NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
620802 | 5nr6 | 34127 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY -5 H1 GLY -5 -15.215 -3.249 33.626 2 H2 GLY -5 H2 GLY -5 -14.517 -2.325 32.468 3 H3 GLY -5 H3 GLY -5 -15.478 -3.582 32.043 4 HA2 GLY -5 HA2 GLY -5 -16.378 -1.150 33.448 5 HA3 GLY -5 HA3 GLY -5 -16.639 -1.493 31.730 6 H SER -4 H SER -4 -18.230 -1.416 34.544 7 HA SER -4 HA SER -4 -20.321 -3.303 33.675 8 HB2 SER -4 HB2 SER -4 -20.496 -4.300 35.946 9 HB3 SER -4 HB3 SER -4 -19.000 -4.738 35.106 10 HG SER -4 HG SER -4 -18.615 -4.143 37.286 11 H HIS -3 H HIS -3 -22.347 -3.008 34.837 12 HA HIS -3 HA HIS -3 -22.730 -0.228 35.877 13 HB2 HIS -3 HB2 HIS -3 -24.009 -0.944 33.846 14 HB3 HIS -3 HB3 HIS -3 -24.827 -2.155 34.835 15 HD2 HIS -3 HD2 HIS -3 -26.587 -1.217 36.717 16 HE1 HIS -3 HE1 HIS -3 -26.642 2.831 35.365 17 HE2 HIS -3 HE2 HIS -3 -27.795 1.122 36.860 18 H MET -2 H MET -2 -22.985 0.058 37.940 19 HA MET -2 HA MET -2 -24.295 -2.014 39.640 20 HB2 MET -2 HB2 MET -2 -21.735 -0.517 40.343 21 HB3 MET -2 HB3 MET -2 -22.688 -1.521 41.444 22 HG2 MET -2 HG2 MET -2 -22.308 -3.481 39.926 23 HG3 MET -2 HG3 MET -2 -21.295 -2.458 38.909 24 HE1 MET -2 HE1 MET -2 -21.595 -4.573 42.135 25 HE2 MET -2 HE2 MET -2 -20.183 -4.086 43.097 26 HE3 MET -2 HE3 MET -2 -21.549 -2.968 42.905 27 H ALA -1 H ALA -1 -26.112 -1.098 40.202 28 HA ALA -1 HA ALA -1 -26.140 1.635 41.422 29 HB1 ALA -1 HB1 ALA -1 -28.131 0.579 39.371 30 HB2 ALA -1 HB2 ALA -1 -28.264 2.111 40.263 31 HB3 ALA -1 HB3 ALA -1 -26.932 1.868 39.122 32 H SER 0 H SER 0 -28.261 -1.213 40.901 33 HA SER 0 HA SER 0 -29.753 -2.266 42.213 34 HB2 SER 0 HB2 SER 0 -27.512 -2.031 44.237 35 HB3 SER 0 HB3 SER 0 -28.795 -3.260 44.220 36 HG SER 0 HG SER 0 -26.861 -4.026 43.241 37 H MET 1 H MET 1 -30.297 0.423 42.244 38 HA MET 1 HA MET 1 -32.010 0.704 44.646 39 HB2 MET 1 HB2 MET 1 -29.795 2.627 43.866 40 HB3 MET 1 HB3 MET 1 -31.243 3.227 44.673 41 HG2 MET 1 HG2 MET 1 -29.509 1.023 45.799 42 HG3 MET 1 HG3 MET 1 -29.324 2.737 46.178 43 HE1 MET 1 HE1 MET 1 -29.566 2.560 48.729 44 HE2 MET 1 HE2 MET 1 -30.814 1.607 49.560 45 HE3 MET 1 HE3 MET 1 -29.590 0.788 48.562 46 H ASP 2 H ASP 2 -30.957 2.120 41.688 47 HA ASP 2 HA ASP 2 -33.523 3.485 41.160 48 HB2 ASP 2 HB2 ASP 2 -30.932 3.355 39.571 49 HB3 ASP 2 HB3 ASP 2 -32.322 4.354 39.151 50 H GLN 3 H GLN 3 -32.659 0.369 40.786 51 HA GLN 3 HA GLN 3 -34.192 -0.090 38.261 52 HB2 GLN 3 HB2 GLN 3 -31.694 0.278 37.934 53 HB3 GLN 3 HB3 GLN 3 -31.423 -1.189 38.854 54 HG2 GLN 3 HG2 GLN 3 -33.308 -1.861 36.779 55 HG3 GLN 3 HG3 GLN 3 -32.115 -0.808 36.035 56 HE21 GLN 3 HE21 GLN 3 -30.824 -4.410 37.643 57 HE22 GLN 3 HE22 GLN 3 -32.239 -3.587 38.322 58 H LEU 4 H LEU 4 -34.927 -0.676 41.065 59 HA LEU 4 HA LEU 4 -35.012 -3.667 41.070 60 HB2 LEU 4 HB2 LEU 4 -35.086 -1.585 43.245 61 HB3 LEU 4 HB3 LEU 4 -35.921 -3.100 43.506 62 HG LEU 4 HG LEU 4 -33.685 -3.067 44.478 63 HD11 LEU 4 HD11 LEU 4 -33.942 -5.161 42.280 64 HD12 LEU 4 HD12 LEU 4 -33.002 -5.283 43.778 65 HD13 LEU 4 HD13 LEU 4 -34.769 -5.205 43.853 66 HD21 LEU 4 HD21 LEU 4 -32.524 -1.763 42.697 67 HD22 LEU 4 HD22 LEU 4 -31.685 -3.257 43.178 68 HD23 LEU 4 HD23 LEU 4 -32.580 -3.203 41.649 69 H ASP 5 H ASP 5 -36.489 -3.375 39.226 70 HA ASP 5 HA ASP 5 -39.292 -3.471 40.223 71 HB2 ASP 5 HB2 ASP 5 -38.330 -1.782 37.876 72 HB3 ASP 5 HB3 ASP 5 -40.006 -2.272 38.085 73 H GLU 6 H GLU 6 -37.277 -4.013 37.260 74 HA GLU 6 HA GLU 6 -38.715 -6.590 36.849 75 HB2 GLU 6 HB2 GLU 6 -39.454 -4.917 35.218 76 HB3 GLU 6 HB3 GLU 6 -37.780 -4.510 34.834 77 HG2 GLU 6 HG2 GLU 6 -38.572 -5.889 33.086 78 HG3 GLU 6 HG3 GLU 6 -37.427 -6.842 34.019 79 H ILE 7 H ILE 7 -37.422 -8.288 36.916 80 HA ILE 7 HA ILE 7 -34.470 -8.029 36.532 81 HB ILE 7 HB ILE 7 -35.866 -9.437 38.834 82 HG12 ILE 7 HG12 ILE 7 -35.991 -7.010 39.214 83 HG13 ILE 7 HG13 ILE 7 -34.981 -7.841 40.373 84 HG21 ILE 7 HG21 ILE 7 -32.911 -9.119 38.178 85 HG22 ILE 7 HG22 ILE 7 -33.545 -9.734 39.720 86 HG23 ILE 7 HG23 ILE 7 -33.848 -10.625 38.228 87 HD11 ILE 7 HD11 ILE 7 -33.877 -6.316 37.982 88 HD12 ILE 7 HD12 ILE 7 -34.038 -5.669 39.626 89 HD13 ILE 7 HD13 ILE 7 -32.947 -7.031 39.315 90 H ILE 8 H ILE 8 -33.770 -9.491 35.108 91 HA ILE 8 HA ILE 8 -35.013 -12.145 34.835 92 HB ILE 8 HB ILE 8 -36.371 -10.611 33.449 93 HG12 ILE 8 HG12 ILE 8 -34.823 -12.517 31.668 94 HG13 ILE 8 HG13 ILE 8 -35.953 -13.065 32.912 95 HG21 ILE 8 HG21 ILE 8 -33.872 -10.209 31.744 96 HG22 ILE 8 HG22 ILE 8 -35.494 -9.569 31.421 97 HG23 ILE 8 HG23 ILE 8 -34.587 -8.984 32.812 98 HD11 ILE 8 HD11 ILE 8 -36.684 -11.297 30.539 99 HD12 ILE 8 HD12 ILE 8 -37.060 -13.014 30.746 100 HD13 ILE 8 HD13 ILE 8 -37.791 -11.815 31.830 101 H GLU 9 H GLU 9 -33.716 -13.692 33.836 102 HA GLU 9 HA GLU 9 -30.833 -12.987 33.803 103 HB2 GLU 9 HB2 GLU 9 -31.909 -14.712 35.362 104 HB3 GLU 9 HB3 GLU 9 -32.123 -15.729 33.942 105 HG2 GLU 9 HG2 GLU 9 -30.155 -16.450 35.088 106 HG3 GLU 9 HG3 GLU 9 -29.625 -15.691 33.599 107 H GLN 10 H GLN 10 -33.283 -14.248 31.592 108 HA GLN 10 HA GLN 10 -31.315 -14.175 29.377 109 HB2 GLN 10 HB2 GLN 10 -31.353 -16.522 30.091 110 HB3 GLN 10 HB3 GLN 10 -33.121 -16.556 29.977 111 HG2 GLN 10 HG2 GLN 10 -32.983 -16.121 27.537 112 HG3 GLN 10 HG3 GLN 10 -31.230 -16.002 27.648 113 HE21 GLN 10 HE21 GLN 10 -33.035 -19.713 27.732 114 HE22 GLN 10 HE22 GLN 10 -34.011 -18.268 27.948 115 H ILE 11 H ILE 11 -32.097 -13.342 27.548 116 HA ILE 11 HA ILE 11 -35.032 -12.887 27.245 117 HB ILE 11 HB ILE 11 -34.619 -10.617 26.617 118 HG12 ILE 11 HG12 ILE 11 -31.652 -11.121 27.126 119 HG13 ILE 11 HG13 ILE 11 -32.396 -10.874 25.539 120 HG21 ILE 11 HG21 ILE 11 -33.073 -11.149 29.185 121 HG22 ILE 11 HG22 ILE 11 -34.061 -9.722 28.788 122 HG23 ILE 11 HG23 ILE 11 -34.838 -11.289 29.048 123 HD11 ILE 11 HD11 ILE 11 -32.172 -8.835 27.774 124 HD12 ILE 11 HD12 ILE 11 -31.341 -8.838 26.212 125 HD13 ILE 11 HD13 ILE 11 -33.101 -8.587 26.270 126 H GLN 12 H GLN 12 -32.693 -14.563 25.820 127 HA GLN 12 HA GLN 12 -33.848 -14.309 23.130 128 HB2 GLN 12 HB2 GLN 12 -31.809 -13.971 21.981 129 HB3 GLN 12 HB3 GLN 12 -31.944 -12.700 23.177 130 HG2 GLN 12 HG2 GLN 12 -30.182 -15.183 23.400 131 HG3 GLN 12 HG3 GLN 12 -29.639 -13.587 22.930 132 HE21 GLN 12 HE21 GLN 12 -29.434 -14.375 26.778 133 HE22 GLN 12 HE22 GLN 12 -29.400 -15.581 25.482 134 H LYS 13 H LYS 13 -33.014 -16.015 21.647 135 HA LYS 13 HA LYS 13 -33.387 -18.589 22.975 136 HB2 LYS 13 HB2 LYS 13 -33.271 -17.767 20.049 137 HB3 LYS 13 HB3 LYS 13 -33.655 -19.399 20.608 138 HG2 LYS 13 HG2 LYS 13 -35.600 -18.596 21.850 139 HG3 LYS 13 HG3 LYS 13 -35.280 -16.929 21.368 140 HD2 LYS 13 HD2 LYS 13 -35.877 -19.192 19.414 141 HD3 LYS 13 HD3 LYS 13 -37.081 -18.066 20.059 142 HE2 LYS 13 HE2 LYS 13 -35.790 -16.149 19.114 143 HE3 LYS 13 HE3 LYS 13 -34.638 -17.287 18.402 144 HZ1 LYS 13 HZ1 LYS 13 -37.537 -17.170 17.755 145 HZ2 LYS 13 HZ2 LYS 13 -36.336 -16.619 16.800 146 HZ3 LYS 13 HZ3 LYS 13 -36.471 -18.218 17.093 147 H GLU 14 H GLU 14 -30.632 -17.184 23.000 148 HA GLU 14 HA GLU 14 -28.994 -19.602 22.582 149 HB2 GLU 14 HB2 GLU 14 -28.489 -16.883 21.296 150 HB3 GLU 14 HB3 GLU 14 -27.172 -18.001 21.672 151 HG2 GLU 14 HG2 GLU 14 -28.183 -19.751 20.320 152 HG3 GLU 14 HG3 GLU 14 -29.538 -18.692 19.901 153 H ALA 15 H ALA 15 -27.196 -19.671 23.800 154 HA ALA 15 HA ALA 15 -26.493 -17.511 25.636 155 HB1 ALA 15 HB1 ALA 15 -27.448 -20.208 26.705 156 HB2 ALA 15 HB2 ALA 15 -26.739 -18.891 27.675 157 HB3 ALA 15 HB3 ALA 15 -28.288 -18.657 26.863 158 H ILE 16 H ILE 16 -25.755 -20.933 25.968 159 HA ILE 16 HA ILE 16 -22.927 -20.517 25.107 160 HB ILE 16 HB ILE 16 -24.038 -21.721 27.633 161 HG12 ILE 16 HG12 ILE 16 -21.762 -20.016 28.139 162 HG13 ILE 16 HG13 ILE 16 -22.752 -19.178 26.977 163 HG21 ILE 16 HG21 ILE 16 -21.162 -22.016 26.709 164 HG22 ILE 16 HG22 ILE 16 -21.720 -22.293 28.375 165 HG23 ILE 16 HG23 ILE 16 -22.318 -23.320 27.085 166 HD11 ILE 16 HD11 ILE 16 -23.683 -20.278 29.664 167 HD12 ILE 16 HD12 ILE 16 -23.389 -18.574 29.257 168 HD13 ILE 16 HD13 ILE 16 -24.727 -19.449 28.489 169 H ASN 17 H ASN 17 -25.497 -21.875 24.090 170 HA ASN 17 HA ASN 17 -24.533 -24.640 23.777 171 HB2 ASN 17 HB2 ASN 17 -27.218 -23.390 23.056 172 HB3 ASN 17 HB3 ASN 17 -26.843 -25.107 22.980 173 HD21 ASN 17 HD21 ASN 17 -28.212 -23.740 26.424 174 HD22 ASN 17 HD22 ASN 17 -28.444 -22.954 24.871 175 H SER 18 H SER 18 -23.905 -21.981 22.086 176 HA SER 18 HA SER 18 -23.893 -23.337 19.388 177 HB2 SER 18 HB2 SER 18 -25.607 -21.576 19.581 178 HB3 SER 18 HB3 SER 18 -24.354 -20.401 20.019 179 HG SER 18 HG SER 18 -24.867 -20.321 17.806 180 H ASN 19 H ASN 19 -22.233 -20.859 21.390 181 HA ASN 19 HA ASN 19 -19.928 -20.685 19.677 182 HB2 ASN 19 HB2 ASN 19 -19.022 -19.302 21.532 183 HB3 ASN 19 HB3 ASN 19 -20.634 -18.795 21.043 184 HD21 ASN 19 HD21 ASN 19 -20.613 -18.815 24.745 185 HD22 ASN 19 HD22 ASN 19 -19.685 -17.958 23.513 186 H VAL 20 H VAL 20 -20.700 -22.731 22.345 187 HA VAL 20 HA VAL 20 -17.961 -23.871 22.511 188 HB VAL 20 HB VAL 20 -20.496 -24.601 24.017 189 HG11 VAL 20 HG11 VAL 20 -17.618 -25.510 24.464 190 HG12 VAL 20 HG12 VAL 20 -18.969 -25.783 25.587 191 HG13 VAL 20 HG13 VAL 20 -18.991 -26.540 23.998 192 HG21 VAL 20 HG21 VAL 20 -19.661 -22.357 24.623 193 HG22 VAL 20 HG22 VAL 20 -19.344 -23.493 25.932 194 HG23 VAL 20 HG23 VAL 20 -18.023 -23.007 24.848 195 H VAL 21 H VAL 21 -21.078 -24.667 21.079 196 HA VAL 21 HA VAL 21 -19.943 -27.160 19.879 197 HB VAL 21 HB VAL 21 -22.770 -26.935 20.984 198 HG11 VAL 21 HG11 VAL 21 -21.149 -29.309 19.940 199 HG12 VAL 21 HG12 VAL 21 -22.795 -29.379 20.605 200 HG13 VAL 21 HG13 VAL 21 -22.503 -28.530 19.087 201 HG21 VAL 21 HG21 VAL 21 -21.266 -27.006 22.897 202 HG22 VAL 21 HG22 VAL 21 -22.024 -28.582 22.696 203 HG23 VAL 21 HG23 VAL 21 -20.343 -28.342 22.169 204 H LEU 22 H LEU 22 -19.505 -25.934 18.021 205 HA LEU 22 HA LEU 22 -21.878 -25.128 16.405 206 HB2 LEU 22 HB2 LEU 22 -20.028 -23.428 16.985 207 HB3 LEU 22 HB3 LEU 22 -18.993 -24.363 15.915 208 HG LEU 22 HG LEU 22 -20.655 -23.930 14.047 209 HD11 LEU 22 HD11 LEU 22 -21.845 -21.987 16.079 210 HD12 LEU 22 HD12 LEU 22 -22.225 -22.021 14.344 211 HD13 LEU 22 HD13 LEU 22 -22.678 -23.383 15.371 212 HD21 LEU 22 HD21 LEU 22 -18.604 -22.593 14.302 213 HD22 LEU 22 HD22 LEU 22 -19.940 -21.603 13.694 214 HD23 LEU 22 HD23 LEU 22 -19.453 -21.483 15.402 215 H LYS 23 H LYS 23 -22.297 -26.043 14.509 216 HA LYS 23 HA LYS 23 -20.327 -27.773 13.100 217 HB2 LYS 23 HB2 LYS 23 -23.133 -28.690 13.860 218 HB3 LYS 23 HB3 LYS 23 -22.100 -29.483 12.666 219 HG2 LYS 23 HG2 LYS 23 -20.341 -29.772 14.458 220 HG3 LYS 23 HG3 LYS 23 -21.560 -29.243 15.639 221 HD2 LYS 23 HD2 LYS 23 -23.043 -31.121 14.938 222 HD3 LYS 23 HD3 LYS 23 -21.872 -31.581 13.699 223 HE2 LYS 23 HE2 LYS 23 -21.532 -33.098 15.467 224 HE3 LYS 23 HE3 LYS 23 -20.164 -31.985 15.497 225 HZ1 LYS 23 HZ1 LYS 23 -22.541 -31.835 17.285 226 HZ2 LYS 23 HZ2 LYS 23 -21.070 -32.381 17.724 227 HZ3 LYS 23 HZ3 LYS 23 -21.265 -30.808 17.339 228 H ASN 24 H ASN 24 -20.993 -25.154 12.474 229 HA ASN 24 HA ASN 24 -22.285 -25.520 9.806 230 HB2 ASN 24 HB2 ASN 24 -23.768 -24.454 11.607 231 HB3 ASN 24 HB3 ASN 24 -22.709 -23.052 11.526 232 HD21 ASN 24 HD21 ASN 24 -23.963 -22.061 8.290 233 HD22 ASN 24 HD22 ASN 24 -22.512 -22.031 9.304 234 HA PRO 25 HA PRO 25 -18.166 -23.308 9.341 235 HB2 PRO 25 HB2 PRO 25 -16.527 -25.206 8.341 236 HB3 PRO 25 HB3 PRO 25 -16.899 -25.113 10.086 237 HG2 PRO 25 HG2 PRO 25 -18.229 -26.903 8.014 238 HG3 PRO 25 HG3 PRO 25 -17.521 -27.376 9.591 239 HD2 PRO 25 HD2 PRO 25 -20.194 -26.858 9.282 240 HD3 PRO 25 HD3 PRO 25 -19.298 -26.466 10.782 241 H ARG 26 H ARG 26 -19.859 -22.390 7.892 242 HA ARG 26 HA ARG 26 -19.361 -23.049 4.990 243 HB2 ARG 26 HB2 ARG 26 -21.954 -22.312 6.398 244 HB3 ARG 26 HB3 ARG 26 -21.749 -22.164 4.658 245 HG2 ARG 26 HG2 ARG 26 -21.510 -24.776 6.210 246 HG3 ARG 26 HG3 ARG 26 -22.901 -24.221 5.274 247 HD2 ARG 26 HD2 ARG 26 -21.093 -23.996 3.323 248 HD3 ARG 26 HD3 ARG 26 -20.214 -25.184 4.280 249 HE ARG 26 HE ARG 26 -22.713 -25.526 2.758 250 HH11 ARG 26 HH11 ARG 26 -23.566 -27.528 2.439 251 HH12 ARG 26 HH12 ARG 26 -22.997 -28.882 3.368 252 HH21 ARG 26 HH21 ARG 26 -20.697 -27.076 5.171 253 HH22 ARG 26 HH22 ARG 26 -21.414 -28.639 4.883 254 H VAL 27 H VAL 27 -20.487 -20.338 7.054 255 HA VAL 27 HA VAL 27 -19.067 -18.438 5.220 256 HB VAL 27 HB VAL 27 -21.910 -18.040 6.220 257 HG11 VAL 27 HG11 VAL 27 -20.199 -16.467 4.232 258 HG12 VAL 27 HG12 VAL 27 -21.895 -16.133 4.644 259 HG13 VAL 27 HG13 VAL 27 -20.641 -15.924 5.865 260 HG21 VAL 27 HG21 VAL 27 -21.981 -19.758 4.501 261 HG22 VAL 27 HG22 VAL 27 -22.564 -18.241 3.829 262 HG23 VAL 27 HG23 VAL 27 -20.920 -18.798 3.442 263 HA PRO 28 HA PRO 28 -18.096 -17.225 9.533 264 HB2 PRO 28 HB2 PRO 28 -15.446 -16.738 9.295 265 HB3 PRO 28 HB3 PRO 28 -16.124 -18.381 9.545 266 HG2 PRO 28 HG2 PRO 28 -15.219 -17.109 6.956 267 HG3 PRO 28 HG3 PRO 28 -14.922 -18.774 7.525 268 HD2 PRO 28 HD2 PRO 28 -16.924 -18.102 5.738 269 HD3 PRO 28 HD3 PRO 28 -17.056 -19.479 6.872 270 H THR 29 H THR 29 -17.531 -15.277 10.438 271 HA THR 29 HA THR 29 -18.314 -12.963 8.867 272 HB THR 29 HB THR 29 -18.383 -11.970 11.230 273 HG1 THR 29 HG1 THR 29 -18.386 -13.475 12.893 274 HG21 THR 29 HG21 THR 29 -20.058 -14.454 10.649 275 HG22 THR 29 HG22 THR 29 -20.480 -13.143 11.775 276 HG23 THR 29 HG23 THR 29 -20.386 -12.819 10.036 277 H GLN 30 H GLN 30 -16.105 -13.378 7.780 278 HA GLN 30 HA GLN 30 -13.879 -12.179 9.150 279 HB2 GLN 30 HB2 GLN 30 -12.548 -13.020 7.312 280 HB3 GLN 30 HB3 GLN 30 -13.778 -14.222 7.693 281 HG2 GLN 30 HG2 GLN 30 -15.140 -12.822 5.785 282 HG3 GLN 30 HG3 GLN 30 -13.500 -12.461 5.265 283 HE21 GLN 30 HE21 GLN 30 -15.109 -16.142 4.593 284 HE22 GLN 30 HE22 GLN 30 -16.008 -14.933 5.498 285 H LYS 31 H LYS 31 -16.099 -10.391 8.387 286 HA LYS 31 HA LYS 31 -15.043 -8.666 6.249 287 HB2 LYS 31 HB2 LYS 31 -17.410 -9.620 6.448 288 HB3 LYS 31 HB3 LYS 31 -17.660 -8.508 7.777 289 HG2 LYS 31 HG2 LYS 31 -18.524 -7.226 6.101 290 HG3 LYS 31 HG3 LYS 31 -16.859 -6.680 5.958 291 HD2 LYS 31 HD2 LYS 31 -18.236 -8.819 4.265 292 HD3 LYS 31 HD3 LYS 31 -17.903 -7.155 3.777 293 HE2 LYS 31 HE2 LYS 31 -15.451 -7.598 3.995 294 HE3 LYS 31 HE3 LYS 31 -15.813 -9.287 4.395 295 HZ1 LYS 31 HZ1 LYS 31 -16.530 -7.953 1.839 296 HZ2 LYS 31 HZ2 LYS 31 -15.314 -9.021 2.033 297 HZ3 LYS 31 HZ3 LYS 31 -16.861 -9.510 2.207 298 H THR 32 H THR 32 -13.213 -8.123 7.659 299 HA THR 32 HA THR 32 -13.755 -5.700 9.323 300 HB THR 32 HB THR 32 -13.543 -7.718 10.687 301 HG1 THR 32 HG1 THR 32 -12.171 -6.787 12.167 302 HG21 THR 32 HG21 THR 32 -10.614 -7.790 9.864 303 HG22 THR 32 HG22 THR 32 -11.396 -8.763 11.123 304 HG23 THR 32 HG23 THR 32 -11.850 -8.993 9.431 305 H GLY 33 H GLY 33 -13.005 -5.615 6.616 306 HA2 GLY 33 HA2 GLY 33 -11.675 -4.201 5.345 307 HA3 GLY 33 HA3 GLY 33 -10.734 -3.795 6.781 308 H GLU 34 H GLU 34 -11.305 -6.863 5.029 309 HA GLU 34 HA GLU 34 -8.435 -7.564 5.293 310 HB2 GLU 34 HB2 GLU 34 -10.932 -9.258 4.979 311 HB3 GLU 34 HB3 GLU 34 -9.296 -9.918 5.004 312 HG2 GLU 34 HG2 GLU 34 -10.483 -8.292 7.289 313 HG3 GLU 34 HG3 GLU 34 -10.516 -10.046 7.186 314 H LEU 35 H LEU 35 -9.164 -5.800 3.252 315 HA LEU 35 HA LEU 35 -8.645 -5.248 1.181 316 HB2 LEU 35 HB2 LEU 35 -6.636 -6.924 2.039 317 HB3 LEU 35 HB3 LEU 35 -7.105 -7.712 0.548 318 HG LEU 35 HG LEU 35 -6.928 -5.330 -0.500 319 HD11 LEU 35 HD11 LEU 35 -5.220 -4.944 2.009 320 HD12 LEU 35 HD12 LEU 35 -5.307 -3.832 0.636 321 HD13 LEU 35 HD13 LEU 35 -6.727 -4.080 1.669 322 HD21 LEU 35 HD21 LEU 35 -5.346 -7.181 -0.967 323 HD22 LEU 35 HD22 LEU 35 -4.502 -5.629 -0.857 324 HD23 LEU 35 HD23 LEU 35 -4.450 -6.779 0.502 325 H SER 36 H SER 36 -10.433 -5.077 -0.047 326 HA SER 36 HA SER 36 -11.870 -7.522 -0.874 327 HB2 SER 36 HB2 SER 36 -12.819 -4.666 -0.910 328 HB3 SER 36 HB3 SER 36 -13.763 -6.112 -1.295 329 HG SER 36 HG SER 36 -14.028 -5.388 0.893 330 H GLU 37 H GLU 37 -11.374 -4.483 -2.601 331 HA GLU 37 HA GLU 37 -10.411 -5.874 -4.973 332 HB2 GLU 37 HB2 GLU 37 -13.168 -5.999 -4.545 333 HB3 GLU 37 HB3 GLU 37 -13.029 -4.552 -5.558 334 HG2 GLU 37 HG2 GLU 37 -11.614 -5.893 -7.145 335 HG3 GLU 37 HG3 GLU 37 -11.859 -7.301 -6.101 336 H GLU 38 H GLU 38 -12.023 -2.954 -3.747 337 HA GLU 38 HA GLU 38 -10.778 -1.113 -5.594 338 HB2 GLU 38 HB2 GLU 38 -12.897 -0.787 -4.175 339 HB3 GLU 38 HB3 GLU 38 -11.836 -0.588 -2.783 340 HG2 GLU 38 HG2 GLU 38 -12.382 1.584 -3.480 341 HG3 GLU 38 HG3 GLU 38 -10.733 1.348 -4.038 342 H GLN 39 H GLN 39 -9.865 -2.519 -2.474 343 HA GLN 39 HA GLN 39 -7.749 -0.695 -1.820 344 HB2 GLN 39 HB2 GLN 39 -8.249 -3.557 -0.911 345 HB3 GLN 39 HB3 GLN 39 -7.109 -2.423 -0.194 346 HG2 GLN 39 HG2 GLN 39 -8.961 -2.310 1.227 347 HG3 GLN 39 HG3 GLN 39 -9.091 -0.859 0.243 348 HE21 GLN 39 HE21 GLN 39 -12.522 -2.074 0.240 349 HE22 GLN 39 HE22 GLN 39 -11.418 -1.091 1.192 350 H LYS 40 H LYS 40 -7.776 -3.799 -3.555 351 HA LYS 40 HA LYS 40 -4.920 -3.931 -4.057 352 HB2 LYS 40 HB2 LYS 40 -7.405 -5.121 -5.334 353 HB3 LYS 40 HB3 LYS 40 -5.823 -5.384 -6.076 354 HG2 LYS 40 HG2 LYS 40 -4.998 -6.647 -4.396 355 HG3 LYS 40 HG3 LYS 40 -5.933 -5.863 -3.133 356 HD2 LYS 40 HD2 LYS 40 -7.746 -7.253 -4.973 357 HD3 LYS 40 HD3 LYS 40 -6.496 -8.359 -4.369 358 HE2 LYS 40 HE2 LYS 40 -7.021 -7.599 -2.028 359 HE3 LYS 40 HE3 LYS 40 -8.323 -6.594 -2.667 360 HZ1 LYS 40 HZ1 LYS 40 -8.198 -9.555 -3.011 361 HZ2 LYS 40 HZ2 LYS 40 -9.041 -8.797 -1.824 362 HZ3 LYS 40 HZ3 LYS 40 -9.474 -8.572 -3.373 363 H LYS 41 H LYS 41 -7.570 -2.484 -5.878 364 HA LYS 41 HA LYS 41 -5.887 -1.438 -7.981 365 HB2 LYS 41 HB2 LYS 41 -8.591 -0.408 -6.999 366 HB3 LYS 41 HB3 LYS 41 -7.785 0.113 -8.478 367 HG2 LYS 41 HG2 LYS 41 -7.857 -2.199 -9.355 368 HG3 LYS 41 HG3 LYS 41 -8.717 -2.718 -7.895 369 HD2 LYS 41 HD2 LYS 41 -10.552 -1.112 -8.408 370 HD3 LYS 41 HD3 LYS 41 -9.695 -0.626 -9.888 371 HE2 LYS 41 HE2 LYS 41 -9.808 -2.989 -10.696 372 HE3 LYS 41 HE3 LYS 41 -10.712 -3.430 -9.241 373 HZ1 LYS 41 HZ1 LYS 41 -11.621 -1.476 -11.292 374 HZ2 LYS 41 HZ2 LYS 41 -12.207 -2.986 -11.103 375 HZ3 LYS 41 HZ3 LYS 41 -12.457 -1.866 -9.943 376 H ILE 42 H ILE 42 -5.769 -0.568 -4.772 377 HA ILE 42 HA ILE 42 -4.344 1.974 -5.468 378 HB ILE 42 HB ILE 42 -5.367 0.945 -2.818 379 HG12 ILE 42 HG12 ILE 42 -6.165 3.649 -3.810 380 HG13 ILE 42 HG13 ILE 42 -6.761 2.332 -4.801 381 HG21 ILE 42 HG21 ILE 42 -3.753 3.469 -3.363 382 HG22 ILE 42 HG22 ILE 42 -4.578 3.080 -1.839 383 HG23 ILE 42 HG23 ILE 42 -3.246 2.074 -2.385 384 HD11 ILE 42 HD11 ILE 42 -7.202 2.595 -1.811 385 HD12 ILE 42 HD12 ILE 42 -8.408 2.798 -3.112 386 HD13 ILE 42 HD13 ILE 42 -7.691 1.209 -2.813 387 H VAL 43 H VAL 43 -3.948 -1.037 -3.478 388 HA VAL 43 HA VAL 43 -1.163 -0.532 -2.997 389 HB VAL 43 HB VAL 43 -2.732 -3.127 -2.756 390 HG11 VAL 43 HG11 VAL 43 -0.012 -2.366 -1.584 391 HG12 VAL 43 HG12 VAL 43 -0.912 -3.865 -1.262 392 HG13 VAL 43 HG13 VAL 43 -0.278 -3.573 -2.860 393 HG21 VAL 43 HG21 VAL 43 -3.568 -1.272 -1.305 394 HG22 VAL 43 HG22 VAL 43 -2.876 -2.599 -0.385 395 HG23 VAL 43 HG23 VAL 43 -1.936 -1.105 -0.622 396 H ALA 44 H ALA 44 -2.620 -3.114 -5.059 397 HA ALA 44 HA ALA 44 -0.026 -3.916 -6.057 398 HB1 ALA 44 HB1 ALA 44 -2.826 -4.582 -7.038 399 HB2 ALA 44 HB2 ALA 44 -1.309 -5.447 -7.432 400 HB3 ALA 44 HB3 ALA 44 -1.913 -5.455 -5.765 401 H ASP 45 H ASP 45 -2.605 -1.832 -7.240 402 HA ASP 45 HA ASP 45 -1.562 -1.138 -9.805 403 HB2 ASP 45 HB2 ASP 45 -3.749 -0.428 -8.879 404 HB3 ASP 45 HB3 ASP 45 -2.914 0.658 -7.761 405 H TYR 46 H TYR 46 -0.532 0.038 -6.561 406 HA TYR 46 HA TYR 46 1.422 1.898 -7.610 407 HB2 TYR 46 HB2 TYR 46 0.169 1.686 -5.264 408 HB3 TYR 46 HB3 TYR 46 1.584 0.757 -4.822 409 HD1 TYR 46 HD1 TYR 46 3.375 2.736 -6.739 410 HD2 TYR 46 HD2 TYR 46 0.637 3.185 -3.475 411 HE1 TYR 46 HE1 TYR 46 4.407 4.888 -6.234 412 HE2 TYR 46 HE2 TYR 46 1.705 5.353 -2.865 413 HH TYR 46 HH TYR 46 4.385 6.754 -4.820 414 H ILE 47 H ILE 47 1.554 -1.462 -6.383 415 HA ILE 47 HA ILE 47 4.393 -1.815 -6.552 416 HB ILE 47 HB ILE 47 2.150 -3.841 -6.890 417 HG12 ILE 47 HG12 ILE 47 1.728 -3.218 -4.739 418 HG13 ILE 47 HG13 ILE 47 2.968 -4.387 -4.412 419 HG21 ILE 47 HG21 ILE 47 5.033 -4.388 -6.145 420 HG22 ILE 47 HG22 ILE 47 3.705 -5.568 -6.238 421 HG23 ILE 47 HG23 ILE 47 4.267 -4.776 -7.705 422 HD11 ILE 47 HD11 ILE 47 3.241 -1.349 -4.397 423 HD12 ILE 47 HD12 ILE 47 3.360 -2.469 -3.037 424 HD13 ILE 47 HD13 ILE 47 4.638 -2.452 -4.273 425 H SER 48 H SER 48 1.897 -1.939 -9.019 426 HA SER 48 HA SER 48 3.611 -2.758 -11.200 427 HB2 SER 48 HB2 SER 48 1.025 -2.815 -10.975 428 HB3 SER 48 HB3 SER 48 1.087 -1.110 -11.466 429 HG SER 48 HG SER 48 0.822 -2.564 -13.245 430 H GLU 49 H GLU 49 3.419 0.325 -9.524 431 HA GLU 49 HA GLU 49 4.068 1.866 -11.971 432 HB2 GLU 49 HB2 GLU 49 2.129 2.442 -10.464 433 HB3 GLU 49 HB3 GLU 49 3.289 2.788 -9.187 434 HG2 GLU 49 HG2 GLU 49 2.678 4.858 -10.135 435 HG3 GLU 49 HG3 GLU 49 4.316 4.547 -10.689 436 H VAL 50 H VAL 50 5.368 1.261 -8.667 437 HA VAL 50 HA VAL 50 7.904 2.620 -9.504 438 HB VAL 50 HB VAL 50 8.062 3.696 -7.378 439 HG11 VAL 50 HG11 VAL 50 5.239 4.139 -8.342 440 HG12 VAL 50 HG12 VAL 50 6.317 5.272 -7.498 441 HG13 VAL 50 HG13 VAL 50 6.692 4.769 -9.150 442 HG21 VAL 50 HG21 VAL 50 7.151 2.032 -5.874 443 HG22 VAL 50 HG22 VAL 50 6.274 3.555 -5.697 444 HG23 VAL 50 HG23 VAL 50 5.541 2.206 -6.591 445 H GLY 51 H GLY 51 6.699 -0.280 -8.073 446 HA2 GLY 51 HA2 GLY 51 8.399 -2.041 -8.658 447 HA3 GLY 51 HA3 GLY 51 9.531 -1.180 -7.615 448 H LEU 52 H LEU 52 8.895 -0.896 -5.373 449 HA LEU 52 HA LEU 52 6.826 -2.510 -4.162 450 HB2 LEU 52 HB2 LEU 52 8.828 -4.166 -4.694 451 HB3 LEU 52 HB3 LEU 52 9.665 -3.330 -3.405 452 HG LEU 52 HG LEU 52 7.419 -3.821 -2.042 453 HD11 LEU 52 HD11 LEU 52 7.431 -5.951 -4.235 454 HD12 LEU 52 HD12 LEU 52 6.473 -6.035 -2.755 455 HD13 LEU 52 HD13 LEU 52 6.156 -4.750 -3.925 456 HD21 LEU 52 HD21 LEU 52 9.572 -4.707 -1.369 457 HD22 LEU 52 HD22 LEU 52 8.337 -5.945 -1.245 458 HD23 LEU 52 HD23 LEU 52 9.477 -5.983 -2.615 459 H ASN 53 H ASN 53 9.913 -1.010 -3.617 460 HA ASN 53 HA ASN 53 9.164 -0.041 -0.915 461 HB2 ASN 53 HB2 ASN 53 11.881 -0.403 -2.245 462 HB3 ASN 53 HB3 ASN 53 11.621 0.061 -0.569 463 HD21 ASN 53 HD21 ASN 53 11.821 -3.807 -1.345 464 HD22 ASN 53 HD22 ASN 53 12.405 -2.556 -2.430 465 H ASN 54 H ASN 54 9.429 1.331 -3.977 466 HA ASN 54 HA ASN 54 10.580 3.898 -3.082 467 HB2 ASN 54 HB2 ASN 54 9.546 3.059 -5.809 468 HB3 ASN 54 HB3 ASN 54 10.514 4.488 -5.450 469 HD21 ASN 54 HD21 ASN 54 12.366 0.999 -6.145 470 HD22 ASN 54 HD22 ASN 54 10.699 1.357 -6.598 471 H LEU 55 H LEU 55 7.446 2.552 -3.319 472 HA LEU 55 HA LEU 55 5.912 5.015 -3.313 473 HB2 LEU 55 HB2 LEU 55 4.092 3.576 -2.529 474 HB3 LEU 55 HB3 LEU 55 4.909 2.938 -3.940 475 HG LEU 55 HG LEU 55 6.206 1.420 -2.247 476 HD11 LEU 55 HD11 LEU 55 3.716 2.139 -0.629 477 HD12 LEU 55 HD12 LEU 55 4.791 0.759 -0.327 478 HD13 LEU 55 HD13 LEU 55 5.402 2.400 -0.127 479 HD21 LEU 55 HD21 LEU 55 4.600 0.641 -3.939 480 HD22 LEU 55 HD22 LEU 55 4.399 -0.235 -2.415 481 HD23 LEU 55 HD23 LEU 55 3.246 1.046 -2.860 482 H ASN 56 H ASN 56 4.585 5.641 -1.332 483 HA ASN 56 HA ASN 56 6.098 5.239 1.188 484 HB2 ASN 56 HB2 ASN 56 5.878 7.459 1.882 485 HB3 ASN 56 HB3 ASN 56 6.512 7.518 0.250 486 HD21 ASN 56 HD21 ASN 56 4.106 10.135 -0.003 487 HD22 ASN 56 HD22 ASN 56 5.806 9.782 0.288 488 H ALA 57 H ALA 57 4.803 5.652 3.102 489 HA ALA 57 HA ALA 57 2.501 3.894 3.063 490 HB1 ALA 57 HB1 ALA 57 3.916 5.547 5.198 491 HB2 ALA 57 HB2 ALA 57 2.678 4.326 5.536 492 HB3 ALA 57 HB3 ALA 57 4.212 3.839 4.794 493 H THR 58 H THR 58 2.954 7.379 3.133 494 HA THR 58 HA THR 58 0.454 8.234 4.151 495 HB THR 58 HB THR 58 2.245 9.660 2.153 496 HG1 THR 58 HG1 THR 58 3.272 10.464 4.001 497 HG21 THR 58 HG21 THR 58 0.323 10.691 4.283 498 HG22 THR 58 HG22 THR 58 1.451 11.700 3.342 499 HG23 THR 58 HG23 THR 58 0.149 10.836 2.519 500 H GLU 59 H GLU 59 1.513 7.782 0.748 501 HA GLU 59 HA GLU 59 -1.024 8.496 -0.412 502 HB2 GLU 59 HB2 GLU 59 1.384 6.904 -1.378 503 HB3 GLU 59 HB3 GLU 59 0.007 7.219 -2.429 504 HG2 GLU 59 HG2 GLU 59 1.727 9.369 -1.113 505 HG3 GLU 59 HG3 GLU 59 1.907 8.794 -2.766 506 H LEU 60 H LEU 60 0.148 5.413 0.818 507 HA LEU 60 HA LEU 60 -2.185 3.874 -0.012 508 HB2 LEU 60 HB2 LEU 60 0.152 3.465 1.840 509 HB3 LEU 60 HB3 LEU 60 -1.307 2.557 2.186 510 HG LEU 60 HG LEU 60 -1.319 1.642 -0.123 511 HD11 LEU 60 HD11 LEU 60 1.396 3.004 -0.341 512 HD12 LEU 60 HD12 LEU 60 0.748 1.801 -1.478 513 HD13 LEU 60 HD13 LEU 60 -0.049 3.375 -1.302 514 HD21 LEU 60 HD21 LEU 60 -0.305 0.395 1.745 515 HD22 LEU 60 HD22 LEU 60 0.575 0.099 0.236 516 HD23 LEU 60 HD23 LEU 60 1.249 1.205 1.452 517 H SER 61 H SER 61 -1.340 5.370 3.188 518 HA SER 61 HA SER 61 -3.765 4.707 4.464 519 HB2 SER 61 HB2 SER 61 -3.125 6.361 6.136 520 HB3 SER 61 HB3 SER 