 H SER 73 H SER 73 -5.256 -2.354 3.805 597 HA SER 73 HA SER 73 -5.649 -4.441 5.728 598 HB2 SER 73 HB2 SER 73 -4.302 -3.045 7.221 599 HB3 SER 73 HB3 SER 73 -3.578 -3.202 5.632 600 HG SER 73 HG SER 73 -4.165 -1.154 5.129 601 HA PRO 74 HA PRO 74 -9.349 -3.298 7.677 602 HB2 PRO 74 HB2 PRO 74 -8.900 -3.617 10.410 603 HB3 PRO 74 HB3 PRO 74 -9.213 -4.939 9.242 604 HG2 PRO 74 HG2 PRO 74 -6.584 -3.911 10.279 605 HG3 PRO 74 HG3 PRO 74 -7.091 -5.609 10.071 606 HD2 PRO 74 HD2 PRO 74 -5.489 -4.349 8.296 607 HD3 PRO 74 HD3 PRO 74 -6.739 -5.501 7.724 608 H ALA 75 H ALA 75 -6.761 -1.899 9.743 609 HA ALA 75 HA ALA 75 -8.117 0.278 10.695 610 HB1 ALA 75 HB1 ALA 75 -5.155 0.130 9.988 611 HB2 ALA 75 HB2 ALA 75 -5.902 1.247 11.141 612 HB3 ALA 75 HB3 ALA 75 -5.917 -0.491 11.482 613 H TYR 76 H TYR 76 -6.384 0.155 7.532 614 HA TYR 76 HA TYR 76 -6.630 2.942 7.010 615 HB2 TYR 76 HB2 TYR 76 -5.079 1.582 5.669 616 HB3 TYR 76 HB3 TYR 76 -6.376 0.525 5.177 617 HD1 TYR 76 HD1 TYR 76 -4.827 3.915 4.560 618 HD2 TYR 76 HD2 TYR 76 -7.949 1.133 3.477 619 HE1 TYR 76 HE1 TYR 76 -5.250 5.141 2.535 620 HE2 TYR 76 HE2 TYR 76 -8.313 2.358 1.369 621 HH TYR 76 HH TYR 76 -6.762 5.445 0.641 622 H LEU 77 H LEU 77 -8.636 0.158 5.912 623 HA LEU 77 HA LEU 77 -10.535 1.744 4.525 624 HB2 LEU 77 HB2 LEU 77 -10.906 -1.014 5.766 625 HB3 LEU 77 HB3 LEU 77 -11.943 -0.302 4.561 626 HG LEU 77 HG LEU 77 -8.980 -0.791 4.028 627 HD11 LEU 77 HD11 LEU 77 -11.328 -2.638 3.654 628 HD12 LEU 77 HD12 LEU 77 -9.711 -2.917 2.973 629 HD13 LEU 77 HD13 LEU 77 -9.944 -2.872 4.733 630 HD21 LEU 77 HD21 LEU 77 -9.682 -0.818 1.675 631 HD22 LEU 77 HD22 LEU 77 -11.338 -0.404 2.159 632 HD23 LEU 77 HD23 LEU 77 -10.013 0.736 2.444 633 H SER 78 H SER 78 -10.584 0.331 7.756 634 HA SER 78 HA SER 78 -13.150 1.070 8.576 635 HB2 SER 78 HB2 SER 78 -11.294 -0.444 9.652 636 HB3 SER 78 HB3 SER 78 -10.798 1.035 10.475 637 HG SER 78 HG SER 78 -12.222 -0.053 11.752 638 H CYS 79 H CYS 79 -10.167 3.160 8.616 639 HA CYS 79 HA CYS 79 -11.523 5.036 10.399 640 HB2 CYS 79 HB2 CYS 79 -8.929 4.688 9.748 641 HB3 CYS 79 HB3 CYS 79 -9.323 5.977 8.606 642 HG CYS 79 HG CYS 79 -8.170 6.972 10.720 643 H GLN 80 H GLN 80 -11.649 4.510 6.951 644 HA GLN 80 HA GLN 80 -12.425 5.762 5.210 645 HB2 GLN 80 HB2 GLN 80 -14.841 6.265 5.399 646 HB3 GLN 80 HB3 GLN 80 -14.387 4.614 5.792 647 HG2 GLN 80 HG2 GLN 80 -14.692 5.031 