61 -1.756 5.331 5.672 521 HG SER 61 HG SER 61 -1.172 7.528 5.766 522 H LYS 62 H LYS 62 -3.061 7.382 2.327 523 HA LYS 62 HA LYS 62 -5.369 9.036 2.954 524 HB2 LYS 62 HB2 LYS 62 -3.424 8.870 0.629 525 HB3 LYS 62 HB3 LYS 62 -4.823 9.944 0.562 526 HG2 LYS 62 HG2 LYS 62 -4.121 11.216 2.457 527 HG3 LYS 62 HG3 LYS 62 -2.887 10.044 2.901 528 HD2 LYS 62 HD2 LYS 62 -1.824 11.964 1.888 529 HD3 LYS 62 HD3 LYS 62 -1.618 10.562 0.827 530 HE2 LYS 62 HE2 LYS 62 -3.515 11.366 -0.574 531 HE3 LYS 62 HE3 LYS 62 -3.708 12.773 0.483 532 HZ1 LYS 62 HZ1 LYS 62 -1.275 12.120 -1.106 533 HZ2 LYS 62 HZ2 LYS 62 -2.360 13.289 -1.484 534 HZ3 LYS 62 HZ3 LYS 62 -1.433 13.438 -0.145 535 H ARG 63 H ARG 63 -5.017 6.238 0.893 536 HA ARG 63 HA ARG 63 -7.765 6.674 -0.267 537 HB2 ARG 63 HB2 ARG 63 -5.402 5.112 -1.362 538 HB3 ARG 63 HB3 ARG 63 -6.995 5.262 -2.127 539 HG2 ARG 63 HG2 ARG 63 -6.662 7.748 -2.246 540 HG3 ARG 63 HG3 ARG 63 -5.031 7.533 -1.581 541 HD2 ARG 63 HD2 ARG 63 -4.507 6.003 -3.521 542 HD3 ARG 63 HD3 ARG 63 -6.089 6.392 -4.197 543 HE ARG 63 HE ARG 63 -5.329 8.512 -4.819 544 HH11 ARG 63 HH11 ARG 63 -3.683 10.041 -5.301 545 HH12 ARG 63 HH12 ARG 63 -2.134 9.844 -4.481 546 HH21 ARG 63 HH21 ARG 63 -2.828 7.140 -2.668 547 HH22 ARG 63 HH22 ARG 63 -1.696 8.365 -3.251 548 H LEU 64 H LEU 64 -5.742 4.292 1.364 549 HA LEU 64 HA LEU 64 -7.880 2.268 1.474 550 HB2 LEU 64 HB2 LEU 64 -5.157 2.488 2.809 551 HB3 LEU 64 HB3 LEU 64 -6.187 1.063 2.879 552 HG LEU 64 HG LEU 64 -5.033 2.217 0.299 553 HD11 LEU 64 HD11 LEU 64 -4.103 -0.192 1.903 554 HD12 LEU 64 HD12 LEU 64 -3.424 0.430 0.380 555 HD13 LEU 64 HD13 LEU 64 -3.288 1.388 1.853 556 HD21 LEU 64 HD21 LEU 64 -7.058 0.866 -0.078 557 HD22 LEU 64 HD22 LEU 64 -5.618 -0.012 -0.619 558 HD23 LEU 64 HD23 LEU 64 -6.384 -0.439 0.926 559 H ASN 65 H ASN 65 -6.905 5.001 3.378 560 HA ASN 65 HA ASN 65 -7.551 5.906 5.287 561 HB2 ASN 65 HB2 ASN 65 -9.817 5.406 4.066 562 HB3 ASN 65 HB3 ASN 65 -10.082 4.268 5.384 563 HD21 ASN 65 HD21 ASN 65 -10.366 6.964 7.833 564 HD22 ASN 65 HD22 ASN 65 -9.630 5.365 7.669 565 H ILE 66 H ILE 66 -6.030 3.399 5.342 566 HA ILE 66 HA ILE 66 -6.248 2.412 8.113 567 HB ILE 66 HB ILE 66 -4.001 1.413 7.609 568 HG12 ILE 66 HG12 ILE 66 -4.435 2.694 4.890 569 HG13 ILE 66 HG13 ILE 66 -3.100 2.954 6.006 570 HG21 ILE 66 HG21 ILE 66 -6.135 0.677 5.574 571 HG22 ILE 66 HG22 ILE 66 -4.859 -0.368 6.244 572 HG23 ILE 66 HG23 ILE 66 -6.150 0.211 7.291 573 HD11 ILE 66 HD11 ILE 66 -3.689 0.453 4.371 574 HD12 ILE 66 HD12 ILE 66 -2.407 1.639 4.113 575 HD13 ILE 66 HD13 ILE 66 -2.369 0.595 5.562 576 H THR 67 H THR 67 -4.372 2.792 9.615 577 HA THR 67 HA THR 67 -3.472 5.606 9.615 578 HB THR 67 HB THR 67 -4.109 4.587 11.734 579 HG1 THR 67 HG1 THR 67 -2.349 5.395 12.820 580 HG21 THR 67 HG21 THR 67 -1.587 2.892 11.487 581 HG22 THR 67 HG22 THR 67 -2.658 3.012 12.893 582 HG23 THR 67 HG23 THR 67 -3.253 2.264 11.408 583 H VAL 68 H VAL 68 -1.181 6.164 9.733 584 HA VAL 68 HA VAL 68 0.200 5.215 7.432 585 HB VAL 68 HB VAL 68 1.493 6.702 9.750 586 HG11 VAL 68 HG11 VAL 68 2.044 6.709 6.745 587 HG12 VAL 68 HG12 VAL 68 2.897 7.682 7.962 588 HG13 VAL 68 HG13 VAL 68 3.054 5.924 7.979 589 HG21 VAL 68 HG21 VAL 68 -0.543 7.950 9.157 590 HG22 VAL 68 HG22 VAL 68 0.884 8.799 8.569 591 HG23 VAL 68 HG23 VAL 68 -0.110 7.866 7.434 592 H ASP 69 H ASP 69 0.652 4.385 10.864 593 HA ASP 69 HA ASP 69 2.930 2.711 10.403 594 HB2 ASP 69 HB2 ASP 69 2.312 3.770 12.586 595 HB3 ASP 69 HB3 ASP 69 0.943 2.661 12.708 596 H LYS 70 H LYS 70 -0.525 2.007 10.196 597 HA LYS 70 HA LYS 70 -0.105 -0.881 9.887 598 HB2 LYS 70 HB2 LYS 70 -2.475 0.960 9.445 599 HB3 LYS 70 HB3 LYS 70 -2.436 -0.643 8.709 600 HG2 LYS 70 HG2 LYS 70 -1.967 -1.640 10.970 601 HG3 LYS 70 HG3 LYS 70 -2.256 -0.044 11.686 602 HD2 LYS 70 HD2 LYS 70 -4.564 -0.050 10.783 603 HD3 LYS 70 HD3 LYS 70 -4.245 -1.585 9.946 604 HE2 LYS 70 HE2 LYS 70 -3.766 -2.652 12.167 605 HE3 LYS 70 HE3 LYS 70 -4.231 -1.144 12.965 606 HZ1 LYS 70 HZ1 LYS 70 -6.014 -2.793 11.242 607 HZ2 LYS 70 HZ2 LYS 70 -6.088 -2.712 12.868 608 HZ3 LYS 70 HZ3 LYS 70 -6.455 -1.398 11.974 609 H ALA 71 H ALA 71 -0.113 1.933 7.738 610 HA ALA 71 HA ALA 71 -0.004 0.327 5.295 611 HB1 ALA 71 HB1 ALA 71 0.832 3.213 5.815 612 HB2 ALA 71 HB2 ALA 71 0.621 2.456 4.224 613 HB3 ALA 71 HB3 ALA 71 -0.765 2.698 5.305 614 H LYS 72 H LYS 72 2.481 1.921 7.276 615 HA LYS 72 HA LYS 72 4.819 1.147 5.857 616 HB2 LYS 72 HB2 LYS 72 4.240 1.676 8.798 617 HB3 LYS 72 HB3 LYS 72 5.871 1.303 8.217 618 HG2 LYS 72 HG2 LYS 72 5.959 3.275 6.874 619 HG3 LYS 72 HG3 LYS 72 4.241 3.594 7.113 620 HD2 LYS 72 HD2 LYS 72 5.733 5.091 8.416 621 HD3 LYS 72 HD3 LYS 72 4.514 4.240 9.372 622 HE2 LYS 72 HE2 LYS 72 6.135 2.655 10.200 623 HE3 LYS 72 HE3 LYS 72 7.386 3.270 9.103 624 HZ1 LYS 72 HZ1 LYS 72 6.160 4.810 11.332 625 HZ2 LYS 72 HZ2 LYS 72 7.656 4.162 11.344 626 HZ3 LYS 72 HZ3 LYS 72 7.312 5.382 10.320 627 H THR 73 H THR 73 3.106 -0.711 8.428 628 HA THR 73 HA THR 73 5.009 -2.942 8.067 629 HB THR 73 HB THR 73 3.959 -2.269 10.275 630 HG1 THR 73 HG1 THR 73 4.109 -4.413 10.913 631 HG21 THR 73 HG21 THR 73 1.752 -4.149 9.339 632 HG22 THR 73 HG22 THR 73 1.931 -3.392 10.938 633 HG23 THR 73 HG23 THR 73 1.557 -2.389 9.526 634 H TYR 74 H TYR 74 1.615 -2.323 7.044 635 HA TYR 74 HA TYR 74 1.007 -4.886 6.094 636 HB2 TYR 74 HB2 TYR 74 -0.704 -3.244 6.254 637 HB3 TYR 74 HB3 TYR 74 0.177 -2.114 5.214 638 HD1 TYR 74 HD1 TYR 74 -0.002 -2.108 2.893 639 HD2 TYR 74 HD2 TYR 74 -1.677 -5.364 5.187 640 HE1 TYR 74 HE1 TYR 74 -0.909 -3.086 0.829 641 HE2 TYR 74 HE2 TYR 74 -2.616 -6.344 3.093 642 HH TYR 74 HH TYR 74 -1.989 -4.909 -0.116 643 H ILE 75 H ILE 75 2.777 -2.296 4.393 644 HA ILE 75 HA ILE 75 3.170 -3.414 1.853 645 HB ILE 75 HB ILE 75 4.895 -1.703 3.660 646 HG12 ILE 75 HG12 ILE 75 3.539 -0.911 1.055 647 HG13 ILE 75 HG13 ILE 75 2.671 -0.891 2.575 648 HG21 ILE 75 HG21 ILE 75 5.504 -2.366 0.738 649 HG22 ILE 75 HG22 ILE 75 6.327 -1.135 1.718 650 HG23 ILE 75 HG23 ILE 75 6.501 -2.823 2.139 651 HD11 ILE 75 HD11 ILE 75 5.180 0.742 1.975 652 HD12 ILE 75 HD12 ILE 75 3.524 1.342 2.116 653 HD13 ILE 75 HD13 ILE 75 4.351 0.687 3.539 654 H LYS 76 H LYS 76 5.629 -3.768 4.470 655 HA LYS 76 HA LYS 76 6.877 -6.039 3.285 656 HB2 LYS 76 HB2 LYS 76 8.046 -6.288 5.454 657 HB3 LYS 76 HB3 LYS 76 8.124 -4.656 4.795 658 HG2 LYS 76 HG2 LYS 76 6.476 -3.844 6.358 659 HG3 LYS 76 HG3 LYS 76 6.119 -5.477 6.941 660 HD2 LYS 76 HD2 LYS 76 8.888 -4.275 7.228 661 HD3 LYS 76 HD3 LYS 76 7.593 -3.954 8.395 662 HE2 LYS 76 HE2 LYS 76 7.271 -6.362 8.777 663 HE3 LYS 76 HE3 LYS 76 8.555 -6.741 7.618 664 HZ1 LYS 76 HZ1 LYS 76 8.930 -5.223 10.148 665 HZ2 LYS 76 HZ2 LYS 76 9.389 -6.767 9.900 666 HZ3 LYS 76 HZ3 LYS 76 10.121 -5.561 9.080 667 H ASN 77 H ASN 77 4.084 -5.968 5.434 668 HA ASN 77 HA ASN 77 4.331 -8.716 6.223 669 HB2 ASN 77 HB2 ASN 77 3.030 -6.804 7.372 670 HB3 ASN 77 HB3 ASN 77 1.734 -7.142 6.216 671 HD21 ASN 77 HD21 ASN 77 2.662 -9.773 9.242 672 HD22 ASN 77 HD22 ASN 77 3.787 -8.500 8.784 673 H SER 78 H SER 78 2.535 -7.194 3.559 674 HA SER 78 HA SER 78 1.520 -9.750 2.523 675 HB2 SER 78 HB2 SER 78 1.634 -6.935 1.399 676 HB3 SER 78 HB3 SER 78 0.998 -8.322 0.492 677 HG SER 78 HG SER 78 -0.648 -7.189 1.648 678 H ASN 79 H ASN 79 4.230 -7.585 1.764 679 HA ASN 79 HA ASN 79 5.574 -9.745 0.245 680 HB2 ASN 79 HB2 ASN 79 5.965 -8.034 -1.646 681 HB3 ASN 79 HB3 ASN 79 4.428 -8.873 -1.559 682 HD21 ASN 79 HD21 ASN 79 4.400 -4.860 -0.676 683 HD22 ASN 79 HD22 ASN 79 5.832 -5.807 -0.281 684 H ARG 80 H ARG 80 7.003 -9.782 1.983 685 HA ARG 80 HA ARG 80 8.601 -7.503 2.741 686 HB2 ARG 80 HB2 ARG 80 8.096 -9.633 4.098 687 HB3 ARG 80 HB3 ARG 80 9.371 -10.420 3.168 688 HG2 ARG 80 HG2 ARG 80 11.021 -8.798 3.986 689 HG3 ARG 80 HG3 ARG 80 9.744 -7.821 4.720 690 HD2 ARG 80 HD2 ARG 80 10.696 -8.996 6.532 691 HD3 ARG 80 HD3 ARG 80 9.168 -9.794 6.204 692 HE ARG 80 HE ARG 80 10.299 -11.717 5.473 693 HH11 ARG 80 HH11 ARG 80 12.031 -13.108 5.472 694 HH12 ARG 80 HH12 ARG 80 13.637 -12.499 5.733 695 HH21 ARG 80 HH21 ARG 80 12.696 -9.220 6.051 696 HH22 ARG 80 HH22 ARG 80 14.012 -10.360 6.053 697 H MET 81 H MET 81 9.280 -10.204 0.584 698 HA MET 81 HA MET 81 11.815 -8.926 -0.352 699 HB2 MET 81 HB2 MET 81 10.666 -11.723 -0.692 700 HB3 MET 81 HB3 MET 81 12.159 -11.172 -1.456 701 HG2 MET 81 HG2 MET 81 11.690 -11.236 1.550 702 HG3 MET 81 HG3 MET 81 12.540 -12.467 0.619 703 HE1 MET 81 HE1 MET 81 14.639 -12.377 2.149 704 HE2 MET 81 HE2 MET 81 15.483 -10.879 2.600 705 HE3 MET 81 HE3 MET 81 13.823 -11.167 3.168 706 H GLY 82 H GLY 82 8.550 -9.462 -1.439 707 HA2 GLY 82 HA2 GLY 82 7.568 -8.580 -3.420 708 HA3 GLY 82 HA3 GLY 82 9.152 -8.464 -4.184 709 H ARG 83 H ARG 83 6.481 -9.946 -4.689 710 HA ARG 83 HA ARG 83 5.649 -11.999 -5.387 711 HB2 ARG 83 HB2 ARG 83 8.274 -11.659 -6.823 712 HB3 ARG 83 HB3 ARG 83 7.254 -13.074 -7.141 713 HG2 ARG 83 HG2 ARG 83 5.353 -11.679 -7.716 714 HG3 ARG 83 HG3 ARG 83 6.266 -10.201 -7.352 715 HD2 ARG 83 HD2 ARG 83 7.767 -10.561 -9.187 716 HD3 ARG 83 HD3 ARG 83 7.239 -12.233 -9.377 717 HE ARG 83 HE ARG 83 5.475 -11.577 -10.675 718 HH11 ARG 83 HH11 ARG 83 4.113 -10.250 -11.784 719 HH12 ARG 83 HH12 ARG 83 4.120 -8.538 -11.485 720 HH21 ARG 83 HH21 ARG 83 6.576 -8.643 -9.092 721 HH22 ARG 83 HH22 ARG 83 5.470 -7.647 -9.996 722 H THR 84 H THR 84 6.543 -12.197 -2.851 723 HA THR 84 HA THR 84 7.364 -13.477 -1.177 724 HB THR 84 HB THR 84 6.212 -15.898 -2.544 725 HG1 THR 84 HG1 THR 84 4.164 -15.117 -2.072 726 HG21 THR 84 HG21 THR 84 5.897 -14.651 0.237 727 HG22 THR 84 HG22 THR 84 5.202 -16.203 -0.293 728 HG23 THR 84 HG23 THR 84 6.956 -16.023 -0.148 729 H ASN 85 H ASN 85 9.408 -13.052 -3.066 730 HA ASN 85 HA ASN 85 11.436 -13.671 -3.749 731 HB2 ASN 85 HB2 ASN 85 11.714 -13.934 -1.282 732 HB3 ASN 85 HB3 ASN 85 11.349 -15.647 -1.432 733 HD21 ASN 85 HD21 ASN 85 15.015 -14.289 -2.682 734 HD22 ASN 85 HD22 ASN 85 13.681 -13.152 -2.618 735 H ASN 86 H ASN 86 8.959 -15.580 -4.536 736 HA ASN 86 HA ASN 86 10.384 -17.967 -5.368 737 HB2 ASN 86 HB2 ASN 86 8.368 -18.895 -5.509 738 HB3 ASN 86 HB3 ASN 86 7.801 -17.462 -4.658 739 HD21 ASN 86 HD21 ASN 86 6.357 -16.050 -7.680 740 HD22 ASN 86 HD22 ASN 86 7.276 -15.559 -6.253 741 H PHE 87 H PHE 87 10.194 -14.942 -6.790 742 HA PHE 87 HA PHE 87 9.938 -15.519 -9.564 743 HB2 PHE 87 HB2 PHE 87 10.476 -13.209 -9.872 744 HB3 PHE 87 HB3 PHE 87 9.426 -13.378 -8.482 745 HD1 PHE 87 HD1 PHE 87 12.819 -12.503 -9.629 746 HD2 PHE 87 HD2 PHE 87 10.229 -12.849 -6.196 747 HE1 PHE 87 HE1 PHE 87 14.458 -11.231 -8.258 748 HE2 PHE 87 HE2 PHE 87 11.850 -11.547 -4.844 749 HZ PHE 87 HZ PHE 87 13.975 -10.756 -5.863 750 H LYS 88 H LYS 88 12.236 -16.847 -7.950 751 HA LYS 88 HA LYS 88 14.707 -16.039 -9.356 752 HB2 LYS 88 HB2 LYS 88 15.777 -17.409 -7.588 753 HB3 LYS 88 HB3 LYS 88 14.717 -16.153 -6.942 754 HG2 LYS 88 HG2 LYS 88 12.906 -17.927 -6.679 755 HG3 LYS 88 HG3 LYS 88 14.108 -19.140 -7.122 756 HD2 LYS 88 HD2 LYS 88 15.391 -18.705 -5.137 757 HD3 LYS 88 HD3 LYS 88 14.518 -17.189 -4.822 758 HE2 LYS 88 HE2 LYS 88 12.398 -18.469 -4.532 759 HE3 LYS 88 HE3 LYS 88 13.293 -19.983 -4.741 760 HZ1 LYS 88 HZ1 LYS 88 13.760 -17.978 -2.589 761 HZ2 LYS 88 HZ2 LYS 88 13.020 -19.424 -2.383 762 HZ3 LYS 88 HZ3 LYS 88 14.609 -19.371 -2.759 763 H THR 89 H THR 89 12.301 -18.220 -9.939 764 HA THR 89 HA THR 89 14.007 -20.173 -11.414 765 HB THR 89 HB THR 89 11.826 -20.785 -9.372 766 HG1 THR 89 HG1 THR 89 13.536 -21.851 -8.326 767 HG21 THR 89 HG21 THR 89 13.422 -22.632 -11.185 768 HG22 THR 89 HG22 THR 89 12.431 -23.165 -9.799 769 HG23 THR 89 HG23 THR 89 11.657 -22.380 -11.181 770 H ILE 90 H ILE 90 10.662 -18.974 -10.728 771 HA ILE 90 HA ILE 90 9.501 -20.002 -13.155 772 HB ILE 90 HB ILE 90 7.655 -18.544 -12.642 773 HG12 ILE 90 HG12 ILE 90 9.124 -17.535 -10.192 774 HG13 ILE 90 HG13 ILE 90 9.110 -16.626 -11.700 775 HG21 ILE 90 HG21 ILE 90 8.631 -19.930 -10.108 776 HG22 ILE 90 HG22 ILE 90 6.955 -19.628 -10.594 777 HG23 ILE 90 HG23 ILE 90 7.942 -20.764 -11.516 778 HD11 ILE 90 HD11 ILE 90 6.647 -17.410 -10.102 779 HD12 ILE 90 HD12 ILE 90 7.371 -15.794 -10.226 780 HD13 ILE 90 HD13 ILE 90 6.644 -16.553 -11.660 781 H LYS 91 H LYS 91 8.526 -18.511 -14.777 782 HA LYS 91 HA LYS 91 8.690 -17.122 -16.552 783 HB2 LYS 91 HB2 LYS 91 10.623 -15.414 -14.966 784 HB3 LYS 91 HB3 LYS 91 9.727 -14.922 -16.381 785 HG2 LYS 91 HG2 LYS 91 8.391 -15.636 -13.726 786 