8.181 648 HG3 GLN 80 HG3 GLN 80 -15.005 6.741 7.879 649 HE21 GLN 80 HE21 GLN 80 -16.660 4.047 8.734 650 HE22 GLN 80 HE22 GLN 80 -18.184 4.395 7.915 651 H LYS 81 H LYS 81 -10.632 7.416 5.827 652 HA LYS 81 HA LYS 81 -11.875 9.942 6.647 653 HB2 LYS 81 HB2 LYS 81 -8.998 9.123 6.706 654 HB3 LYS 81 HB3 LYS 81 -9.546 10.778 6.989 655 HG2 LYS 81 HG2 LYS 81 -10.455 8.366 8.561 656 HG3 LYS 81 HG3 LYS 81 -9.208 9.485 9.091 657 HD2 LYS 81 HD2 LYS 81 -10.842 11.301 9.287 658 HD3 LYS 81 HD3 LYS 81 -12.105 10.289 8.578 659 HE2 LYS 81 HE2 LYS 81 -11.651 8.638 10.488 660 HE3 LYS 81 HE3 LYS 81 -10.878 10.016 11.302 661 HZ1 LYS 81 HZ1 LYS 81 -13.013 11.223 11.006 662 HZ2 LYS 81 HZ2 LYS 81 -13.635 9.932 10.220 663 HZ3 LYS 81 HZ3 LYS 81 -13.266 9.794 11.808 664 HA PRO 82 HA PRO 82 -11.423 11.325 2.374 665 HB2 PRO 82 HB2 PRO 82 -13.483 13.106 2.384 666 HB3 PRO 82 HB3 PRO 82 -13.794 11.353 2.372 667 HG2 PRO 82 HG2 PRO 82 -13.827 13.229 4.739 668 HG3 PRO 82 HG3 PRO 82 -15.040 11.978 4.291 669 HD2 PRO 82 HD2 PRO 82 -13.013 11.548 6.134 670 HD3 PRO 82 HD3 PRO 82 -13.720 10.257 5.124 671 H ASP 83 H ASP 83 -11.394 13.893 1.763 672 HA ASP 83 HA ASP 83 -10.011 15.762 1.925 673 HB2 ASP 83 HB2 ASP 83 -11.518 16.069 4.511 674 HB3 ASP 83 HB3 ASP 83 -10.870 17.344 3.476 675 H THR 84 H THR 84 -8.367 13.766 2.539 676 HA THR 84 HA THR 84 -6.913 14.569 5.009 677 HB THR 84 HB THR 84 -8.123 12.386 5.010 678 HG1 THR 84 HG1 THR 84 -6.597 12.282 6.432 679 HG21 THR 84 HG21 THR 84 -6.055 11.575 2.925 680 HG22 THR 84 HG22 THR 84 -7.268 10.532 3.727 681 HG23 THR 84 HG23 THR 84 -7.794 11.796 2.621 682 H ALA 85 H ALA 85 -6.654 14.744 1.693 683 HA ALA 85 HA ALA 85 -4.951 15.197 0.204 684 HB1 ALA 85 HB1 ALA 85 -3.687 16.345 2.694 685 HB2 ALA 85 HB2 ALA 85 -3.159 16.629 1.028 686 HB3 ALA 85 HB3 ALA 85 -4.766 17.172 1.540 687 H ARG 86 H ARG 86 -4.309 13.372 -0.668 688 HA ARG 86 HA ARG 86 -2.313 11.723 0.760 689 HB2 ARG 86 HB2 ARG 86 -3.283 11.629 -2.155 690 HB3 ARG 86 HB3 ARG 86 -1.999 10.605 -1.522 691 HG2 ARG 86 HG2 ARG 86 -3.756 9.214 -1.180 692 HG3 ARG 86 HG3 ARG 86 -3.766 10.088 0.348 693 HD2 ARG 86 HD2 ARG 86 -5.959 10.386 -0.093 694 HD3 ARG 86 HD3 ARG 86 -5.430 11.693 -1.152 695 HE ARG 86 HE ARG 86 -6.087 8.893 -1.908 696 HH11 ARG 86 HH11 ARG 86 -5.825 12.341 -3.029 697 HH12 ARG 86 HH12 ARG 86 -6.822 12.044 -4.394 698 HH21 ARG 86 HH21 ARG 86 -7.195 