HG3 LYS 91 HG3 LYS 91 8.974 -14.043 -14.143 787 HD2 LYS 91 HD2 LYS 91 6.691 -13.960 -14.580 788 HD3 LYS 91 HD3 LYS 91 7.449 -14.064 -16.171 789 HE2 LYS 91 HE2 LYS 91 6.890 -16.486 -16.271 790 HE3 LYS 91 HE3 LYS 91 6.218 -16.405 -14.636 791 HZ1 LYS 91 HZ1 LYS 91 5.170 -14.920 -16.992 792 HZ2 LYS 91 HZ2 LYS 91 4.481 -16.242 -16.330 793 HZ3 LYS 91 HZ3 LYS 91 4.542 -14.849 -15.485 794 H MET 92 H MET 92 11.661 -18.585 -15.469 795 HA MET 92 HA MET 92 12.444 -18.670 -18.347 796 HB2 MET 92 HB2 MET 92 14.796 -18.241 -17.792 797 HB3 MET 92 HB3 MET 92 13.760 -16.869 -17.470 798 HG2 MET 92 HG2 MET 92 14.218 -18.709 -15.157 799 HG3 MET 92 HG3 MET 92 15.628 -17.828 -15.741 800 HE1 MET 92 HE1 MET 92 15.713 -16.932 -13.157 801 HE2 MET 92 HE2 MET 92 14.381 -16.010 -12.422 802 HE3 MET 92 HE3 MET 92 14.159 -17.728 -12.818 803 H PHE 93 H PHE 93 11.288 -20.674 -16.357 804 HA PHE 93 HA PHE 93 13.171 -22.887 -17.047 805 HB2 PHE 93 HB2 PHE 93 13.548 -21.869 -14.714 806 HB3 PHE 93 HB3 PHE 93 11.989 -22.568 -14.276 807 HD1 PHE 93 HD1 PHE 93 15.431 -23.287 -15.447 808 HD2 PHE 93 HD2 PHE 93 11.823 -24.920 -13.764 809 HE1 PHE 93 HE1 PHE 93 16.635 -25.422 -14.953 810 HE2 PHE 93 HE2 PHE 93 13.019 -27.054 -13.261 811 HZ PHE 93 HZ PHE 93 15.422 -27.301 -13.859 812 H GLU 94 H GLU 94 9.840 -21.913 -16.398 813 HA GLU 94 HA GLU 94 8.821 -24.663 -16.375 814 HB2 GLU 94 HB2 GLU 94 7.374 -21.994 -16.435 815 HB3 GLU 94 HB3 GLU 94 6.619 -23.582 -16.237 816 HG2 GLU 94 HG2 GLU 94 7.916 -23.930 -14.140 817 HG3 GLU 94 HG3 GLU 94 8.612 -22.314 -14.305 818 H ASP 95 H ASP 95 8.099 -25.811 -18.065 819 HA ASP 95 HA ASP 95 7.217 -24.560 -20.593 820 HB2 ASP 95 HB2 ASP 95 9.602 -26.436 -20.327 821 HB3 ASP 95 HB3 ASP 95 8.676 -26.311 -21.815 822 H ASP 96 H ASP 96 6.021 -25.992 -21.946 823 HA ASP 96 HA ASP 96 4.557 -28.132 -20.588 824 HB2 ASP 96 HB2 ASP 96 4.502 -27.083 -23.444 825 HB3 ASP 96 HB3 ASP 96 3.479 -28.386 -22.849 826 H VAL 97 H VAL 97 4.635 -30.303 -20.984 827 HA VAL 97 HA VAL 97 6.815 -31.391 -22.746 828 HB VAL 97 HB VAL 97 5.902 -32.523 -20.077 829 HG11 VAL 97 HG11 VAL 97 8.120 -33.406 -21.980 830 HG12 VAL 97 HG12 VAL 97 7.837 -34.058 -20.351 831 HG13 VAL 97 HG13 VAL 97 6.630 -34.307 -21.612 832 HG21 VAL 97 HG21 VAL 97 7.274 -30.514 -19.718 833 HG22 VAL 97 HG22 VAL 97 8.199 -31.958 -19.308 834 HG23 VAL 97 HG23 VAL 97 8.502 -31.125 -20.849 835 H SER 98 H SER 98 3.683 -32.194 -21.217 836 HA SER 98 HA SER 98 2.945 -33.809 -23.627 837 HB2 SER 98 HB2 SER 98 2.177 -34.361 -20.742 838 HB3 SER 98 HB3 SER 98 1.733 -35.326 -22.164 839 HG SER 98 HG SER 98 3.537 -36.208 -21.063 840 H SER 99 H SER 99 2.431 -30.974 -23.103 841 HA SER 99 HA SER 99 0.839 -29.378 -22.970 842 HB2 SER 99 HB2 SER 99 -0.883 -29.514 -24.688 843 HB3 SER 99 HB3 SER 99 0.717 -29.995 -25.248 844 HG SER 99 HG SER 99 -0.941 -31.394 -26.002 845 H ALA 100 H ALA 100 0.636 -30.910 -20.687 846 HA ALA 100 HA ALA 100 -2.202 -30.514 -19.900 847 HB1 ALA 100 HB1 ALA 100 -0.528 -33.008 -19.356 848 HB2 ALA 100 HB2 ALA 100 -2.156 -32.683 -18.726 849 HB3 ALA 100 HB3 ALA 100 -1.912 -32.900 -20.468 850 H SER 101 H SER 101 -2.525 -30.386 -17.578 851 HA SER 101 HA SER 101 -0.207 -29.565 -15.915 852 HB2 SER 101 HB2 SER 101 -2.577 -27.751 -16.534 853 HB3 SER 101 HB3 SER 101 -1.350 -27.454 -15.290 854 HG SER 101 HG SER 101 -0.892 -26.339 -17.244 855 H ALA 102 H ALA 102 -0.550 -29.847 -13.757 856 HA ALA 102 HA ALA 102 -1.299 -30.875 -11.920 857 HB1 ALA 102 HB1 ALA 102 -3.988 -29.690 -12.673 858 HB2 ALA 102 HB2 ALA 102 -3.451 -30.176 -11.052 859 HB3 ALA 102 HB3 ALA 102 -2.657 -28.820 -11.874 860 H GLN 103 H GLN 103 -1.629 -32.403 -14.563 861 HA GLN 103 HA GLN 103 -3.632 -34.429 -13.896 862 HB2 GLN 103 HB2 GLN 103 -1.644 -34.120 -16.168 863 HB3 GLN 103 HB3 GLN 103 -2.615 -35.569 -15.968 864 HG2 GLN 103 HG2 GLN 103 -3.726 -32.759 -16.371 865 HG3 GLN 103 HG3 GLN 103 -3.638 -34.032 -17.584 866 HE21 GLN 103 HE21 GLN 103 -6.764 -34.030 -14.998 867 HE22 GLN 103 HE22 GLN 103 -5.545 -32.763 -14.950 868 HA PRO 104 HA PRO 104 -0.903 -37.139 -11.659 869 HB2 PRO 104 HB2 PRO 104 -1.806 -39.650 -12.309 870 HB3 PRO 104 HB3 PRO 104 -2.687 -38.516 -11.242 871 HG2 PRO 104 HG2 PRO 104 -3.121 -38.994 -14.207 872 HG3 PRO 104 HG3 PRO 104 -4.349 -38.932 -12.902 873 HD2 PRO 104 HD2 PRO 104 -3.841 -36.780 -14.466 874 HD3 PRO 104 HD3 PRO 104 -4.170 -36.579 -12.719 875 H ASN 105 H ASN 105 1.126 -37.169 -12.212 876 HA ASN 105 HA ASN 105 2.132 -38.814 -14.481 877 HB2 ASN 105 HB2 ASN 105 1.954 -36.468 -15.259 878 HB3 ASN 105 HB3 ASN 105 2.911 -35.923 -13.882 879 HD21 ASN 105 HD21 ASN 105 5.412 -36.042 -16.479 880 HD22 ASN 105 HD22 ASN 105 4.165 -34.999 -15.809 881 H LEU 106 H LEU 106 2.791 -40.387 -13.056 882 HA LEU 106 HA LEU 106 5.013 -39.721 -11.182 883 HB2 LEU 106 HB2 LEU 106 2.653 -40.061 -10.174 884 HB3 LEU 106 HB3 LEU 106 2.851 -41.751 -10.564 885 HG LEU 106 HG LEU 106 3.379 -41.398 -8.267 886 HD11 LEU 106 HD11 LEU 106 6.085 -41.686 -9.626 887 HD12 LEU 106 HD12 LEU 106 5.622 -42.233 -8.006 888 HD13 LEU 106 HD13 LEU 106 4.894 -42.995 -9.429 889 HD21 LEU 106 HD21 LEU 106 3.876 -38.974 -8.382 890 HD22 LEU 106 HD22 LEU 106 5.059 -39.874 -7.421 891 HD23 LEU 106 HD23 LEU 106 5.478 -39.339 -9.058 892 HA PRO 107 HA PRO 107 6.367 -42.938 -14.176 893 HB2 PRO 107 HB2 PRO 107 8.984 -42.206 -14.429 894 HB3 PRO 107 HB3 PRO 107 7.638 -41.353 -15.246 895 HG2 PRO 107 HG2 PRO 107 9.024 -40.595 -12.655 896 HG3 PRO 107 HG3 PRO 107 8.638 -39.545 -14.055 897 HD2 PRO 107 HD2 PRO 107 7.054 -39.670 -11.837 898 HD3 PRO 107 HD3 PRO 107 6.362 -39.440 -13.471 Start of MODEL 2 1 H1 GLY -5 H1 GLY -5 -51.714 -11.601 -3.775 2 H2 GLY -5 H2 GLY -5 -53.229 -12.079 -4.177 3 H3 GLY -5 H3 GLY -5 -52.558 -10.779 -4.912 4 HA2 GLY -5 HA2 GLY -5 -52.528 -12.648 -6.411 5 HA3 GLY -5 HA3 GLY -5 -50.885 -12.153 -5.968 6 H SER -4 H SER -4 -49.594 -13.829 -5.510 7 HA SER -4 HA SER -4 -50.714 -16.323 -4.275 8 HB2 SER -4 HB2 SER -4 -48.472 -16.060 -6.308 9 HB3 SER -4 HB3 SER -4 -49.005 -17.564 -5.532 10 HG SER -4 HG SER -4 -49.961 -17.238 -7.612 11 H HIS -3 H HIS -3 -49.395 -17.490 -2.854 12 HA HIS -3 HA HIS -3 -47.435 -15.804 -1.371 13 HB2 HIS -3 HB2 HIS -3 -49.773 -16.445 -0.466 14 HB3 HIS -3 HB3 HIS -3 -49.098 -18.044 -0.202 15 HD2 HIS -3 HD2 HIS -3 -46.181 -16.181 0.751 16 HE1 HIS -3 HE1 HIS -3 -48.661 -15.644 4.177 17 HE2 HIS -3 HE2 HIS -3 -46.293 -15.464 3.288 18 H MET -2 H MET -2 -46.563 -17.393 -3.544 19 HA MET -2 HA MET -2 -45.269 -19.819 -2.463 20 HB2 MET -2 HB2 MET -2 -45.283 -18.600 -5.251 21 HB3 MET -2 HB3 MET -2 -44.527 -20.138 -4.801 22 HG2 MET -2 HG2 MET -2 -46.722 -21.021 -4.090 23 HG3 MET -2 HG3 MET -2 -47.490 -19.494 -4.531 24 HE1 MET -2 HE1 MET -2 -49.292 -20.639 -6.013 25 HE2 MET -2 HE2 MET -2 -48.928 -21.863 -7.249 26 HE3 MET -2 HE3 MET -2 -48.623 -22.216 -5.533 27 H ALA -1 H ALA -1 -43.987 -18.707 -0.880 28 HA ALA -1 HA ALA -1 -41.521 -17.393 -1.969 29 HB1 ALA -1 HB1 ALA -1 -43.034 -16.747 0.589 30 HB2 ALA -1 HB2 ALA -1 -41.493 -16.023 0.072 31 HB3 ALA -1 HB3 ALA -1 -42.961 -15.766 -0.888 32 H SER 0 H SER 0 -42.471 -18.777 1.185 33 HA SER 0 HA SER 0 -41.449 -20.157 2.640 34 HB2 SER 0 HB2 SER 0 -40.961 -21.762 0.120 35 HB3 SER 0 HB3 SER 0 -41.087 -22.402 1.771 36 HG SER 0 HG SER 0 -43.068 -22.588 0.625 37 H MET 1 H MET 1 -39.522 -18.200 1.703 38 HA MET 1 HA MET 1 -37.086 -19.481 2.783 39 HB2 MET 1 HB2 MET 1 -37.104 -18.089 0.070 40 HB3 MET 1 HB3 MET 1 -35.642 -18.494 0.976 41 HG2 MET 1 HG2 MET 1 -36.330 -20.897 0.932 42 HG3 MET 1 HG3 MET 1 -37.647 -20.462 -0.159 43 HE1 MET 1 HE1 MET 1 -36.379 -18.320 -2.166 44 HE2 MET 1 HE2 MET 1 -35.826 -19.424 -3.441 45 HE3 MET 1 HE3 MET 1 -37.381 -19.715 -2.631 46 H ASP 2 H ASP 2 -38.695 -16.615 1.820 47 HA ASP 2 HA ASP 2 -36.758 -14.805 3.133 48 HB2 ASP 2 HB2 ASP 2 -37.695 -14.441 0.830 49 HB3 ASP 2 HB3 ASP 2 -39.280 -14.182 1.555 50 H GLN 3 H GLN 3 -39.300 -16.531 4.264 51 HA GLN 3 HA GLN 3 -40.270 -14.518 6.241 52 HB2 GLN 3 HB2 GLN 3 -41.542 -14.465 4.070 53 HB3 GLN 3 HB3 GLN 3 -41.967 -16.146 4.313 54 HG2 GLN 3 HG2 GLN 3 -42.777 -14.771 6.706 55 HG3 GLN 3 HG3 GLN 3 -43.180 -13.697 5.374 56 HE21 GLN 3 HE21 GLN 3 -44.962 -17.445 5.458 57 HE22 GLN 3 HE22 GLN 3 -43.353 -17.212 6.161 58 H LEU 4 H LEU 4 -38.543 -16.687 6.799 59 HA LEU 4 HA LEU 4 -40.260 -18.646 8.269 60 HB2 LEU 4 HB2 LEU 4 -37.544 -18.890 6.979 61 HB3 LEU 4 HB3 LEU 4 -37.960 -19.908 8.350 62 HG LEU 4 HG LEU 4 -39.965 -20.756 7.191 63 HD11 LEU 4 HD11 LEU 4 -38.843 -19.250 4.796 64 HD12 LEU 4 HD12 LEU 4 -40.057 -20.551 4.707 65 HD13 LEU 4 HD13 LEU 4 -40.456 -19.052 5.532 66 HD21 LEU 4 HD21 LEU 4 -37.826 -21.979 7.181 67 HD22 LEU 4 HD22 LEU 4 -38.718 -22.236 5.675 68 HD23 LEU 4 HD23 LEU 4 -37.331 -21.121 5.703 69 H ASP 5 H ASP 5 -40.099 -16.119 9.364 70 HA ASP 5 HA ASP 5 -39.008 -16.778 12.003 71 HB2 ASP 5 HB2 ASP 5 -37.192 -15.473 10.965 72 HB3 ASP 5 HB3 ASP 5 -38.329 -14.203 10.515 73 H GLU 6 H GLU 6 -41.050 -16.987 12.804 74 HA GLU 6 HA GLU 6 -43.219 -15.169 12.104 75 HB2 GLU 6 HB2 GLU 6 -43.497 -17.607 12.335 76 HB3 GLU 6 HB3 GLU 6 -43.084 -17.505 14.052 77 HG2 GLU 6 HG2 GLU 6 -45.042 -16.052 14.435 78 HG3 GLU 6 HG3 GLU 6 -45.416 -16.075 12.711 79 H ILE 7 H ILE 7 -43.181 -13.161 12.955 80 HA ILE 7 HA ILE 7 -42.083 -12.730 15.657 81 HB ILE 7 HB ILE 7 -42.764 -10.517 13.731 82 HG12 ILE 7 HG12 ILE 7 -40.022 -10.807 13.480 83 HG13 ILE 7 HG13 ILE 7 -40.529 -12.490 13.459 84 HG21 ILE 7 HG21 ILE 7 -40.724 -10.796 15.983 85 HG22 ILE 7 HG22 ILE 7 -41.033 -9.341 15.011 86 HG23 ILE 7 HG23 ILE 7 -42.283 -9.948 16.098 87 HD11 ILE 7 HD11 ILE 7 -41.545 -10.241 11.659 88 HD12 ILE 7 HD12 ILE 7 -40.477 -11.579 11.192 89 HD13 ILE 7 HD13 ILE 7 -42.169 -11.906 11.633 90 H ILE 8 H ILE 8 -43.978 -13.690 16.695 91 HA ILE 8 HA ILE 8 -45.826 -11.566 17.502 92 HB ILE 8 HB ILE 8 -46.938 -12.738 15.582 93 HG12 ILE 8 HG12 ILE 8 -48.460 -12.981 18.204 94 HG13 ILE 8 HG13 ILE 8 -48.139 -11.456 17.368 95 HG21 ILE 8 HG21 ILE 8 -47.324 -15.088 17.480 96 HG22 ILE 8 HG22 ILE 8 -47.840 -14.952 15.787 97 HG23 ILE 8 HG23 ILE 8 -46.122 -15.062 16.177 98 HD11 ILE 8 HD11 ILE 8 -49.787 -13.781 16.292 99 HD12 ILE 8 HD12 ILE 8 -50.374 -12.202 16.835 100 HD13 ILE 8 HD13 ILE 8 -49.373 -12.312 15.373 101 H GLU 9 H GLU 9 -46.782 -11.866 19.526 102 HA GLU 9 HA GLU 9 -46.194 -14.285 21.118 103 HB2 GLU 9 HB2 GLU 9 -44.184 -12.811 21.365 104 HB3 GLU 9 HB3 GLU 9 -45.222 -11.537 22.017 105 HG2 GLU 9 HG2 GLU 9 -45.830 -12.991 23.922 106 HG3 GLU 9 HG3 GLU 9 -44.906 -14.324 23.222 107 H GLN 10 H GLN 10 -47.680 -11.030 21.009 108 HA GLN 10 HA GLN 10 -50.084 -12.094 22.380 109 HB2 GLN 10 HB2 GLN 10 -48.316 -10.561 23.795 110 HB3 GLN 10 HB3 GLN 10 -49.296 -9.297 23.032 111 HG2 GLN 10 HG2 GLN 10 -51.352 -10.332 24.000 112 HG3 GLN 10 HG3 GLN 10 -50.356 -11.566 24.767 113 HE21 GLN 10 HE21 GLN 10 -51.056 -8.878 27.284 114 HE22 GLN 10 HE22 GLN 10 -52.049 -9.973 26.331 115 H ILE 11 H ILE 11 -51.762 -10.102 22.315 116 HA ILE 11 HA ILE 11 -52.011 -9.211 19.522 117 HB ILE 11 HB ILE 11 -53.403 -11.110 19.855 118 HG12 ILE 11 HG12 ILE 11 -55.053 -8.566 20.000 119 HG13 ILE 11 HG13 ILE 11 -54.164 -9.128 18.579 120 HG21 ILE 11 HG21 ILE 11 -54.728 -9.737 22.237 121 HG22 ILE 11 HG22 ILE 11 -55.150 -11.313 21.544 122 HG23 ILE 11 HG23 ILE 11 -53.603 -11.110 22.347 123 HD11 ILE 11 HD11 ILE 11 -56.528 -10.526 19.906 124 HD12 ILE 11 HD12 ILE 11 -56.494 -9.745 18.316 125 HD13 ILE 11 HD13 ILE 11 -55.555 -11.229 18.591 126 H GLN 12 H GLN 12 -52.135 -7.216 19.310 127 HA GLN 12 HA GLN 12 -53.483 -5.282 21.016 128 HB2 GLN 12 HB2 GLN 12 -51.513 -3.922 21.504 129 HB3 GLN 12 HB3 GLN 12 -51.377 -5.490 22.260 130 HG2 GLN 12 HG2 GLN 12 -49.967 -4.756 19.645 131 HG3 GLN 12 HG3 GLN 12 -49.260 -4.555 21.240 132 HE21 GLN 12 HE21 GLN 12 -49.303 -8.290 19.609 133 HE22 GLN 12 HE22 GLN 12 -49.769 -6.866 18.683 134 H LYS 13 H LYS 13 -53.006 -2.987 20.116 135 HA LYS 13 HA LYS 13 -53.475 -2.891 17.239 136 HB2 LYS 13 HB2 LYS 13 -53.073 -0.687 19.306 137 HB3 LYS 13 HB3 LYS 13 -53.551 -0.439 17.620 138 HG2 LYS 13 HG2 LYS 13 -55.599 -1.800 17.989 139 HG3 LYS 13 HG3 LYS 13 -55.142 -2.029 19.687 140 HD2 LYS 13 HD2 LYS 13 -55.218 0.439 20.030 141 HD3 LYS 13 HD3 LYS 13 -55.751 0.640 18.345 142 HE2 LYS 13 HE2 LYS 13 -57.740 -0.780 18.815 143 HE3 LYS 13 HE3 LYS 13 -57.203 -0.988 20.486 144 HZ1 LYS 13 HZ1 LYS 13 -57.949 