8.546 -3.887 699 HH22 ARG 86 HH22 ARG 86 -7.374 9.861 -5.012 700 H VAL 87 H VAL 87 -0.122 11.262 -0.312 701 HA VAL 87 HA VAL 87 1.163 13.598 -1.523 702 HB VAL 87 HB VAL 87 3.093 13.156 0.124 703 HG11 VAL 87 HG11 VAL 87 0.529 14.536 1.000 704 HG12 VAL 87 HG12 VAL 87 2.004 14.601 1.939 705 HG13 VAL 87 HG13 VAL 87 2.003 15.244 0.300 706 HG21 VAL 87 HG21 VAL 87 2.597 12.284 2.313 707 HG22 VAL 87 HG22 VAL 87 0.878 12.142 1.921 708 HG23 VAL 87 HG23 VAL 87 2.090 11.059 1.147 709 H ASP 88 H ASP 88 3.322 12.924 -2.350 710 HA ASP 88 HA ASP 88 3.207 10.199 -3.493 711 HB2 ASP 88 HB2 ASP 88 4.439 11.035 -5.340 712 HB3 ASP 88 HB3 ASP 88 3.184 12.218 -5.020 713 H ILE 89 H ILE 89 5.705 9.610 -4.089 714 HA ILE 89 HA ILE 89 6.942 8.833 -1.630 715 HB ILE 89 HB ILE 89 8.866 8.097 -3.107 716 HG12 ILE 89 HG12 ILE 89 7.143 9.060 -5.444 717 HG13 ILE 89 HG13 ILE 89 8.495 9.977 -4.791 718 HG21 ILE 89 HG21 ILE 89 7.761 6.268 -4.098 719 HG22 ILE 89 HG22 ILE 89 6.803 6.673 -2.676 720 HG23 ILE 89 HG23 ILE 89 6.249 7.158 -4.289 721 HD11 ILE 89 HD11 ILE 89 8.785 7.195 -5.940 722 HD12 ILE 89 HD12 ILE 89 9.120 8.742 -6.769 723 HD13 ILE 89 HD13 ILE 89 10.071 8.293 -5.343 724 H TYR 90 H TYR 90 7.241 11.799 -3.409 725 HA TYR 90 HA TYR 90 9.842 12.528 -2.197 726 HB2 TYR 90 HB2 TYR 90 7.972 13.819 -4.209 727 HB3 TYR 90 HB3 TYR 90 9.381 14.622 -3.559 728 HD1 TYR 90 HD1 TYR 90 8.185 11.940 -5.859 729 HD2 TYR 90 HD2 TYR 90 11.610 14.068 -4.293 730 HE1 TYR 90 HE1 TYR 90 9.572 11.072 -7.706 731 HE2 TYR 90 HE2 TYR 90 12.972 13.244 -6.179 732 HH TYR 90 HH TYR 90 11.816 10.853 -8.540 733 H GLY 91 H GLY 91 6.579 12.402 -1.299 734 HA2 GLY 91 HA2 GLY 91 5.567 13.210 0.579 735 HA3 GLY 91 HA3 GLY 91 6.946 14.276 0.893 736 H ASN 92 H ASN 92 5.947 14.675 -2.386 737 HA ASN 92 HA ASN 92 4.936 17.336 -1.838 738 HB2 ASN 92 HB2 ASN 92 4.872 15.651 -4.385 739 HB3 ASN 92 HB3 ASN 92 4.497 17.368 -4.288 740 HD21 ASN 92 HD21 ASN 92 6.809 15.295 -5.265 741 HD22 ASN 92 HD22 ASN 92 8.221 16.340 -5.045 742 H GLU 93 H GLU 93 2.820 17.998 -1.727 743 HA GLU 93 HA GLU 93 0.774 16.114 -1.212 744 HB2 GLU 93 HB2 GLU 93 1.086 19.097 -1.560 745 HB3 GLU 93 HB3 GLU 93 -0.509 18.394 -1.469 746 HG2 GLU 93 HG2 GLU 93 0.066 17.343 0.703 747 HG3 GLU 93 HG3 GLU 93 1.660 18.133 0.623 748 H VAL 94 H VAL 94 -0.955 15.586 -2.227 749 HA VAL 94 HA VAL 94 -1.531 16.302 -4.982 750 HB VAL 94 HB