1.611 19.249 145 HZ2 LYS 13 HZ2 LYS 13 -58.859 0.773 20.311 146 HZ3 LYS 13 HZ3 LYS 13 -57.442 1.422 20.791 147 H GLU 14 H GLU 14 -51.693 -3.873 16.446 148 HA GLU 14 HA GLU 14 -48.986 -3.232 16.943 149 HB2 GLU 14 HB2 GLU 14 -48.582 -4.910 15.146 150 HB3 GLU 14 HB3 GLU 14 -49.758 -5.452 16.332 151 HG2 GLU 14 HG2 GLU 14 -51.599 -5.107 14.866 152 HG3 GLU 14 HG3 GLU 14 -50.662 -4.106 13.764 153 H ALA 15 H ALA 15 -50.164 -0.807 16.101 154 HA ALA 15 HA ALA 15 -49.836 -0.238 13.384 155 HB1 ALA 15 HB1 ALA 15 -49.927 1.570 15.834 156 HB2 ALA 15 HB2 ALA 15 -50.313 2.085 14.169 157 HB3 ALA 15 HB3 ALA 15 -51.335 0.886 14.998 158 H ILE 16 H ILE 16 -47.295 -0.457 15.568 159 HA ILE 16 HA ILE 16 -45.508 1.449 14.271 160 HB ILE 16 HB ILE 16 -45.470 -0.494 16.541 161 HG12 ILE 16 HG12 ILE 16 -44.717 2.464 16.365 162 HG13 ILE 16 HG13 ILE 16 -46.327 1.857 16.743 163 HG21 ILE 16 HG21 ILE 16 -42.902 0.826 15.536 164 HG22 ILE 16 HG22 ILE 16 -43.076 -0.067 17.065 165 HG23 ILE 16 HG23 ILE 16 -43.253 -0.918 15.542 166 HD11 ILE 16 HD11 ILE 16 -43.840 1.525 18.461 167 HD12 ILE 16 HD12 ILE 16 -45.285 2.484 18.803 168 HD13 ILE 16 HD13 ILE 16 -45.394 0.713 18.776 169 H ASN 17 H ASN 17 -46.464 -1.565 13.460 170 HA ASN 17 HA ASN 17 -43.918 -2.517 12.473 171 HB2 ASN 17 HB2 ASN 17 -46.770 -3.552 12.229 172 HB3 ASN 17 HB3 ASN 17 -45.425 -4.347 11.404 173 HD21 ASN 17 HD21 ASN 17 -45.797 -4.752 15.436 174 HD22 ASN 17 HD22 ASN 17 -46.868 -3.678 14.525 175 H SER 18 H SER 18 -46.078 -0.305 11.092 176 HA SER 18 HA SER 18 -45.505 -0.933 8.293 177 HB2 SER 18 HB2 SER 18 -46.872 1.485 9.521 178 HB3 SER 18 HB3 SER 18 -46.862 1.036 7.804 179 HG SER 18 HG SER 18 -48.767 0.318 8.862 180 H ASN 19 H ASN 19 -44.052 1.242 10.670 181 HA ASN 19 HA ASN 19 -42.686 2.780 8.526 182 HB2 ASN 19 HB2 ASN 19 -42.226 4.432 10.199 183 HB3 ASN 19 HB3 ASN 19 -43.919 3.981 10.337 184 HD21 ASN 19 HD21 ASN 19 -43.542 2.831 13.667 185 HD22 ASN 19 HD22 ASN 19 -44.645 3.185 12.342 186 H VAL 20 H VAL 20 -41.922 0.187 10.542 187 HA VAL 20 HA VAL 20 -39.055 0.633 10.785 188 HB VAL 20 HB VAL 20 -40.799 -1.837 11.094 189 HG11 VAL 20 HG11 VAL 20 -37.841 -1.507 11.771 190 HG12 VAL 20 HG12 VAL 20 -38.869 -2.853 12.308 191 HG13 VAL 20 HG13 VAL 20 -38.537 -2.642 10.591 192 HG21 VAL 20 HG21 VAL 20 -41.157 -0.052 12.786 193 HG22 VAL 20 HG22 VAL 20 -40.409 -1.480 13.501 194 HG23 VAL 20 HG23 VAL 20 -39.421 -0.046 13.145 195 H VAL 21 H VAL 21 -41.116 -0.809 8.321 196 HA VAL 21 HA VAL 21 -38.814 -1.929 6.845 197 HB VAL 21 HB VAL 21 -41.752 -2.166 6.125 198 HG11 VAL 21 HG11 VAL 21 -39.293 -3.843 5.403 199 HG12 VAL 21 HG12 VAL 21 -40.965 -4.172 4.903 200 HG13 VAL 21 HG13 VAL 21 -40.137 -2.737 4.299 201 HG21 VAL 21 HG21 VAL 21 -41.481 -3.138 8.356 202 HG22 VAL 21 HG22 VAL 21 -41.613 -4.429 7.167 203 HG23 VAL 21 HG23 VAL 21 -40.019 -4.008 7.833 204 H LEU 22 H LEU 22 -38.044 0.357 6.670 205 HA LEU 22 HA LEU 22 -38.805 1.367 3.973 206 HB2 LEU 22 HB2 LEU 22 -39.493 2.839 6.089 207 HB3 LEU 22 HB3 LEU 22 -37.782 3.252 6.099 208 HG LEU 22 HG LEU 22 -38.097 3.939 3.618 209 HD11 LEU 22 HD11 LEU 22 -41.027 3.871 4.467 210 HD12 LEU 22 HD12 LEU 22 -40.387 4.563 2.961 211 HD13 LEU 22 HD13 LEU 22 -40.294 2.819 3.241 212 HD21 LEU 22 HD21 LEU 22 -37.843 5.574 5.420 213 HD22 LEU 22 HD22 LEU 22 -39.025 6.132 4.227 214 HD23 LEU 22 HD23 LEU 22 -39.582 5.474 5.783 215 H LYS 23 H LYS 23 -37.131 2.195 2.693 216 HA LYS 23 HA LYS 23 -34.535 0.947 3.107 217 HB2 LYS 23 HB2 LYS 23 -36.061 1.077 0.975 218 HB3 LYS 23 HB3 LYS 23 -35.325 2.661 0.739 219 HG2 LYS 23 HG2 LYS 23 -33.054 1.487 0.785 220 HG3 LYS 23 HG3 LYS 23 -33.929 -0.046 0.909 221 HD2 LYS 23 HD2 LYS 23 -35.020 0.398 -1.280 222 HD3 LYS 23 HD3 LYS 23 -34.251 1.987 -1.346 223 HE2 LYS 23 HE2 LYS 23 -32.989 0.572 -2.777 224 HE3 LYS 23 HE3 LYS 23 -32.003 0.893 -1.350 225 HZ1 LYS 23 HZ1 LYS 23 -33.571 -1.594 -1.823 226 HZ2 LYS 23 HZ2 LYS 23 -31.955 -1.458 -1.984 227 HZ3 LYS 23 HZ3 LYS 23 -32.635 -1.315 -0.509 228 H ASN 24 H ASN 24 -35.170 3.280 4.808 229 HA ASN 24 HA ASN 24 -34.384 5.760 4.390 230 HB2 ASN 24 HB2 ASN 24 -35.126 4.936 6.540 231 HB3 ASN 24 HB3 ASN 24 -33.606 4.065 6.775 232 HD21 ASN 24 HD21 ASN 24 -32.488 6.899 8.565 233 HD22 ASN 24 HD22 ASN 24 -32.850 5.178 8.597 234 HA PRO 25 HA PRO 25 -30.134 4.941 3.090 235 HB2 PRO 25 HB2 PRO 25 -30.058 6.325 0.765 236 HB3 PRO 25 HB3 PRO 25 -31.109 4.900 0.988 237 HG2 PRO 25 HG2 PRO 25 -31.892 7.817 1.101 238 HG3 PRO 25 HG3 PRO 25 -32.775 6.432 0.374 239 HD2 PRO 25 HD2 PRO 25 -33.214 7.519 2.937 240 HD3 PRO 25 HD3 PRO 25 -33.771 5.933 2.341 241 H ARG 26 H ARG 26 -29.738 6.104 5.170 242 HA ARG 26 HA ARG 26 -28.203 8.664 4.704 243 HB2 ARG 26 HB2 ARG 26 -29.880 7.824 7.098 244 HB3 ARG 26 HB3 ARG 26 -28.773 9.207 7.079 245 HG2 ARG 26 HG2 ARG 26 -30.070 10.144 5.120 246 HG3 ARG 26 HG3 ARG 26 -31.242 8.838 5.334 247 HD2 ARG 26 HD2 ARG 26 -32.311 10.044 6.873 248 HD3 ARG 26 HD3 ARG 26 -30.911 9.964 7.928 249 HE ARG 26 HE ARG 26 -31.784 12.210 6.231 250 HH11 ARG 26 HH11 ARG 26 -30.778 14.174 6.347 251 HH12 ARG 26 HH12 ARG 26 -29.278 14.337 7.213 252 HH21 ARG 26 HH21 ARG 26 -29.086 11.052 8.157 253 HH22 ARG 26 HH22 ARG 26 -28.335 12.622 8.193 254 H VAL 27 H VAL 27 -28.243 5.651 6.582 255 HA VAL 27 HA VAL 27 -25.343 6.078 7.240 256 HB VAL 27 HB VAL 27 -27.373 4.669 8.993 257 HG11 VAL 27 HG11 VAL 27 -24.481 5.543 9.478 258 HG12 VAL 27 HG12 VAL 27 -25.560 4.799 10.677 259 HG13 VAL 27 HG13 VAL 27 -25.029 3.865 9.279 260 HG21 VAL 27 HG21 VAL 27 -27.875 7.064 9.005 261 HG22 VAL 27 HG22 VAL 27 -27.075 6.620 10.510 262 HG23 VAL 27 HG23 VAL 27 -26.154 7.453 9.239 263 HA PRO 28 HA PRO 28 -25.408 2.100 4.919 264 HB2 PRO 28 HB2 PRO 28 -23.288 2.527 3.289 265 HB3 PRO 28 HB3 PRO 28 -24.915 3.193 2.938 266 HG2 PRO 28 HG2 PRO 28 -22.570 4.598 4.250 267 HG3 PRO 28 HG3 PRO 28 -23.605 5.198 2.920 268 HD2 PRO 28 HD2 PRO 28 -23.995 5.880 5.547 269 HD3 PRO 28 HD3 PRO 28 -25.356 5.709 4.396 270 H THR 29 H THR 29 -23.654 0.496 4.671 271 HA THR 29 HA THR 29 -21.955 0.385 7.094 272 HB THR 29 HB THR 29 -22.364 -2.120 6.725 273 HG1 THR 29 HG1 THR 29 -24.177 -2.642 5.518 274 HG21 THR 29 HG21 THR 29 -24.796 -0.383 7.326 275 HG22 THR 29 HG22 THR 29 -24.569 -2.080 7.806 276 HG23 THR 29 HG23 THR 29 -23.526 -0.823 8.490 277 H GLN 30 H GLN 30 -20.478 1.608 5.653 278 HA GLN 30 HA GLN 30 -19.070 0.134 3.648 279 HB2 GLN 30 HB2 GLN 30 -17.685 2.125 3.399 280 HB3 GLN 30 HB3 GLN 30 -19.388 2.536 3.432 281 HG2 GLN 30 HG2 GLN 30 -17.719 2.713 5.975 282 HG3 GLN 30 HG3 GLN 30 -17.659 3.993 4.766 283 HE21 GLN 30 HE21 GLN 30 -20.914 3.718 7.199 284 HE22 GLN 30 HE22 GLN 30 -19.490 2.717 7.444 285 H LYS 31 H LYS 31 -18.891 -1.333 6.043 286 HA LYS 31 HA LYS 31 -16.216 -0.936 7.193 287 HB2 LYS 31 HB2 LYS 31 -18.457 -1.540 8.374 288 HB3 LYS 31 HB3 LYS 31 -18.122 -3.189 7.895 289 HG2 LYS 31 HG2 LYS 31 -15.707 -2.027 9.080 290 HG3 LYS 31 HG3 LYS 31 -17.081 -1.617 10.090 291 HD2 LYS 31 HD2 LYS 31 -16.171 -3.605 10.972 292 HD3 LYS 31 HD3 LYS 31 -17.676 -4.088 10.172 293 HE2 LYS 31 HE2 LYS 31 -16.411 -4.890 8.217 294 HE3 LYS 31 HE3 LYS 31 -14.911 -4.240 8.881 295 HZ1 LYS 31 HZ1 LYS 31 -16.474 -6.497 10.004 296 HZ2 LYS 31 HZ2 LYS 31 -14.989 -6.568 9.301 297 HZ3 LYS 31 HZ3 LYS 31 -15.172 -5.833 10.745 298 H THR 32 H THR 32 -15.203 -1.246 5.101 299 HA THR 32 HA THR 32 -14.661 -4.112 4.420 300 HB THR 32 HB THR 32 -16.303 -3.007 2.951 301 HG1 THR 32 HG1 THR 32 -15.446 -3.846 1.115 302 HG21 THR 32 HG21 THR 32 -13.954 -1.386 1.898 303 HG22 THR 32 HG22 THR 32 -15.599 -1.452 1.232 304 HG23 THR 32 HG23 THR 32 -15.323 -0.739 2.827 305 H GLY 33 H GLY 33 -13.095 -2.332 6.116 306 HA2 GLY 33 HA2 GLY 33 -10.632 -1.611 4.733 307 HA3 GLY 33 HA3 GLY 33 -10.939 -1.565 6.470 308 H GLU 34 H GLU 34 -11.586 -4.553 4.868 309 HA GLU 34 HA GLU 34 -9.252 -5.856 6.197 310 HB2 GLU 34 HB2 GLU 34 -12.012 -6.959 5.570 311 HB3 GLU 34 HB3 GLU 34 -10.667 -7.889 6.250 312 HG2 GLU 34 HG2 GLU 34 -10.576 -6.309 8.188 313 HG3 GLU 34 HG3 GLU 34 -12.009 -5.491 7.558 314 H LEU 35 H LEU 35 -9.107 -4.613 3.602 315 HA LEU 35 HA LEU 35 -8.255 -4.840 1.602 316 HB2 LEU 35 HB2 LEU 35 -6.567 -6.027 3.232 317 HB3 LEU 35 HB3 LEU 35 -7.041 -7.488 2.376 318 HG LEU 35 HG LEU 35 -6.640 -5.874 0.239 319 HD11 LEU 35 HD11 LEU 35 -4.637 -4.787 2.250 320 HD12 LEU 35 HD12 LEU 35 -4.875 -4.281 0.561 321 HD13 LEU 35 HD13 LEU 35 -6.109 -3.934 1.797 322 HD21 LEU 35 HD21 LEU 35 -5.490 -8.035 0.715 323 HD22 LEU 35 HD22 LEU 35 -4.429 -6.815 -0.004 324 HD23 LEU 35 HD23 LEU 35 -4.335 -7.160 1.741 325 H SER 36 H SER 36 -10.214 -4.932 0.509 326 HA SER 36 HA SER 36 -11.414 -7.562 -0.104 327 HB2 SER 36 HB2 SER 36 -12.570 -4.788 -0.342 328 HB3 SER 36 HB3 SER 36 -13.411 -6.309 -0.685 329 HG SER 36 HG SER 36 -13.622 -5.296 1.506 330 H GLU 37 H GLU 37 -11.001 -4.608 -1.987 331 HA GLU 37 HA GLU 37 -9.986 -6.113 -4.291 332 HB2 GLU 37 HB2 GLU 37 -11.918 -6.058 -5.664 333 HB3 GLU 37 HB3 GLU 37 -12.424 -6.724 -4.099 334 HG2 GLU 37 HG2 GLU 37 -13.353 -4.491 -3.490 335 HG3 GLU 37 HG3 GLU 37 -12.997 -3.937 -5.134 336 H GLU 38 H GLU 38 -11.585 -3.136 -3.234 337 HA GLU 38 HA GLU 38 -10.282 -1.485 -5.265 338 HB2 GLU 38 HB2 GLU 38 -12.477 -0.968 -4.217 339 HB3 GLU 38 HB3 GLU 38 -11.665 -0.684 -2.672 340 HG2 GLU 38 HG2 GLU 38 -10.429 1.203 -3.627 341 HG3 GLU 38 HG3 GLU 38 -11.043 0.834 -5.242 342 H GLN 39 H GLN 39 -9.458 -2.679 -2.101 343 HA GLN 39 HA GLN 39 -7.431 -0.761 -1.395 344 HB2 GLN 39 HB2 GLN 39 -7.886 -3.617 -0.444 345 HB3 GLN 39 HB3 GLN 39 -6.838 -2.418 0.304 346 HG2 GLN 39 HG2 GLN 39 -8.880 -2.460 1.579 347 HG3 GLN 39 HG3 GLN 39 -8.813 -0.935 0.704 348 HE21 GLN 39 HE21 GLN 39 -12.117 -1.621 -0.377 349 HE22 GLN 39 HE22 GLN 39 -11.058 -0.508 0.511 350 H LYS 40 H LYS 40 -7.296 -3.971 -2.932 351 HA LYS 40 HA LYS 40 -4.491 -3.936 -3.559 352 HB2 LYS 40 HB2 LYS 40 -6.900 -5.269 -4.876 353 HB3 LYS 40 HB3 LYS 40 -5.251 -5.566 -5.428 354 HG2 LYS 40 HG2 LYS 40 -4.668 -6.824 -3.660 355 HG3 LYS 40 HG3 LYS 40 -5.536 -5.850 -2.499 356 HD2 LYS 40 HD2 LYS 40 -7.559 -7.191 -4.077 357 HD3 LYS 40 HD3 LYS 40 -6.312 -8.383 -3.670 358 HE2 LYS 40 HE2 LYS 40 -6.452 -7.534 -1.269 359 HE3 LYS 40 HE3 LYS 40 -7.836 -6.551 -1.759 360 HZ1 LYS 40 HZ1 LYS 40 -7.711 -9.529 -1.975 361 HZ2 LYS 40 HZ2 LYS 40 -8.484 -8.700 -0.785 362 HZ3 LYS 40 HZ3 LYS 40 -9.022 -8.588 -2.315 363 H LYS 41 H LYS 41 -7.256 -2.596 -5.284 364 HA LYS 41 HA LYS 41 -5.698 -1.601 -7.525 365 HB2 LYS 41 HB2 LYS 41 -8.376 -0.600 -6.487 366 HB3 LYS 41 HB3 LYS 41 -7.610 -0.072 -7.978 367 HG2 LYS 41 HG2 LYS 41 -7.660 -2.361 -8.872 368 HG3 LYS 41 HG3 LYS 41 -8.428 -2.937 -7.385 369 HD2 LYS 41 HD2 LYS 41 -10.355 -1.405 -7.793 370 HD3 LYS 41 HD3 LYS 41 -9.583 -0.859 -9.299 371 HE2 LYS 41 HE2 LYS 41 -9.632 -3.207 -10.148 372 HE3 LYS 41 HE3 LYS 41 -10.437 -3.720 -8.660 373 HZ1 LYS 41 HZ1 LYS 41 -11.547 -1.774 -10.617 374 HZ2 LYS 41 HZ2 LYS 41 -12.040 -3.318 -10.441 375 HZ3 LYS 41 HZ3 LYS 41 -12.296 -2.243 -9.241 376 H ILE 42 H ILE 42 -5.453 -0.605 -4.350 377 HA ILE 42 HA ILE 42 -4.235 2.014 -5.134 378 HB ILE 42 HB ILE 42 -5.230 0.924 -2.496 379 HG12 ILE 42 HG12 ILE 42 -6.239 3.494 -3.718 380 HG13 ILE 42 HG13 ILE 42 -6.765 2.005 -4.481 381 HG21 ILE 42 HG21 ILE 42 -3.864 3.592 -2.989 382 HG22 ILE 42 HG22 ILE 42 -4.796 3.185 -1.534 383 HG23 ILE 42 HG23 ILE 42 -3.332 2.290 -1.902 384 HD11 ILE 42 HD11 ILE 42 -7.107 2.644 -1.547 385 HD12 ILE 42 HD12 ILE 42 -8.378 2.595 -2.800 386 HD13 ILE 42 HD13 ILE 42 -7.523 1.114 -2.327 387 H VAL 43 H VAL 43 -3.394 -1.214 -4.064 388 HA VAL 43 HA VAL 43 -0.605 -0.275 -3.476 389 HB VAL 43 HB VAL 43 -1.915 -2.671 -2.162 390 HG11 VAL 43 HG11 VAL 43 0.635 -1.033 -1.647 391 HG12 VAL 43 HG12 VAL 43 0.064 -2.337 -0.602 392 HG13 VAL 43 HG13 VAL 43 0.575 -2.703 -2.246 393 HG21 VAL 43 HG21 VAL 43 -1.736 0.230 -1.305 394 HG22 VAL 43 HG22 VAL 43 -3.152 -0.825 -1.361 395 HG23 VAL 43 HG23 VAL 43 -1.921 -1.084 -0.127 396 H ALA 44 H ALA 44 -2.332 -3.265 -4.620 397 HA ALA 44 HA ALA 44 0.068 -4.404 -5.768 398 HB1 ALA 44 HB1 ALA 44 -2.869 -4.834 -6.478 399 HB2 ALA 44 HB2 ALA 44 -1.506 -5.884 -6.917 400 HB3 ALA 44 HB3 ALA 44 -1.967 -5.709 -5.212 401 H ASP 45 H ASP 45 -2.446 -2.195 -6.921 402 HA ASP 45 HA ASP 45 -1.474 -1.727 -9.578 403 HB2 ASP 45 HB2 ASP 45 -3.648 -0.954 -8.670 404 HB3 ASP 45 HB3 ASP 45 -2.800 0.194 -7.630 405 H TYR 46 H TYR 46 -0.487 -0.171 -6.477 406 HA TYR 46 HA TYR 46 1.285 1.745 -7.667 407 HB2 TYR 46 HB2 TYR 46 0.102 1.601 -5.346 408 HB3 TYR 46 HB3 TYR 46 1.512 0.700 -4.825 409 HD1 TYR 46 HD1 TYR 46 0.647 3.033 -3.419 410 HD2 TYR 46 HD2 TYR 46 3.197 2.801 -6.868 411 HE1 TYR 46 HE1 TYR 46 1.629 5.255 -2.839 412 HE2 TYR 46 HE2 TYR 46 4.211 4.953 -6.312 413 HH TYR 46 HH TYR 46 3.119 6.904 -3.473 414 H ILE 47 H ILE 47 1.794 -1.508 -6.328 415 HA ILE 47 HA ILE 47 4.632 -1.694 -6.660 416 HB ILE 47 HB ILE 47 2.301 -3.539 -6.304 417 HG12 ILE 47 HG12 ILE 47 3.396 -4.261 -4.346 418 HG13 ILE 47 HG13 ILE 47 4.969 -3.692 -4.880 419 HG21 ILE 47 HG21 ILE 47 5.016 -4.593 -7.118 420 HG22 ILE 47 HG22 ILE 47 3.702 -5.555 -6.414 421 HG23 ILE 47 HG23 ILE 47 3.481 -4.802 -8.002 422 HD11 ILE 47 HD11 ILE 47 2.686 -1.885 -3.997 423 HD12 ILE 47 HD12 ILE 47 4.132 -2.321 -3.067 424 HD13 ILE 47 HD13 ILE 47 4.291 -1.362 -4.545 425 H SER 48 H SER 48 2.085 -1.743 -9.073 426 HA SER 48 HA SER 48 3.867 -2.665 -11.210 427 HB2 SER 48 HB2 SER 48 1.288 -2.935 -11.016 428 HB3 SER 48 HB3 SER 48 1.223 -1.272 -11.629 429 HG SER 48 HG SER 48 1.148 -2.856 -13.305 430 H GLU 49 H GLU 49 3.375 0.434 -9.644 431 HA GLU 49 HA GLU 49 4.153 1.985 -12.062 432 HB2 GLU 49 HB2 GLU 49 3.366 2.843 -9.251 433 HB3 GLU 49 HB3 GLU 49 3.748 3.938 -10.573 434 HG2 GLU 49 HG2 GLU 49 1.483 1.922 -10.628 435 HG3 GLU 49 HG3 GLU 49 1.312 3.582 -10.081 436 H VAL 50 H VAL 50 5.218 1.517 -8.689 437 HA VAL 50 HA VAL 50 7.881 2.676 -9.416 438 HB VAL 50 HB VAL 50 7.945 3.830 -7.349 439 HG11 VAL 50 HG11 VAL 50 5.149 4.249 -8.392 440 HG12 VAL 50 HG12 VAL 50 6.202 5.398 -7.543 441 HG13 VAL 50 HG13 VAL 50 6.626 4.859 -9.173 442 HG21 VAL 50 HG21 VAL 50 7.004 2.209 -5.818 443 HG22 VAL 50 HG22 VAL 50 6.150 3.750 -5.699 444 HG23 VAL 50 HG23 VAL 50 5.407 2.382 -6.564 445 H GLY 51 H GLY 51 6.466 -0.132 -8.006 446 HA2 GLY 51 HA2 GLY 51 7.985 -2.020 -8.484 447 HA3 GLY 51 HA3 GLY 51 9.241 -1.194 -7.567 448 H LEU 52 H LEU 52 8.677 -0.709 -5.288 449 HA LEU 52 HA LEU 52 6.652 -2.126 -3.838 450 HB2 LEU 52 HB2 LEU 52 8.011 -4.117 -4.337 451 HB3 LEU 52 HB3 LEU 52 9.469 -3.317 -3.764 452 HG LEU 52 HG LEU 52 8.647 -3.369 -1.456 453 HD11 LEU 52 HD11 LEU 52 6.175 -4.741 -2.588 454 HD12 LEU 52 HD12 LEU 52 6.575 -4.535 -0.856 455 HD13 LEU 52 HD13 LEU 52 6.211 -3.133 -1.841 456 HD21 LEU 52 HD21 LEU 52 9.846 -5.349 -2.335 457 HD22 LEU 52 HD22 LEU 52 8.649 -5.798 -1.108 458 HD23 LEU 52 HD23 LEU 52 8.305 -6.071 -2.830 459 H ASN 53 H ASN 53 9.884 -0.741 -3.695 460 HA ASN 53 HA ASN 53 9.420 0.237 -0.916 461 HB2 ASN 53 HB2 ASN 53 11.977 -0.394 -2.436 462 HB3 ASN 53 HB3 ASN 53 11.922 0.253 -0.801 463 HD21 ASN 53 HD21 ASN 53 11.627 -3.684 -1.183 464 HD22 ASN 53 HD22 ASN 53 12.172 -2.636 -2.484 465 H ASN 54 H ASN 54 9.397 1.588 -3.966 466 HA ASN 54 HA ASN 54 10.594 4.174 -3.140 467 HB2 ASN 54 HB2 ASN 54 9.441 3.292 -5.803 468 HB3 ASN 54 HB3 ASN 54 10.362 4.765 -5.501 469 HD21 ASN 54 HD21 ASN 54 12.325 1.366 -6.320 470 HD22 ASN 54 HD22 ASN 54 10.607 1.624 -6.634 471 H LEU 55 H LEU 55 7.455 2.740 -3.330 472 HA LEU 55 HA LEU 55 5.882 5.184 -3.226 473 HB2 LEU 55 HB2 LEU 55 4.083 3.687 -2.517 474 HB3 LEU 55 HB3 LEU 55 4.896 3.101 -3.946 475 HG LEU 55 HG LEU 55 6.276 1.731 -1.976 476 HD11 LEU 55 HD11 LEU 55 3.360 1.890 -1.101 477 HD12 LEU 55 HD12 LEU 55 4.602 0.789 -0.472 478 HD13 LEU 55 HD13 LEU 55 4.748 2.532 -0.194 479 HD21 LEU 55 HD21 LEU 55 5.342 0.769 -4.045 480 HD22 LEU 55 HD22 LEU 55 4.911 -0.185 -2.623 481 HD23 LEU 55 HD23 LEU 55 3.703 0.885 -3.369 482 H ASN 56 H ASN 56 4.582 5.758 -1.254 483 HA ASN 56 HA ASN 56 6.069 5.281 1.276 484 HB2 ASN 56 HB2 ASN 56 5.716 7.510 1.993 485 HB3 ASN 56 HB3 ASN 56 6.435 7.580 0.397 486 HD21 ASN 56 HD21 ASN 56 3.946 10.094 -0.026 487 HD22 ASN 56 HD22 ASN 56 5.634 9.825 0.403 488 H ALA 57 H ALA 57 4.685 5.750 3.181 489 HA ALA 57 HA ALA 57 2.339 4.009 3.075 490 HB1 ALA 57 HB1 ALA 57 3.778 5.536 5.282 491 HB2 ALA 57 HB2 ALA 57 2.490 4.341 5.546 492 HB3 ALA 57 HB3 ALA 57 4.029 3.833 4.823 493 H THR 58 H THR 58 2.951 7.465 3.168 494 HA THR 58 HA THR 58 0.519 8.426 4.237 495 HB THR 58 HB THR 58 2.329 9.772 2.200 496 HG1 THR 58 HG1 THR 58 3.405 10.545 4.043 497 HG21 THR 58 HG21 THR 58 0.465 10.886 4.339 498 HG22 THR 58 HG22 THR 58 1.638 11.849 3.407 499 HG23 THR 58 HG23 THR 58 0.302 11.048 2.575 500 H GLU 59 H GLU 59 1.435 7.909 0.787 501 HA GLU 59 HA GLU 59 -1.140 8.690 -0.268 502 HB2 GLU 59 HB2 GLU 59 1.067 6.895 -1.352 503 HB3 GLU 59 HB3 GLU 59 -0.371 7.320 -2.280 504 HG2 GLU 59 HG2 GLU 59 1.695 9.290 -1.204 505 HG3 GLU 59 HG3 GLU 59 1.554 8.740 -2.867 506 H LEU 60 H LEU 60 0.097 5.529 0.813 507 HA LEU 60 HA LEU 60 -2.237 3.994 0.170 508 HB2 LEU 60 HB2 LEU 60 0.225 3.663 1.785 509 HB3 LEU 60 HB3 LEU 60 -1.178 2.918 2.535 510 HG LEU 60 HG LEU 60 -1.661 1.692 0.431 511 HD11 LEU 60 HD11 LEU 60 1.048 2.823 -0.417 512 HD12 LEU 60 HD12 LEU 60 0.212 1.490 -1.236 513 HD13 LEU 60 HD13 LEU 60 -0.515 3.101 -1.217 514 HD21 LEU 60 HD21 LEU 60 -0.437 0.643 2.284 515 HD22 LEU 60 HD22 LEU 60 0.179 0.059 0.729 516 HD23 LEU 60 HD23 LEU 60 1.097 1.272 1.642 517 H SER 61 H SER 61 -1.412 5.694 3.262 518 HA SER 61 HA SER 61 -3.825 4.954 4.571 519 HB2 SER 61 HB2 SER 61 -3.211 6.706 6.209 520 HB3 SER 61 HB3 SER 61 -1.876 5.599 5.826 521 HG SER 61 HG SER 61 -1.113 7.696 5.781 522 H LYS 62 H LYS 62 -3.079 7.656 2.491 523 HA LYS 62 HA LYS 62 -5.497 9.215 2.966 524 HB2 LYS 62 HB2 LYS 62 -3.422 9.151 0.743 525 HB3 LYS 62 HB3 LYS 62 -4.825 10.217 0.676 526 HG2 LYS 62 HG2 LYS 62 -4.161 11.455 2.593 527 HG3 LYS 62 HG3 LYS 62 -2.970 10.253 3.077 528 HD2 LYS 62 HD2 LYS 62 -1.823 12.158 2.133 529 HD3 LYS 62 HD3 LYS 62 -1.600 10.764 1.065 530 HE2 LYS 62 HE2 LYS 62 -3.427 11.639 -0.408 531 HE3 LYS 62 HE3 LYS 62 -3.592 13.046 0.655 532 HZ1 LYS 62 HZ1 LYS 62 -1.135 12.299 -0.859 533 HZ2 LYS 62 HZ2 LYS 62 -2.153 13.519 -1.254 534 HZ3 LYS 62 HZ3 LYS 62 -1.270 13.611 0.119 535 H ARG 63 H ARG 63 -4.639 6.765 0.543 536 HA ARG 63 HA ARG 63 -7.229 7.112 -0.852 537 HB2 ARG 63 HB2 ARG 63 -4.724 5.516 -1.493 538 HB3 ARG 63 HB3 ARG 63 -6.134 5.646 -2.556 539 HG2 ARG 63 HG2 ARG 63 -5.819 8.056 -2.788 540 HG3 ARG 63 HG3 ARG 63 -4.519 8.055 -1.592 541 HD2 ARG 63 HD2 ARG 63 -3.201 6.517 -3.072 542 HD3 ARG 63 HD3 ARG 63 -4.432 6.717 -4.324 543 HE ARG 63 HE ARG 63 -2.387 8.665 -3.448 544 HH11 ARG 63 HH11 ARG 63 -2.081 10.454 -4.387 545 HH12 ARG 63 HH12 ARG 63 -3.207 11.131 -5.572 546 HH21 ARG 63 HH21 ARG 63 -5.394 8.455 -5.272 547 HH22 ARG 63 HH22 ARG 63 -5.083 9.984 -6.049 548 H LEU 64 H LEU 64 -5.629 4.575 1.020 549 HA LEU 64 HA LEU 64 -7.844 2.662 0.613 550 HB2 LEU 64 HB2 LEU 64 -5.248 2.340 0.637 551 HB3 LEU 64 HB3 LEU 64 -5.423 2.272 2.382 552 HG LEU 64 HG LEU 64 -6.893 0.417 0.475 553 HD11 LEU 64 HD11 LEU 64 -4.153 0.084 1.769 554 HD12 LEU 64 HD12 LEU 64 -5.013 -1.174 0.862 555 HD13 LEU 64 HD13 LEU 64 -4.492 0.298 0.040 556 HD21 LEU 64 HD21 LEU 64 -7.769 0.235 2.755 557 HD22 LEU 64 HD22 LEU 64 -6.754 -1.167 2.444 558 HD23 LEU 64 HD23 LEU 64 -6.121 0.166 3.414 559 H ASN 65 H ASN 65 -6.936 5.077 2.907 560 HA ASN 65 HA ASN 65 -7.756 5.819 4.836 561 HB2 ASN 65 HB2 ASN 65 -9.863 5.921 3.619 562 HB3 ASN 65 HB3 ASN 65 -10.269 4.275 4.120 563 HD21 ASN 65 HD21 ASN 65 -10.339 7.219 7.008 564 HD22 ASN 65 HD22 ASN 65 -9.191 7.368 5.686 565 H ILE 66 H ILE 66 -6.018 4.664 5.636 566 HA ILE 66 HA ILE 66 -6.646 2.834 7.879 567 HB ILE 66 HB ILE 66 -4.448 1.638 7.383 568 HG12 ILE 66 HG12 ILE 66 -4.807 2.897 4.628 569 HG13 ILE 66 HG13 ILE 66 -3.495 3.198 5.779 570 HG21 ILE 66 HG21 ILE 66 -6.714 1.191 5.413 571 HG22 ILE 66 HG22 ILE 66 -5.493 -0.005 5.930 572 HG23 ILE 66 HG23 ILE 66 -6.661 0.621 7.094 573 HD11 ILE 66 HD11 ILE 66 -4.011 0.602 4.292 574 HD12 ILE 66 HD12 ILE 66 -2.767 1.807 3.958 575 HD13 ILE 66 HD13 ILE 66 -2.717 0.879 5.482 576 H THR 67 H THR 67 -4.856 2.911 9.539 577 HA THR 67 HA THR 67 -3.664 5.581 9.762 578 HB THR 67 HB THR 67 -4.371 4.393 11.774 579 HG1 THR 67 HG1 THR 67 -2.559 4.977 12.917 580 HG21 THR 67 HG21 THR 67 -1.954 2.582 11.339 581 HG22 THR 67 HG22 THR 67 -3.033 2.608 12.745 582 HG23 THR 67 HG23 THR 67 -3.651 2.070 11.179 583 H VAL 68 H VAL 68 -1.399 6.029 9.814 584 HA VAL 68 HA VAL 68 -0.061 5.124 7.476 585 HB VAL 68 HB VAL 68 1.306 6.452 9.846 586 HG11 VAL 68 HG11 VAL 68 1.804 6.609 6.836 587 HG12 VAL 68 HG12 VAL 68 2.713 7.480 8.090 588 HG13 VAL 68 HG13 VAL 68 2.805 5.720 8.003 589 HG21 VAL 68 HG21 VAL 68 -0.682 7.808 9.377 590 HG22 VAL 68 HG22 VAL 68 0.751 8.629 8.767 591 HG23 VAL 68 HG23 VAL 68 -0.321 7.779 7.637 592 H ASP 69 H ASP 69 0.298 4.080 10.850 593 HA ASP 69 HA ASP 69 2.564 2.408 10.373 594 HB2 ASP 69 HB2 ASP 69 1.851 3.315 12.593 595 HB3 ASP 69 HB3 ASP 69 0.465 2.222 12.570 596 H LYS 70 H LYS 70 -0.886 1.737 9.963 597 HA LYS 70 HA LYS 70 -0.471 -1.141 9.544 598 HB2 LYS 70 HB2 LYS 70 -2.800 0.746 9.006 599 HB3 LYS 70 HB3 LYS 70 -2.775 -0.914 8.399 600 HG2 LYS 70 HG2 LYS 70 -2.447 -1.774 10.704 601 HG3 LYS 70 HG3 LYS 70 -2.558 -0.122 11.334 602 HD2 LYS 70 HD2 LYS 70 -4.865 0.065 10.401 603 HD3 LYS 70 HD3 LYS 70 -4.730 -1.583 9.752 604 HE2 LYS 70 HE2 LYS 70 -4.382 -2.451 12.061 605 HE3 LYS 70 HE3 LYS 70 -4.557 -0.813 12.703 606 HZ1 LYS 70 HZ1 LYS 70 -6.668 -2.298 11.223 607 HZ2 LYS 70 HZ2 LYS 70 -6.644 -2.052 12.834 608 HZ3 LYS 70 HZ3 LYS 70 -6.835 -0.786 11.825 609 H ALA 71 H ALA 71 -0.369 1.761 7.542 610 HA ALA 71 HA ALA 71 -0.194 0.293 5.002 611 HB1 ALA 71 HB1 ALA 71 0.610 3.143 5.770 612 HB2 ALA 71 HB2 ALA 71 0.552 2.498 4.125 613 HB3 ALA 71 HB3 ALA 71 -0.936 2.664 5.084 614 H LYS 72 H LYS 72 2.195 1.822 7.161 615 HA LYS 72 HA LYS 72 4.597 1.142 5.818 616 HB2 LYS 72 HB2 LYS 72 3.898 1.535 8.751 617 HB3 LYS 72 HB3 LYS 72 5.552 1.193 8.226 618 HG2 LYS 72 HG2 LYS 72 5.685 3.218 6.964 619 HG3 LYS 72 HG3 LYS 72 3.959 3.524 7.156 620 HD2 LYS 72 HD2 LYS 72 5.372 4.972 8.579 621 HD3 LYS 72 HD3 LYS 72 4.159 4.043 9.468 622 HE2 LYS 72 HE2 LYS 72 5.817 2.453 10.233 623 HE3 LYS 72 HE3 LYS 72 7.066 3.178 9.203 624 HZ1 LYS 72 HZ1 LYS 72 5.737 4.538 11.491 625 HZ2 LYS 72 HZ2 LYS 72 7.254 3.942 11.500 626 HZ3 LYS 72 HZ3 LYS 72 6.890 5.209 10.542 627 H THR 73 H THR 73 2.804 -0.857 8.220 628 HA THR 73 HA THR 73 4.807 -2.994 7.865 629 HB THR 73 HB THR 73 3.723 -2.355 10.071 630 HG1 THR 73 HG1 THR 73 4.018 -4.451 10.736 631 HG21 THR 73 HG21 THR 73 1.612 -4.362 9.172 632 HG22 THR 73 HG22 THR 73 1.752 -3.557 10.747 633 HG23 THR 73 HG23 THR 73 1.319 -2.612 9.313 634 H TYR 74 H TYR 74 1.463 -2.449 6.695 635 HA TYR 74 HA TYR 74 1.044 -5.085 5.703 636 HB2 TYR 74 HB2 TYR 74 -0.799 -3.587 5.896 637 HB3 TYR 74 HB3 TYR 74 -0.003 -2.373 4.884 638 HD1 TYR 74 HD1 TYR 74 -0.618 -2.156 2.693 639 HD2 TYR 74 HD2 TYR 74 -1.125 -5.977 4.643 640 HE1 TYR 74 HE1 TYR 74 -1.545 -3.103 0.613 641 HE2 TYR 74 HE2 TYR 74 -1.979 -6.943 2.506 642 HH TYR 74 HH TYR 74 -2.139 -5.001 -0.510 643 H ILE 75 H ILE 75 2.678 -2.288 4.180 644 HA ILE 75 HA ILE 75 3.165 -3.252 1.603 645 HB ILE 75 HB ILE 75 4.799 -1.562 3.515 646 HG12 ILE 75 HG12 ILE 75 3.435 -0.743 0.917 647 HG13 ILE 75 HG13 ILE 75 2.565 -0.787 2.432 648 HG21 ILE 75 HG21 ILE 75 5.475 -2.123 0.591 649 HG22 ILE 75 HG22 ILE 75 6.228 -0.865 1.591 650 HG23 ILE 75 HG23 ILE 75 6.473 -2.546 2.006 651 HD11 ILE 75 HD11 ILE 75 5.016 0.949 1.875 652 HD12 ILE 75 HD12 ILE 75 3.344 1.488 2.025 653 HD13 ILE 75 HD13 ILE 75 4.186 0.829 3.438 654 H LYS 76 H LYS 76 5.064 -4.072 4.544 655 HA LYS 76 HA LYS 76 6.664 -6.032 2.983 656 HB2 LYS 76 HB2 LYS 76 7.948 -6.288 5.114 657 HB3 LYS 76 HB3 LYS 76 7.942 -4.645 4.476 658 HG2 LYS 76 HG2 LYS 76 6.357 -3.889 6.111 659 HG3 LYS 76 HG3 LYS 76 6.016 -5.533 6.664 660 HD2 LYS 76 HD2 LYS 76 8.802 -4.361 6.903 661 HD3 LYS 76 HD3 LYS 76 7.539 -4.013 8.100 662 HE2 LYS 76 HE2 LYS 76 7.180 -6.399 8.513 663 HE3 LYS 76 HE3 LYS 76 8.397 -6.827 7.298 664 HZ1 LYS 76 HZ1 LYS 76 8.945 -5.308 9.796 665 HZ2 LYS 76 HZ2 LYS 76 9.333 -6.871 9.541 666 HZ3 LYS 76 HZ3 LYS 76 10.069 -5.700 8.677 667 H ASN 77 H ASN 77 3.956 -6.201 5.225 668 HA ASN 77 HA ASN 77 4.284 -9.087 5.608 669 HB2 ASN 77 HB2 ASN 77 2.081 -7.099 6.226 670 HB3 ASN 77 HB3 ASN 77 1.791 -8.831 6.329 671 HD21 ASN 77 HD21 ASN 77 4.140 -7.082 9.169 672 HD22 ASN 77 HD22 ASN 77 3.743 -6.188 7.715 673 H SER 78 H SER 78 2.715 -7.114 3.145 674 HA SER 78 HA SER 78 1.335 -9.367 1.920 675 HB2 SER 78 HB2 SER 78 0.542 -7.017 1.916 