VAL 94 -2.231 14.069 -5.533 751 HG11 VAL 94 HG11 VAL 94 0.066 14.777 -6.121 752 HG12 VAL 94 HG12 VAL 94 0.659 14.070 -4.597 753 HG13 VAL 94 HG13 VAL 94 -0.038 13.028 -5.838 754 HG21 VAL 94 HG21 VAL 94 -2.555 13.325 -3.133 755 HG22 VAL 94 HG22 VAL 94 -1.886 12.139 -4.281 756 HG23 VAL 94 HG23 VAL 94 -0.806 12.957 -3.139 757 H ASP 95 H ASP 95 -3.990 15.315 -5.234 758 HA ASP 95 HA ASP 95 -5.445 17.076 -3.463 759 HB2 ASP 95 HB2 ASP 95 -5.713 16.770 -5.937 760 HB3 ASP 95 HB3 ASP 95 -6.343 15.162 -5.642 761 H VAL 96 H VAL 96 -7.854 16.100 -2.845 762 HA VAL 96 HA VAL 96 -7.277 13.897 -0.948 763 HB VAL 96 HB VAL 96 -8.692 14.950 0.534 764 HG11 VAL 96 HG11 VAL 96 -7.662 17.508 -0.708 765 HG12 VAL 96 HG12 VAL 96 -7.857 17.077 1.008 766 HG13 VAL 96 HG13 VAL 96 -6.564 16.372 0.023 767 HG21 VAL 96 HG21 VAL 96 -10.666 15.488 -0.764 768 HG22 VAL 96 HG22 VAL 96 -10.133 16.989 -0.023 769 HG23 VAL 96 HG23 VAL 96 -9.783 16.690 -1.736 770 H VAL 97 H VAL 97 -8.968 12.621 -0.265 771 HA VAL 97 HA VAL 97 -10.687 11.565 -2.421 772 HB VAL 97 HB VAL 97 -10.374 10.631 0.473 773 HG11 VAL 97 HG11 VAL 97 -11.309 9.128 -2.016 774 HG12 VAL 97 HG12 VAL 97 -11.070 8.422 -0.398 775 HG13 VAL 97 HG13 VAL 97 -12.326 9.621 -0.645 776 HG21 VAL 97 HG21 VAL 97 -8.753 8.985 -0.455 777 HG22 VAL 97 HG22 VAL 97 -8.821 9.833 -2.010 778 HG23 VAL 97 HG23 VAL 97 -8.176 10.625 -0.535 779 H THR 98 H THR 98 -13.048 11.589 -2.407 780 HA THR 98 HA THR 98 -14.314 13.625 -0.791 781 HB THR 98 HB THR 98 -16.347 12.636 -2.106 782 HG1 THR 98 HG1 THR 98 -15.586 11.460 -3.999 783 HG21 THR 98 HG21 THR 98 -15.786 13.809 -4.127 784 HG22 THR 98 HG22 THR 98 -15.120 14.713 -2.764 785 HG23 THR 98 HG23 THR 98 -14.058 13.716 -3.779 786 HA PRO 99 HA PRO 99 -15.958 11.156 2.470 787 HB2 PRO 99 HB2 PRO 99 -18.671 11.790 2.528 788 HB3 PRO 99 HB3 PRO 99 -17.349 12.766 3.238 789 HG2 PRO 99 HG2 PRO 99 -18.714 13.094 0.562 790 HG3 PRO 99 HG3 PRO 99 -18.261 14.365 1.744 791 HD2 PRO 99 HD2 PRO 99 -16.734 13.888 -0.422 792 HD3 PRO 99 HD3 PRO 99 -15.967 14.210 1.155 793 H GLU 100 H GLU 100 -17.814 10.899 -0.573 794 HA GLU 100 HA GLU 100 -19.103 8.425 0.088 795 HB2 GLU 100 HB2 GLU 100 -18.704 10.149 -2.313 796 HB3 GLU 100 HB3 GLU 100 -18.820 8.445 -2.702 797 HG2 GLU 100 HG2 GLU 100 -20.842 9.984 -1.008 798 HG3 GLU 100 HG3 GLU 100 -21.021 9.612 -2.731 799 H GLN 101 H GLN 101 -16.157 9.162 -1.840 800 HA GLN 101 HA GLN 101 -15.520 6.420 -2.284 801 HB2 GLN 101 HB2 GLN 101 -13.809 8.934 -2.383 802 HB3 GLN 101 HB3 GLN 101 -13.333 7.355 -3.036 803 HG2 GLN 101 HG2 GLN 101 -15.841 8.870 -3.934 804 HG3 GLN 101 HG3 GLN 101 -14.292 9.018 -4.723 805 HE21 GLN 101 HE21 GLN 101 -13.810 7.514 -6.334 806 HE22 GLN 101 HE22 GLN 101 -14.683 6.001 -6.569 807 H ALA 102 H ALA 102 -14.785 8.611 0.392 808 HA ALA 102 HA ALA 102 -12.775 6.932 1.573 809 HB1 ALA 102 HB1 ALA 102 -12.967 9.275 2.175 810 HB2 ALA 102 HB2 ALA 102 -14.605 9.029 2.840 811 HB3 ALA 102 HB3 ALA 102 -13.206 8.274 3.616 812 H LYS 103 H LYS 103 -16.349 7.212 2.123 813 HA LYS 103 HA LYS 103 -16.361 5.127 4.108 814 HB2 LYS 103 HB2 LYS 103 -18.654 5.335 4.222 815 HB3 LYS 103 HB3 LYS 103 -18.005 6.959 3.989 816 HG2 LYS 103 HG2 LYS 103 -18.720 6.859 1.602 817 HG3 LYS 103 HG3 LYS 103 -19.362 5.230 1.865 818 HD2 LYS 103 HD2 LYS 103 -21.217 6.680 2.020 819 HD3 LYS 103 HD3 LYS 103 -20.825 6.235 3.680 820 HE2 LYS 103 HE2 LYS 103 -19.494 8.389 3.846 821 HE3 LYS 103 HE3 LYS 103 -20.103 8.827 2.244 822 HZ1 LYS 103 HZ1 LYS 103 -22.308 8.919 3.119 823 HZ2 LYS 103 HZ2 LYS 103 -21.852 8.257 4.562 824 HZ3 LYS 103 HZ3 LYS 103 -21.333 9.757 4.142 825 H TYR 104 H TYR 104 -16.733 4.994 0.584 826 HA TYR 104 HA TYR 104 -17.959 2.528 0.286 827 HB2 TYR 104 HB2 TYR 104 -16.370 4.317 -1.383 828 HB3 TYR 104 HB3 TYR 104 -15.930 2.654 -1.709 829 HD1 TYR 104 HD1 TYR 104 -18.503 5.197 -2.100 830 HD2 TYR 104 HD2 TYR 104 -17.771 0.947 -2.280 831 HE1 TYR 104 HE1 TYR 104 -20.576 4.900 -3.349 832 HE2 TYR 104 HE2 TYR 104 -19.847 0.638 -3.579 833 HH TYR 104 HH TYR 104 -21.755 3.432 -4.750 834 H ALA 105 H ALA 105 -14.759 3.172 1.399 835 HA ALA 105 HA ALA 105 -13.391 0.793 1.034 836 HB1 ALA 105 HB1 ALA 105 -12.153 1.532 3.056 837 HB2 ALA 105 HB2 ALA 105 -12.423 2.832 1.879 838 HB3 ALA 105 HB3 ALA 105 -13.405 2.723 3.381 839 H TYR 106 H TYR 106 -16.087 1.443 3.279 840 HA TYR 106 HA TYR 106 -15.624 -0.544 5.201 841 HB2 TYR 106 HB2 TYR 106 -17.710 -0.100 5.959 842 HB3 TYR 106 HB3 TYR 106 -17.475 1.349 4.998 843 HD1 TYR 106 HD1 TYR 106 -18.381 1.158 2.436 844 HD2 TYR 106 HD2 TYR 106 -19.613 -1.420 5.675 845 HE1 TYR 106 HE1 TYR 106 -20.463 0.635 1.225 846 HE2 TYR 106 HE2 TYR 106 -21.650 -2.014 4.433 847 HH TYR 106 HH TYR 106 -22.460 -1.975 1.936 848 H GLN 107 H GLN 107 -17.112 -0.832 1.947 849 HA GLN 107 HA GLN 107 -18.087 -3.466 2.090 850 HB2 GLN 107 HB2 GLN 107 -16.960 -1.775 -0.164 851 HB3 GLN 107 HB3 GLN 107 -17.303 -3.464 -0.423 852 HG2 GLN 107 HG2 GLN 107 -19.658 -2.431 0.809 853 HG3 GLN 107 HG3 GLN 107 -19.158 -1.238 -0.388 854 HE21 GLN 107 HE21 GLN 107 -18.506 -2.180 -2.615 855 HE22 GLN 107 HE22 GLN 107 -19.449 -3.530 -3.190 856 H ARG 108 H ARG 108 -14.864 -2.248 1.263 857 HA ARG 108 HA ARG 108 -13.683 -4.803 0.687 858 HB2 ARG 108 HB2 ARG 108 -12.251 -2.295 1.596 859 HB3 ARG 108 HB3 ARG 108 -11.613 -3.566 0.574 860 HG2 ARG 108 HG2 ARG 108 -13.794 -1.531 -0.196 861 HG3 ARG 108 HG3 ARG 108 -12.087 -1.480 -0.634 862 HD2 ARG 108 HD2 ARG 108 -12.683 -3.948 -1.593 863 HD3 ARG 108 HD3 ARG 108 -14.288 -3.216 -1.686 864 HE ARG 108 HE ARG 108 -11.969 -1.720 -2.766 865 HH11 ARG 108 HH11 ARG 108 -14.904 -3.616 -3.580 866 HH12 ARG 108 HH12 ARG 108 -14.960 -2.992 -5.200 867 HH21 ARG 108 HH21 ARG 108 -12.026 -1.030 -4.885 868 HH22 ARG 108 HH22 ARG 108 -13.321 -1.501 -5.948 869 H TYR 109 H TYR 109 -14.157 -2.955 3.720 870 HA TYR 109 HA TYR 109 -12.223 -4.487 5.232 871 HB2 TYR 109 HB2 TYR 109 -13.149 -2.259 5.899 872 HB3 TYR 109 HB3 TYR 109 -14.712 -2.990 6.195 873 HD1 TYR 109 HD1 TYR 109 -14.755 -5.053 7.954 874 HD2 TYR 109 HD2 TYR 109 -11.627 -2.061 7.682 875 HE1 TYR 109 HE1 TYR 109 -14.039 -5.583 10.248 876 HE2 TYR 109 HE2 TYR 109 -10.975 -2.571 10.022 877 HH TYR 109 HH TYR 109 -12.530 -4.979 12.103 878 H GLN 110 H GLN 110 -15.790 -4.592 4.909 879 HA GLN 110 HA GLN 110 -16.109 -6.935 6.438 880 HB2 GLN 110 HB2 GLN 110 -18.399 -7.014 5.713 881 HB3 GLN 110 HB3 GLN 110 -17.908 -5.394 6.205 882 HG2 GLN 110 HG2 GLN 110 -17.679 -4.799 3.791 883 HG3 GLN 110 HG3 GLN 110 -18.284 -6.401 3.345 884 HE21 GLN 110 HE21 GLN 110 -20.300 -5.702 2.355 885 HE22 GLN 110 HE22 GLN 110 -21.505 -4.869 3.328 886 H GLU 111 H GLU 111 -15.242 -6.553 3.054 887 HA GLU 111 HA GLU 111 -16.113 -9.009 2.036 888 HB2 GLU 111 HB2 GLU 111 -14.813 -8.597 0.311 889 HB3 GLU 111 HB3 GLU 111 -14.845 -6.980 0.951 890 HG2 GLU 111 HG2 GLU 111 -12.698 -7.057 0.362 891 HG3 GLU 111 HG3 GLU 111 -12.455 -7.777 1.940 892 H ARG 112 H ARG 112 -13.263 -8.243 3.658 893 HA ARG 112 HA ARG 112 -12.441 -11.117 4.120 894 HB2 ARG 112 HB2 ARG 112 -10.971 -8.499 4.174 895 HB3 ARG 112 HB3 ARG 112 -10.277 -9.878 5.017 896 HG2 ARG 112 HG2 ARG 112 -11.262 -10.443 