676 HB3 SER 78 HB3 SER 78 1.856 -6.588 0.813 677 HG SER 78 HG SER 78 -0.253 -7.140 -0.158 678 H ASN 79 H ASN 79 4.335 -7.613 1.192 679 HA ASN 79 HA ASN 79 4.805 -9.373 -1.174 680 HB2 ASN 79 HB2 ASN 79 6.108 -6.729 -0.521 681 HB3 ASN 79 HB3 ASN 79 6.201 -7.613 -2.041 682 HD21 ASN 79 HD21 ASN 79 3.012 -5.231 -1.242 683 HD22 ASN 79 HD22 ASN 79 4.290 -5.525 -0.049 684 H ARG 80 H ARG 80 6.315 -8.385 1.807 685 HA ARG 80 HA ARG 80 8.204 -8.784 2.822 686 HB2 ARG 80 HB2 ARG 80 6.678 -10.873 2.988 687 HB3 ARG 80 HB3 ARG 80 7.825 -11.671 1.923 688 HG2 ARG 80 HG2 ARG 80 8.313 -12.271 4.192 689 HG3 ARG 80 HG3 ARG 80 9.632 -11.229 3.638 690 HD2 ARG 80 HD2 ARG 80 8.676 -9.322 4.858 691 HD3 ARG 80 HD3 ARG 80 7.245 -10.264 5.266 692 HE ARG 80 HE ARG 80 10.028 -10.858 6.246 693 HH11 ARG 80 HH11 ARG 80 10.256 -11.600 8.317 694 HH12 ARG 80 HH12 ARG 80 8.854 -11.828 9.319 695 HH21 ARG 80 HH21 ARG 80 6.588 -10.844 6.949 696 HH22 ARG 80 HH22 ARG 80 6.836 -11.409 8.578 697 H MET 81 H MET 81 9.025 -7.577 0.878 698 HA MET 81 HA MET 81 10.731 -6.909 -0.429 699 HB2 MET 81 HB2 MET 81 12.337 -9.212 0.716 700 HB3 MET 81 HB3 MET 81 12.972 -7.828 -0.162 701 HG2 MET 81 HG2 MET 81 11.501 -7.713 2.499 702 HG3 MET 81 HG3 MET 81 13.238 -7.612 2.288 703 HE1 MET 81 HE1 MET 81 13.948 -5.664 0.058 704 HE2 MET 81 HE2 MET 81 13.905 -4.098 0.896 705 HE3 MET 81 HE3 MET 81 14.568 -5.526 1.719 706 H GLY 82 H GLY 82 10.030 -10.341 -0.812 707 HA2 GLY 82 HA2 GLY 82 8.882 -10.537 -3.105 708 HA3 GLY 82 HA3 GLY 82 10.474 -10.151 -3.771 709 H ARG 83 H ARG 83 11.976 -11.613 -1.841 710 HA ARG 83 HA ARG 83 11.212 -14.493 -2.240 711 HB2 ARG 83 HB2 ARG 83 13.934 -13.220 -2.745 712 HB3 ARG 83 HB3 ARG 83 13.722 -14.941 -2.483 713 HG2 ARG 83 HG2 ARG 83 13.759 -14.929 -4.714 714 HG3 ARG 83 HG3 ARG 83 12.020 -14.874 -4.442 715 HD2 ARG 83 HD2 ARG 83 11.998 -12.465 -4.933 716 HD3 ARG 83 HD3 ARG 83 13.756 -12.420 -5.009 717 HE ARG 83 HE ARG 83 11.878 -13.466 -7.032 718 HH11 ARG 83 HH11 ARG 83 12.633 -13.981 -9.049 719 HH12 ARG 83 HH12 ARG 83 14.344 -14.071 -9.347 720 HH21 ARG 83 HH21 ARG 83 15.268 -13.278 -6.143 721 HH22 ARG 83 HH22 ARG 83 15.801 -13.696 -7.747 722 H THR 84 H THR 84 11.033 -12.567 0.131 723 HA THR 84 HA THR 84 11.470 -12.477 2.352 724 HB THR 84 HB THR 84 11.491 -15.504 2.241 725 HG1 THR 84 HG1 THR 84 9.266 -15.349 2.177 726 HG21 THR 84 HG21 THR 84 10.420 -13.489 4.278 727 HG22 THR 84 HG22 THR 84 10.047 -15.225 4.303 728 HG23 THR 84 HG23 THR 84 11.703 -14.682 4.543 729 H ASN 85 H ASN 85 13.785 -12.146 0.840 730 HA ASN 85 HA ASN 85 16.058 -12.202 0.825 731 HB2 ASN 85 HB2 ASN 85 15.560 -12.191 3.820 732 HB3 ASN 85 HB3 ASN 85 17.112 -11.820 3.070 733 HD21 ASN 85 HD21 ASN 85 16.133 -8.597 1.937 734 HD22 ASN 85 HD22 ASN 85 17.292 -9.896 1.710 735 H ASN 86 H ASN 86 14.877 -14.882 0.559 736 HA ASN 86 HA ASN 86 16.999 -16.572 1.716 737 HB2 ASN 86 HB2 ASN 86 15.524 -18.193 1.929 738 HB3 ASN 86 HB3 ASN 86 14.311 -16.942 1.701 739 HD21 ASN 86 HD21 ASN 86 13.511 -18.068 -1.637 740 HD22 ASN 86 HD22 ASN 86 13.610 -16.610 -0.645 741 H PHE 87 H PHE 87 16.830 -14.896 -1.067 742 HA PHE 87 HA PHE 87 17.471 -16.793 -3.092 743 HB2 PHE 87 HB2 PHE 87 17.856 -14.839 -4.487 744 HB3 PHE 87 HB3 PHE 87 16.380 -14.709 -3.559 745 HD1 PHE 87 HD1 PHE 87 16.041 -12.933 -1.935 746 HD2 PHE 87 HD2 PHE 87 19.889 -13.447 -3.817 747 HE1 PHE 87 HE1 PHE 87 16.784 -10.749 -1.022 748 HE2 PHE 87 HE2 PHE 87 20.637 -11.287 -2.869 749 HZ PHE 87 HZ PHE 87 19.087 -9.928 -1.474 750 H LYS 88 H LYS 88 19.339 -16.684 -0.680 751 HA LYS 88 HA LYS 88 22.008 -16.079 -1.822 752 HB2 LYS 88 HB2 LYS 88 22.736 -16.224 0.512 753 HB3 LYS 88 HB3 LYS 88 21.379 -15.120 0.314 754 HG2 LYS 88 HG2 LYS 88 20.033 -17.451 0.952 755 HG3 LYS 88 HG3 LYS 88 21.547 -17.716 1.808 756 HD2 LYS 88 HD2 LYS 88 21.253 -15.644 3.069 757 HD3 LYS 88 HD3 LYS 88 19.885 -15.169 2.042 758 HE2 LYS 88 HE2 LYS 88 18.655 -17.237 2.807 759 HE3 LYS 88 HE3 LYS 88 19.965 -17.534 3.962 760 HZ1 LYS 88 HZ1 LYS 88 18.259 -15.097 3.862 761 HZ2 LYS 88 HZ2 LYS 88 18.133 -16.288 4.983 762 HZ3 LYS 88 HZ3 LYS 88 19.464 -15.343 4.948 763 H THR 89 H THR 89 20.011 -18.722 -1.581 764 HA THR 89 HA THR 89 22.238 -20.716 -1.750 765 HB THR 89 HB THR 89 19.615 -20.940 -0.212 766 HG1 THR 89 HG1 THR 89 20.988 -20.952 1.592 767 HG21 THR 89 HG21 THR 89 21.987 -22.819 -0.467 768 HG22 THR 89 HG22 THR 89 20.641 -23.011 0.692 769 HG23 THR 89 HG23 THR 89 20.327 -23.104 -1.048 770 H ILE 90 H ILE 90 18.778 -20.011 -2.485 771 HA ILE 90 HA ILE 90 18.543 -22.104 -4.495 772 HB ILE 90 HB ILE 90 16.475 -20.965 -5.082 773 HG12 ILE 90 HG12 ILE 90 16.982 -19.045 -2.786 774 HG13 ILE 90 HG13 ILE 90 17.290 -18.621 -4.473 775 HG21 ILE 90 HG21 ILE 90 16.757 -21.420 -2.083 776 HG22 ILE 90 HG22 ILE 90 15.282 -21.580 -3.054 777 HG23 ILE 90 HG23 ILE 90 16.621 -22.705 -3.301 778 HD11 ILE 90 HD11 ILE 90 14.600 -19.404 -3.297 779 HD12 ILE 90 HD12 ILE 90 15.111 -17.791 -3.833 780 HD13 ILE 90 HD13 ILE 90 14.916 -19.100 -5.021 781 H LYS 91 H LYS 91 17.951 -21.496 -6.765 782 HA LYS 91 HA LYS 91 18.471 -20.775 -8.822 783 HB2 LYS 91 HB2 LYS 91 19.514 -18.193 -7.622 784 HB3 LYS 91 HB3 LYS 91 19.000 -18.465 -9.276 785 HG2 LYS 91 HG2 LYS 91 17.178 -18.530 -6.827 786 HG3 LYS 91 HG3 LYS 91 17.355 -17.189 -7.951 787 HD2 LYS 91 HD2 LYS 91 16.466 -18.529 -9.785 788 HD3 LYS 91 HD3 LYS 91 16.353 -19.960 -8.730 789 HE2 LYS 91 HE2 LYS 91 14.752 -18.814 -7.278 790 HE3 LYS 91 HE3 LYS 91 14.882 -17.338 -8.247 791 HZ1 LYS 91 HZ1 LYS 91 13.849 -19.944 -9.249 792 HZ2 LYS 91 HZ2 LYS 91 12.928 -18.650 -8.876 793 HZ3 LYS 91 HZ3 LYS 91 13.961 -18.577 -10.136 794 H MET 92 H MET 92 21.154 -20.519 -6.571 795 HA MET 92 HA MET 92 23.108 -20.916 -8.759 796 HB2 MET 92 HB2 MET 92 24.808 -20.572 -7.094 797 HB3 MET 92 HB3 MET 92 23.598 -19.293 -7.042 798 HG2 MET 92 HG2 MET 92 22.531 -20.483 -5.075 799 HG3 MET 92 HG3 MET 92 23.874 -21.629 -5.110 800 HE1 MET 92 HE1 MET 92 22.571 -18.116 -4.258 801 HE2 MET 92 HE2 MET 92 24.023 -17.200 -3.794 802 HE3 MET 92 HE3 MET 92 23.738 -17.602 -5.499 803 H PHE 93 H PHE 93 21.784 -22.847 -6.053 804 HA PHE 93 HA PHE 93 23.363 -25.210 -6.895 805 HB2 PHE 93 HB2 PHE 93 21.460 -24.610 -4.614 806 HB3 PHE 93 HB3 PHE 93 21.902 -26.259 -5.017 807 HD1 PHE 93 HD1 PHE 93 22.893 -23.446 -3.084 808 HD2 PHE 93 HD2 PHE 93 24.412 -26.816 -5.283 809 HE1 PHE 93 HE1 PHE 93 25.025 -23.303 -1.811 810 HE2 PHE 93 HE2 PHE 93 26.557 -26.680 -4.011 811 HZ PHE 93 HZ PHE 93 26.862 -24.920 -2.277 812 H GLU 94 H GLU 94 20.153 -23.909 -7.440 813 HA GLU 94 HA GLU 94 19.436 -26.240 -9.096 814 HB2 GLU 94 HB2 GLU 94 17.394 -26.703 -7.910 815 HB3 GLU 94 HB3 GLU 94 18.783 -26.862 -6.827 816 HG2 GLU 94 HG2 GLU 94 18.253 -24.593 -5.875 817 HG3 GLU 94 HG3 GLU 94 16.800 -24.549 -6.876 818 H ASP 95 H ASP 95 18.283 -25.710 -10.845 819 HA ASP 95 HA ASP 95 16.576 -23.358 -11.028 820 HB2 ASP 95 HB2 ASP 95 18.832 -22.338 -11.237 821 HB3 ASP 95 HB3 ASP 95 19.206 -23.423 -12.572 822 H ASP 96 H ASP 96 15.389 -25.509 -11.348 823 HA ASP 96 HA ASP 96 15.293 -26.254 -14.249 824 HB2 ASP 96 HB2 ASP 96 15.169 -28.107 -11.841 825 HB3 ASP 96 HB3 ASP 96 14.720 -28.569 -13.479 826 H VAL 97 H VAL 97 13.328 -26.459 -15.148 827 HA VAL 97 HA VAL 97 10.876 -26.144 -13.452 828 HB VAL 97 HB VAL 97 11.450 -24.586 -16.002 829 HG11 VAL 97 HG11 VAL 97 9.104 -24.448 -14.054 830 HG12 VAL 97 HG12 VAL 97 9.388 -23.333 -15.409 831 HG13 VAL 97 HG13 VAL 97 9.042 -25.030 -15.735 832 HG21 VAL 97 HG21 VAL 97 12.787 -23.650 -14.173 833 HG22 VAL 97 HG22 VAL 97 11.438 -22.576 -14.533 834 HG23 VAL 97 HG23 VAL 97 11.365 -23.636 -13.106 835 H SER 98 H SER 98 12.003 -26.945 -16.768 836 HA SER 98 HA SER 98 9.828 -28.989 -16.940 837 HB2 SER 98 HB2 SER 98 9.529 -26.745 -18.223 838 HB3 SER 98 HB3 SER 98 10.743 -27.393 -19.335 839 HG SER 98 HG SER 98 8.580 -27.904 -19.962 840 H SER 99 H SER 99 12.621 -29.216 -16.161 841 HA SER 99 HA SER 99 14.570 -30.261 -16.446 842 HB2 SER 99 HB2 SER 99 14.599 -32.499 -16.978 843 HB3 SER 99 HB3 SER 99 12.959 -32.199 -16.397 844 HG SER 99 HG SER 99 12.971 -33.489 -18.282 845 H ALA 100 H ALA 100 16.177 -31.396 -18.100 846 HA ALA 100 HA ALA 100 16.154 -30.116 -20.750 847 HB1 ALA 100 HB1 ALA 100 18.333 -29.537 -18.693 848 HB2 ALA 100 HB2 ALA 100 18.373 -29.074 -20.410 849 HB3 ALA 100 HB3 ALA 100 17.151 -28.374 -19.331 850 H SER 101 H SER 101 16.533 -31.745 -22.064 851 HA SER 101 HA SER 101 18.912 -33.497 -21.698 852 HB2 SER 101 HB2 SER 101 16.116 -34.495 -22.383 853 HB3 SER 101 HB3 SER 101 17.605 -35.448 -22.512 854 HG SER 101 HG SER 101 16.500 -35.820 -20.532 855 H ALA 102 H ALA 102 20.121 -33.310 -23.455 856 HA ALA 102 HA ALA 102 20.900 -32.773 -25.474 857 HB1 ALA 102 HB1 ALA 102 18.347 -34.029 -26.520 858 HB2 ALA 102 HB2 ALA 102 19.883 -33.845 -27.393 859 HB3 ALA 102 HB3 ALA 102 19.794 -34.915 -25.982 860 H GLN 103 H GLN 103 18.992 -30.747 -24.189 861 HA GLN 103 HA GLN 103 18.147 -29.135 -26.500 862 HB2 GLN 103 HB2 GLN 103 17.935 -28.672 -23.499 863 HB3 GLN 103 HB3 GLN 103 17.354 -27.536 -24.711 864 HG2 GLN 103 HG2 GLN 103 16.349 -30.382 -24.308 865 HG3 GLN 103 HG3 GLN 103 15.521 -28.913 -23.828 866 HE21 GLN 103 HE21 GLN 103 14.600 -30.287 -27.391 867 HE22 GLN 103 HE22 GLN 103 15.169 -31.243 -26.027 868 HA PRO 104 HA PRO 104 21.828 -26.548 -26.449 869 HB2 PRO 104 HB2 PRO 104 20.904 -24.244 -27.596 870 HB3 PRO 104 HB3 PRO 104 21.170 -25.758 -28.512 871 HG2 PRO 104 HG2 PRO 104 18.563 -24.701 -27.379 872 HG3 PRO 104 HG3 PRO 104 18.878 -25.354 -29.017 873 HD2 PRO 104 HD2 PRO 104 17.805 -26.867 -27.010 874 HD3 PRO 104 HD3 PRO 104 18.913 -27.570 -28.229 875 H ASN 105 H ASN 105 22.592 -25.776 -24.637 876 HA ASN 105 HA ASN 105 21.107 -23.745 -23.021 877 HB2 ASN 105 HB2 ASN 105 20.811 -26.059 -22.106 878 HB3 ASN 105 HB3 ASN 105 22.561 -26.190 -21.918 879 HD21 ASN 105 HD21 ASN 105 20.414 -23.734 -19.395 880 HD22 ASN 105 HD22 ASN 105 19.728 -24.183 -20.948 881 H LEU 106 H LEU 106 22.371 -22.208 -24.092 882 HA LEU 106 HA LEU 106 25.019 -21.727 -22.952 883 HB2 LEU 106 HB2 LEU 106 26.164 -21.496 -25.027 884 HB3 LEU 106 HB3 LEU 106 25.499 -23.109 -24.945 885 HG LEU 106 HG LEU 106 24.279 -20.827 -26.579 886 HD11 LEU 106 HD11 LEU 106 26.078 -23.124 -27.448 887 HD12 LEU 106 HD12 LEU 106 25.305 -21.932 -28.519 888 HD13 LEU 106 HD13 LEU 106 26.535 -21.407 -27.364 889 HD21 LEU 106 HD21 LEU 106 22.592 -22.549 -26.194 890 HD22 LEU 106 HD22 LEU 106 23.185 -22.708 -27.841 891 HD23 LEU 106 HD23 LEU 106 23.759 -23.837 -26.595 892 HA PRO 107 HA PRO 107 23.538 -17.532 -23.160 893 HB2 PRO 107 HB2 PRO 107 25.843 -16.056 -23.108 894 HB3 PRO 107 HB3 PRO 107 25.233 -16.985 -21.705 895 HG2 PRO 107 HG2 PRO 107 27.332 -17.833 -23.729 896 HG3 PRO 107 HG3 PRO 107 27.423 -17.912 -21.940 897 HD2 PRO 107 HD2 PRO 107 26.725 -20.072 -23.425 898 HD3 PRO 107 HD3 PRO 107 25.942 -19.748 -21.852 Start of MODEL 3 1 H1 GLY -5 H1 GLY -5 -16.412 9.831 15.148 2 H2 GLY -5 H2 GLY -5 -17.469 9.035 14.181 3 H3 GLY -5 H3 GLY -5 -18.014 10.148 15.256 4 HA2 GLY -5 HA2 GLY -5 -16.313 10.726 12.919 5 HA3 GLY -5 HA3 GLY -5 -18.052 11.055 13.023 6 H SER -4 H SER -4 -16.166 13.066 12.454 7 HA SER -4 HA SER -4 -15.550 14.629 14.827 8 HB2 SER -4 HB2 SER -4 -14.977 16.399 13.152 9 HB3 SER -4 HB3 SER -4 -14.100 14.871 12.962 10 HG SER -4 HG SER -4 -14.883 15.683 10.955 11 H HIS -3 H HIS -3 -16.442 16.579 15.485 12 HA HIS -3 HA HIS -3 -18.894 17.629 14.245 13 HB2 HIS -3 HB2 HIS -3 -19.559 15.825 15.953 14 HB3 HIS -3 HB3 HIS -3 -18.922 16.892 17.199 15 HD2 HIS -3 HD2 HIS -3 -20.269 19.329 17.482 16 HE1 HIS -3 HE1 HIS -3 -23.803 18.057 15.455 17 HE2 HIS -3 HE2 HIS -3 -22.803 19.853 16.950 18 H MET -2 H MET -2 -18.928 19.814 14.383 19 HA MET -2 HA MET -2 -17.081 21.214 16.289 20 HB2 MET -2 HB2 MET -2 -17.477 21.730 13.320 21 HB3 MET -2 HB3 MET -2 -16.642 22.832 14.422 22 HG2 MET -2 HG2 MET -2 -15.823 19.950 13.896 23 HG3 MET -2 HG3 MET -2 -15.100 21.363 13.137 24 HE1 MET -2 HE1 MET -2 -12.852 19.957 14.001 25 HE2 MET -2 HE2 MET -2 -12.463 19.754 15.724 26 HE3 MET -2 HE3 MET -2 -13.815 18.850 15.010 27 H ALA -1 H ALA -1 -18.581 21.786 17.721 28 HA ALA -1 HA ALA -1 -20.291 24.084 17.027 29 HB1 ALA -1 HB1 ALA -1 -21.469 21.577 18.312 30 HB2 ALA -1 HB2 ALA -1 -22.299 23.134 18.093 31 HB3 ALA -1 HB3 ALA -1 -21.815 22.186 16.677 32 H SER 0 H SER 0 -19.556 21.811 19.716 33 HA SER 0 HA