2.258 897 HG3 ARG 112 HG3 ARG 112 -9.854 -9.392 2.354 898 HD2 ARG 112 HD2 ARG 112 -8.626 -11.096 3.583 899 HD3 ARG 112 HD3 ARG 112 -10.074 -12.122 3.693 900 HE ARG 112 HE ARG 112 -9.845 -11.730 1.001 901 HH11 ARG 112 HH11 ARG 112 -7.302 -12.666 3.302 902 HH12 ARG 112 HH12 ARG 112 -6.469 -13.666 2.164 903 HH21 ARG 112 HH21 ARG 112 -8.705 -12.778 -0.482 904 HH22 ARG 112 HH22 ARG 112 -7.318 -13.787 -0.095 905 H TYR 113 H TYR 113 -13.336 -8.341 6.112 906 HA TYR 113 HA TYR 113 -12.842 -9.987 8.551 907 HB2 TYR 113 HB2 TYR 113 -13.024 -6.992 8.352 908 HB3 TYR 113 HB3 TYR 113 -12.440 -7.932 9.720 909 HD1 TYR 113 HD1 TYR 113 -11.303 -5.804 7.259 910 HD2 TYR 113 HD2 TYR 113 -10.518 -9.769 8.759 911 HE1 TYR 113 HE1 TYR 113 -9.044 -5.755 6.200 912 HE2 TYR 113 HE2 TYR 113 -8.315 -9.758 7.678 913 HH TYR 113 HH TYR 113 -6.700 -8.386 6.683 914 H GLY 114 H GLY 114 -15.262 -9.654 6.643 915 HA2 GLY 114 HA2 GLY 114 -17.321 -9.651 8.750 916 HA3 GLY 114 HA3 GLY 114 -17.515 -8.554 7.353 917 H ASN 115 H ASN 115 -19.505 -10.032 6.966 918 HA ASN 115 HA ASN 115 -18.715 -12.204 5.113 919 HB2 ASN 115 HB2 ASN 115 -20.522 -12.668 7.517 920 HB3 ASN 115 HB3 ASN 115 -20.472 -13.708 6.096 921 HD21 ASN 115 HD21 ASN 115 -18.890 -13.029 9.114 922 HD22 ASN 115 HD22 ASN 115 -17.507 -14.087 8.848 923 H LYS 116 H LYS 116 -19.404 -10.680 3.484 924 HA LYS 116 HA LYS 116 -22.297 -10.769 3.128 925 HB2 LYS 116 HB2 LYS 116 -21.093 -8.357 4.125 926 HB3 LYS 116 HB3 LYS 116 -21.521 -8.048 2.444 927 HG2 LYS 116 HG2 LYS 116 -23.409 -9.183 4.556 928 HG3 LYS 116 HG3 LYS 116 -23.329 -7.484 4.086 929 HD2 LYS 116 HD2 LYS 116 -24.027 -7.991 1.811 930 HD3 LYS 116 HD3 LYS 116 -24.037 -9.723 2.135 931 HE2 LYS 116 HE2 LYS 116 -25.845 -7.691 3.493 932 HE3 LYS 116 HE3 LYS 116 -26.295 -8.738 2.148 933 HZ1 LYS 116 HZ1 LYS 116 -27.034 -9.718 4.126 934 HZ2 LYS 116 HZ2 LYS 116 -25.745 -10.655 3.641 935 HZ3 LYS 116 HZ3 LYS 116 -25.609 -9.577 4.886 936 H LYS 117 H LYS 117 -22.895 -10.890 1.058 937 HA LYS 117 HA LYS 117 -21.155 -11.786 -0.868 938 HB2 LYS 117 HB2 LYS 117 -23.735 -11.969 -0.588 939 HB3 LYS 117 HB3 LYS 117 -23.823 -10.471 -1.535 940 HG2 LYS 117 HG2 LYS 117 -22.619 -11.635 -3.384 941 HG3 LYS 117 HG3 LYS 117 -22.473 -13.065 -2.345 942 HD2 LYS 117 HD2 LYS 117 -24.947 -13.303 -2.308 943 HD3 LYS 117 HD3 LYS 117 -25.065 -11.936 -3.444 944 HE2 LYS 117 HE2 LYS 117 -23.520 -13.208 -5.001 945 HE3 LYS 117 HE3 LYS 117 -23.594 -14.571 -3.891 946 HZ1 LYS 117 HZ1 LYS 117 -25.114 -14.910 -5.624 947 HZ2 LYS 117 HZ2 LYS 117 -26.013 -14.629 -4.281 948 HZ3 LYS 117 HZ3 LYS 117 -25.856 -13.447 -5.433 949 H SER 118 H SER 118 -20.203 -10.977 -2.673 950 HA SER 118 HA SER 118 -19.574 -8.102 -2.668 951 HB2 SER 118 HB2 SER 118 -17.936 -10.116 -2.844 952 HB3 SER 118 HB3 SER 118 -18.471 -10.247 -4.524 953 HG SER 118 HG SER 118 -16.570 -8.834 -3.731 954 H GLN 119 H GLN 119 -19.453 -7.065 -4.966 955 HA GLN 119 HA GLN 119 -22.070 -7.209 -6.149 956 HB2 GLN 119 HB2 GLN 119 -19.532 -5.803 -7.120 957 HB3 GLN 119 HB3 GLN 119 -21.155 -5.569 -7.775 958 HG2 GLN 119 HG2 GLN 119 -21.874 -4.927 -5.389 959 HG3 GLN 119 HG3 GLN 119 -20.150 -4.762 -5.035 960 HE21 GLN 119 HE21 GLN 119 -19.181 -3.548 -7.520 961 HE22 GLN 119 HE22 GLN 119 -20.042 -2.037 -7.711 962 H ASP 120 H ASP 120 -22.384 -7.398 -8.490 963 HA ASP 120 HA ASP 120 -20.672 -9.322 -9.945 964 HB2 ASP 120 HB2 ASP 120 -22.628 -10.631 -10.651 965 HB3 ASP 120 HB3 ASP 120 -22.313 -10.743 -8.951 966 H LEU 121 H LEU 121 -21.910 -9.602 -12.180 967 HA LEU 121 HA LEU 121 -22.170 -8.794 -14.170 968 HB2 LEU 121 HB2 LEU 121 -23.907 -6.739 -12.777 969 HB3 LEU 121 HB3 LEU 121 -23.813 -6.872 -14.527 970 HG LEU 121 HG LEU 121 -24.503 -9.314 -12.884 971 HD11 LEU 121 HD11 LEU 121 -26.400 -7.159 -13.878 972 HD12 LEU 121 HD12 LEU 121 -26.880 -8.773 -13.248 973 HD13 LEU 121 HD13 LEU 121 -26.088 -7.603 -12.200 974 HD21 LEU 121 HD21 LEU 121 -23.910 -9.637 -15.280 975 HD22 LEU 121 HD22 LEU 121 -25.612 -10.020 -14.957 976 HD23 LEU 121 HD23 LEU 121 -25.171 -8.488 -15.742 977 H LYS 122 H LYS 122 -22.286 -5.788 -15.011 978 HA LYS 122 HA LYS 122 -19.609 -4.924 -14.179 979 HB2 LYS 122 HB2 LYS 122 -20.365 -5.356 -17.104 980 HB3 LYS 122 HB3 LYS 122 -18.895 -4.574 -16.509 981 HG2 LYS 122 HG2 LYS 122 -18.174 -6.713 -15.440 982 HG3 LYS 122 HG3 LYS 122 -19.662 -7.484 -16.026 983 HD2 LYS 122 HD2 LYS 122 -18.141 -8.127 -17.600 984 HD3 LYS 122 HD3 LYS 122 -18.968 -6.765 -18.367 985 HE2 LYS 122 HE2 LYS 122 -17.104 -5.293 -17.942 986 HE3 LYS 122 HE3 LYS 122 -16.333 -6.491 -16.885 987 HZ1 LYS 122 HZ1 LYS 122 -16.802 -6.896 -19.776 988 HZ2 LYS 122 HZ2 LYS 122 -15.346 -6.477 -19.071 989 HZ3 LYS 122 HZ3 LYS 122 -16.036 -7.923 -18.737
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