SER 0 -19.054 22.082 21.878 34 HB2 SER 0 HB2 SER 0 -17.043 23.010 20.505 35 HB3 SER 0 HB3 SER 0 -17.492 24.570 21.215 36 HG SER 0 HG SER 0 -15.946 23.398 22.481 37 H MET 1 H MET 1 -21.470 23.442 21.065 38 HA MET 1 HA MET 1 -21.983 24.979 23.542 39 HB2 MET 1 HB2 MET 1 -22.501 26.068 20.737 40 HB3 MET 1 HB3 MET 1 -23.302 26.697 22.180 41 HG2 MET 1 HG2 MET 1 -21.089 27.241 23.165 42 HG3 MET 1 HG3 MET 1 -20.316 26.747 21.650 43 HE1 MET 1 HE1 MET 1 -19.144 29.209 21.869 44 HE2 MET 1 HE2 MET 1 -20.068 30.727 21.853 45 HE3 MET 1 HE3 MET 1 -20.166 29.645 23.259 46 H ASP 2 H ASP 2 -23.265 23.397 20.780 47 HA ASP 2 HA ASP 2 -25.898 22.903 22.108 48 HB2 ASP 2 HB2 ASP 2 -24.905 22.280 19.302 49 HB3 ASP 2 HB3 ASP 2 -26.515 21.899 19.907 50 H GLN 3 H GLN 3 -22.925 21.546 22.261 51 HA GLN 3 HA GLN 3 -23.825 18.770 22.724 52 HB2 GLN 3 HB2 GLN 3 -23.335 19.280 20.245 53 HB3 GLN 3 HB3 GLN 3 -21.647 19.413 20.683 54 HG2 GLN 3 HG2 GLN 3 -23.407 16.954 21.190 55 HG3 GLN 3 HG3 GLN 3 -22.473 17.202 19.719 56 HE21 GLN 3 HE21 GLN 3 -19.276 16.736 21.448 57 HE22 GLN 3 HE22 GLN 3 -19.996 17.862 20.310 58 H LEU 4 H LEU 4 -23.212 20.124 24.821 59 HA LEU 4 HA LEU 4 -20.793 18.741 25.697 60 HB2 LEU 4 HB2 LEU 4 -19.801 20.493 26.903 61 HB3 LEU 4 HB3 LEU 4 -19.945 21.024 25.241 62 HG LEU 4 HG LEU 4 -21.821 21.905 27.498 63 HD11 LEU 4 HD11 LEU 4 -19.403 23.316 26.313 64 HD12 LEU 4 HD12 LEU 4 -20.531 23.990 27.511 65 HD13 LEU 4 HD13 LEU 4 -19.516 22.610 27.941 66 HD21 LEU 4 HD21 LEU 4 -22.861 22.269 25.317 67 HD22 LEU 4 HD22 LEU 4 -22.299 23.814 25.940 68 HD23 LEU 4 HD23 LEU 4 -21.355 22.979 24.688 69 H ASP 5 H ASP 5 -20.786 18.128 27.859 70 HA ASP 5 HA ASP 5 -23.032 18.860 29.632 71 HB2 ASP 5 HB2 ASP 5 -22.554 16.036 28.595 72 HB3 ASP 5 HB3 ASP 5 -23.348 16.341 30.133 73 H GLU 6 H GLU 6 -20.275 16.522 29.384 74 HA GLU 6 HA GLU 6 -19.442 17.292 32.145 75 HB2 GLU 6 HB2 GLU 6 -20.274 15.010 31.958 76 HB3 GLU 6 HB3 GLU 6 -19.151 14.668 30.632 77 HG2 GLU 6 HG2 GLU 6 -17.236 15.029 32.117 78 HG3 GLU 6 HG3 GLU 6 -18.309 15.520 33.431 79 H ILE 7 H ILE 7 -17.757 18.578 32.143 80 HA ILE 7 HA ILE 7 -15.516 18.231 30.189 81 HB ILE 7 HB ILE 7 -16.703 20.851 31.173 82 HG12 ILE 7 HG12 ILE 7 -18.204 19.851 29.496 83 HG13 ILE 7 HG13 ILE 7 -17.461 21.345 28.972 84 HG21 ILE 7 HG21 ILE 7 -14.364 20.291 29.304 85 HG22 ILE 7 HG22 ILE 7 -15.114 21.885 29.537 86 HG23 ILE 7 HG23 ILE 7 -14.311 21.087 30.889 87 HD11 ILE 7 HD11 ILE 7 -16.473 18.596 28.120 88 HD12 ILE 7 HD12 ILE 7 -17.564 19.629 27.180 89 HD13 ILE 7 HD13 ILE 7 -15.911 20.168 27.514 90 H ILE 8 H ILE 8 -13.904 17.452 31.377 91 HA ILE 8 HA ILE 8 -13.183 18.726 33.959 92 HB ILE 8 HB ILE 8 -14.778 16.849 34.302 93 HG12 ILE 8 HG12 ILE 8 -12.131 16.221 35.637 94 HG13 ILE 8 HG13 ILE 8 -13.073 17.669 36.006 95 HG21 ILE 8 HG21 ILE 8 -12.501 15.021 33.433 96 HG22 ILE 8 HG22 ILE 8 -14.082 14.529 34.064 97 HG23 ILE 8 HG23 ILE 8 -13.982 15.334 32.501 98 HD11 ILE 8 HD11 ILE 8 -14.018 14.793 36.348 99 HD12 ILE 8 HD12 ILE 8 -13.560 15.931 37.626 100 HD13 ILE 8 HD13 ILE 8 -15.007 16.244 36.647 101 H GLU 9 H GLU 9 -11.998 18.305 31.074 102 HA GLU 9 HA GLU 9 -9.292 17.336 31.885 103 HB2 GLU 9 HB2 GLU 9 -10.371 16.211 29.975 104 HB3 GLU 9 HB3 GLU 9 -10.439 17.749 29.107 105 HG2 GLU 9 HG2 GLU 9 -7.944 17.895 29.213 106 HG3 GLU 9 HG3 GLU 9 -7.900 16.368 30.096 107 H GLN 10 H GLN 10 -8.088 18.929 32.663 108 HA GLN 10 HA GLN 10 -7.364 21.169 30.983 109 HB2 GLN 10 HB2 GLN 10 -9.416 22.106 32.057 110 HB3 GLN 10 HB3 GLN 10 -8.725 21.792 33.644 111 HG2 GLN 10 HG2 GLN 10 -8.494 24.140 33.090 112 HG3 GLN 10 HG3 GLN 10 -6.895 23.420 33.165 113 HE21 GLN 10 HE21 GLN 10 -6.211 24.027 29.688 114 HE22 GLN 10 HE22 GLN 10 -5.695 23.122 31.107 115 H ILE 11 H ILE 11 -7.279 20.113 34.409 116 HA ILE 11 HA ILE 11 -4.344 19.868 34.381 117 HB ILE 11 HB ILE 11 -4.351 20.996 36.703 118 HG12 ILE 11 HG12 ILE 11 -6.701 22.572 35.555 119 HG13 ILE 11 HG13 ILE 11 -6.871 21.354 36.813 120 HG21 ILE 11 HG21 ILE 11 -4.577 22.792 34.258 121 HG22 ILE 11 HG22 ILE 11 -3.646 23.098 35.737 122 HG23 ILE 11 HG23 ILE 11 -3.164 21.792 34.656 123 HD11 ILE 11 HD11 ILE 11 -5.309 23.950 37.045 124 HD12 ILE 11 HD12 ILE 11 -6.827 23.520 37.846 125 HD13 ILE 11 HD13 ILE 11 -5.333 22.665 38.279 126 H GLN 12 H GLN 12 -4.048 17.807 34.935 127 HA GLN 12 HA GLN 12 -5.193 16.678 37.359 128 HB2 GLN 12 HB2 GLN 12 -6.291 14.787 36.251 129 HB3 GLN 12 HB3 GLN 12 -7.090 16.300 35.884 130 HG2 GLN 12 HG2 GLN 12 -5.187 14.840 33.996 131 HG3 GLN 12 HG3 GLN 12 -6.936 14.720 33.957 132 HE21 GLN 12 HE21 GLN 12 -5.287 17.688 31.873 133 HE22 GLN 12 HE22 GLN 12 -4.388 16.292 32.450 134 H LYS 13 H LYS 13 -4.142 14.758 38.010 135 HA LYS 13 HA LYS 13 -1.466 14.362 36.855 136 HB2 LYS 13 HB2 LYS 13 -1.881 14.544 39.300 137 HB3 LYS 13 HB3 LYS 13 -2.730 12.991 39.257 138 HG2 LYS 13 HG2 LYS 13 -0.683 11.846 38.542 139 HG3 LYS 13 HG3 LYS 13 0.132 13.387 38.261 140 HD2 LYS 13 HD2 LYS 13 0.961 12.415 40.305 141 HD3 LYS 13 HD3 LYS 13 0.072 13.898 40.673 142 HE2 LYS 13 HE2 LYS 13 -1.914 12.534 41.324 143 HE3 LYS 13 HE3 LYS 13 -1.018 11.056 40.942 144 HZ1 LYS 13 HZ1 LYS 13 -0.255 13.020 43.041 145 HZ2 LYS 13 HZ2 LYS 13 -0.925 11.560 43.317 146 HZ3 LYS 13 HZ3 LYS 13 0.577 11.659 42.689 147 H GLU 14 H GLU 14 -2.244 13.702 34.836 148 HA GLU 14 HA GLU 14 -3.684 11.269 34.429 149 HB2 GLU 14 HB2 GLU 14 -3.255 11.717 31.997 150 HB3 GLU 14 HB3 GLU 14 -3.988 13.016 32.908 151 HG2 GLU 14 HG2 GLU 14 -2.433 13.990 31.410 152 HG3 GLU 14 HG3 GLU 14 -1.824 14.218 33.033 153 H ALA 15 H ALA 15 -1.496 10.621 35.990 154 HA ALA 15 HA ALA 15 0.503 9.115 34.538 155 HB1 ALA 15 HB1 ALA 15 -0.380 9.235 37.440 156 HB2 ALA 15 HB2 ALA 15 1.081 8.396 36.852 157 HB3 ALA 15 HB3 ALA 15 0.927 10.162 36.679 158 H ILE 16 H ILE 16 -1.779 7.826 36.921 159 HA ILE 16 HA ILE 16 -2.196 5.371 35.281 160 HB ILE 16 HB ILE 16 -1.437 5.785 38.170 161 HG12 ILE 16 HG12 ILE 16 -0.244 3.981 36.020 162 HG13 ILE 16 HG13 ILE 16 0.351 5.583 36.445 163 HG21 ILE 16 HG21 ILE 16 -2.484 3.146 37.043 164 HG22 ILE 16 HG22 ILE 16 -1.737 3.356 38.642 165 HG23 ILE 16 HG23 ILE 16 -3.263 4.135 38.301 166 HD11 ILE 16 HD11 ILE 16 0.435 3.120 38.210 167 HD12 ILE 16 HD12 ILE 16 1.781 4.018 37.502 168 HD13 ILE 16 HD13 ILE 16 0.804 4.770 38.777 169 H ASN 17 H ASN 17 -3.745 7.894 36.483 170 HA ASN 17 HA ASN 17 -6.049 6.611 37.588 171 HB2 ASN 17 HB2 ASN 17 -5.581 9.496 36.681 172 HB3 ASN 17 HB3 ASN 17 -7.017 8.965 37.552 173 HD21 ASN 17 HD21 ASN 17 -3.793 9.843 39.725 174 HD22 ASN 17 HD22 ASN 17 -3.939 10.315 38.039 175 H SER 18 H SER 18 -5.208 7.041 34.342 176 HA SER 18 HA SER 18 -8.013 6.758 33.360 177 HB2 SER 18 HB2 SER 18 -6.553 8.351 32.213 178 HB3 SER 18 HB3 SER 18 -5.423 7.045 31.809 179 HG SER 18 HG SER 18 -6.934 7.515 30.113 180 H ASN 19 H ASN 19 -4.882 4.977 32.955 181 HA ASN 19 HA ASN 19 -6.185 2.850 31.586 182 HB2 ASN 19 HB2 ASN 19 -4.021 1.821 31.437 183 HB3 ASN 19 HB3 ASN 19 -3.839 3.548 31.192 184 HD21 ASN 19 HD21 ASN 19 -1.493 3.788 33.820 185 HD22 ASN 19 HD22 ASN 19 -2.223 4.543 32.415 186 H VAL 20 H VAL 20 -5.957 3.304 34.931 187 HA VAL 20 HA VAL 20 -6.109 0.546 35.765 188 HB VAL 20 HB VAL 20 -5.375 2.437 37.191 189 HG11 VAL 20 HG11 VAL 20 -8.331 3.094 37.529 190 HG12 VAL 20 HG12 VAL 20 -6.957 3.851 38.352 191 HG13 VAL 20 HG13 VAL 20 -7.172 4.084 36.614 192 HG21 VAL 20 HG21 VAL 20 -5.999 0.256 38.165 193 HG22 VAL 20 HG22 VAL 20 -6.292 1.616 39.262 194 HG23 VAL 20 HG23 VAL 20 -7.655 0.853 38.421 195 H VAL 21 H VAL 21 -8.470 2.714 34.413 196 HA VAL 21 HA VAL 21 -10.778 1.157 35.398 197 HB VAL 21 HB VAL 21 -10.902 3.619 33.634 198 HG11 VAL 21 HG11 VAL 21 -12.852 2.394 35.652 199 HG12 VAL 21 HG12 VAL 21 -13.130 3.855 34.681 200 HG13 VAL 21 HG13 VAL 21 -13.010 2.285 33.887 201 HG21 VAL 21 HG21 VAL 21 -9.642 4.310 35.605 202 HG22 VAL 21 HG22 VAL 21 -11.292 4.905 35.738 203 HG23 VAL 21 HG23 VAL 21 -10.797 3.480 36.678 204 H LEU 22 H LEU 22 -9.582 -0.640 34.126 205 HA LEU 22 HA LEU 22 -10.970 -0.995 31.517 206 HB2 LEU 22 HB2 LEU 22 -8.001 -1.191 32.084 207 HB3 LEU 22 HB3 LEU 22 -8.720 -2.208 30.840 208 HG LEU 22 HG LEU 22 -8.868 0.838 30.842 209 HD11 LEU 22 HD11 LEU 22 -7.117 -1.070 29.233 210 HD12 LEU 22 HD12 LEU 22 -7.206 0.696 29.033 211 HD13 LEU 22 HD13 LEU 22 -6.564 0.007 30.532 212 HD21 LEU 22 HD21 LEU 22 -10.725 -0.161 29.554 213 HD22 LEU 22 HD22 LEU 22 -9.525 0.503 28.450 214 HD23 LEU 22 HD23 LEU 22 -9.588 -1.251 28.725 215 H LYS 23 H LYS 23 -11.943 -2.823 31.279 216 HA LYS 23 HA LYS 23 -11.190 -5.272 32.815 217 HB2 LYS 23 HB2 LYS 23 -13.963 -4.021 32.599 218 HB3 LYS 23 HB3 LYS 23 -13.678 -5.646 33.209 219 HG2 LYS 23 HG2 LYS 23 -12.539 -3.133 34.487 220 HG3 LYS 23 HG3 LYS 23 -14.014 -3.957 34.984 221 HD2 LYS 23 HD2 LYS 23 -12.728 -6.021 35.475 222 HD3 LYS 23 HD3 LYS 23 -11.223 -5.195 35.023 223 HE2 LYS 23 HE2 LYS 23 -11.586 -3.519 36.796 224 HE3 LYS 23 HE3 LYS 23 -13.107 -4.302 37.244 225 HZ1 LYS 23 HZ1 LYS 23 -10.427 -5.580 37.410 226 HZ2 LYS 23 HZ2 LYS 23 -11.282 -5.019 38.681 227 HZ3 LYS 23 HZ3 LYS 23 -11.836 -6.296 37.832 228 H ASN 24 H ASN 24 -10.922 -4.378 29.954 229 HA ASN 24 HA ASN 24 -12.110 -6.818 28.694 230 HB2 ASN 24 HB2 ASN 24 -13.243 -4.531 28.216 231 HB3 ASN 24 HB3 ASN 24 -11.822 -4.169 27.240 232 HD21 ASN 24 HD21 ASN 24 -12.785 -6.432 24.624 233 HD22 ASN 24 HD22 ASN 24 -11.359 -5.807 25.462 234 HA PRO 25 HA PRO 25 -7.514 -6.354 27.725 235 HB2 PRO 25 HB2 PRO 25 -6.187 -7.940 29.462 236 HB3 PRO 25 HB3 PRO 25 -6.847 -6.360 29.970 237 HG2 PRO 25 HG2 PRO 25 -8.158 -9.090 30.309 238 HG3 PRO 25 HG3 PRO 25 -7.856 -7.845 31.566 239 HD2 PRO 25 HD2 PRO 25 -10.251 -8.032 30.250 240 HD3 PRO 25 HD3 PRO 25 -9.537 -6.475 30.772 241 H ARG 26 H ARG 26 -8.879 -7.426 25.991 242 HA ARG 26 HA ARG 26 -8.077 -10.298 25.541 243 HB2 ARG 26 HB2 ARG 26 -10.415 -8.705 24.438 244 HB3 ARG 26 HB3 ARG 26 -9.999 -10.367 23.982 245 HG2 ARG 26 HG2 ARG 26 -10.239 -10.984 26.460 246 HG3 ARG 26 HG3 ARG 26 -10.937 -9.370 26.700 247 HD2 ARG 26 HD2 ARG 26 -12.609 -9.954 24.847 248 HD3 ARG 26 HD3 ARG 26 -11.965 -11.591 24.884 249 HE ARG 26 HE ARG 26 -12.920 -11.973 27.007 250 HH11 ARG 26 HH11 ARG 26 -14.552 -11.667 28.494 251 HH12 ARG 26 HH12 ARG 26 -15.405 -10.152 28.545 252 HH21 ARG 26 HH21 ARG 26 -13.658 -8.707 25.983 253 HH22 ARG 26 HH22 ARG 26 -14.909 -8.508 27.168 254 H VAL 27 H VAL 27 -8.249 -7.188 23.902 255 HA VAL 27 HA VAL 27 -7.641 -6.490 21.815 256 HB VAL 27 HB VAL 27 -5.030 -7.574 22.852 257 HG11 VAL 27 HG11 VAL 27 -5.661 -5.243 20.957 258 HG12 VAL 27 HG12 VAL 27 -4.050 -5.648 21.589 259 HG13 VAL 27 HG13 VAL 27 -4.861 -6.750 20.479 260 HG21 VAL 27 HG21 VAL 27 -6.092 -6.189 24.561 261 HG22 VAL 27 HG22 VAL 27 -4.764 -5.298 23.824 262 HG23 VAL 27 HG23 VAL 27 -6.438 -4.921 23.361 263 HA PRO 28 HA PRO 28 -7.854 -10.438 19.443 264 HB2 PRO 28 HB2 PRO 28 -9.734 -9.716 17.611 265 HB3 PRO 28 HB3 PRO 28 -10.124 -10.310 19.254 266 HG2 PRO 28 HG2 PRO 28 -9.939 -7.418 18.327 267 HG3 PRO 28 HG3 PRO 28 -11.248 -8.184 19.282 268 HD2 PRO 28 HD2 PRO 28 -9.267 -6.751 20.452 269 HD3 PRO 28 HD3 PRO 28 -9.905 -8.229 21.235 270 H THR 29 H THR 29 -7.530 -10.922 17.189 271 HA THR 29 HA THR 29 -5.306 -9.249 16.189 272 HB THR 29 HB THR 29 -4.413 -11.578 15.657 273 HG1 THR 29 HG1 THR 29 -5.324 -13.257 16.838 274 HG21 THR 29 HG21 THR 29 -4.974 -10.895 18.574 275 HG22 THR 29 HG22 THR 29 -3.670 -11.948 17.974 276 HG23 THR 29 HG23 THR 29 -3.660 -10.216 17.593 277 H GLN 30 H GLN 30 -7.118 -8.275 14.882 278 HA GLN 30 HA GLN 30 -7.802 -9.899 12.514 279 HB2 GLN 30 HB2 GLN 30 -8.988 -7.359 13.666 280 HB3 GLN 30 HB3 GLN 30 -9.574 -8.096 12.171 281 HG2 GLN 30 HG2 GLN 30 -10.382 -10.026 13.232 282 HG3 GLN 30 HG3 GLN 30 -9.437 -9.768 14.697 283 HE21 GLN 30 HE21 GLN 30 -11.648 -7.292 16.077 284 HE22 GLN 30 HE22 GLN 30 -9.945 -7.728 15.976 285 H LYS 31 H LYS 31 -5.228 -8.512 12.852 286 HA LYS 31 HA LYS 31 -5.121 -6.369 10.920 287 HB2 LYS 31 HB2 LYS 31 -3.774 -7.040 13.175 288 HB3 LYS 31 HB3 LYS 31 -2.622 -7.644 12.014 289 HG2 LYS 31 HG2 LYS 31 -3.692 -4.773 12.169 290 HG3 LYS 31 HG3 LYS 31 -2.208 -5.355 12.906 291 HD2 LYS 31 HD2 LYS 31 -1.388 -4.327 11.021 292 HD3 LYS 31 HD3 LYS 31 -1.458 -6.016 10.518 293 HE2 LYS 31 HE2 LYS 31 -3.801 -5.417 9.539 294 HE3 LYS 31 HE3 LYS 31 -3.378 -3.737 9.831 295 HZ1 LYS 31 HZ1 LYS 31 -1.870 -5.645 8.128 296 HZ2 LYS 31 HZ2 LYS 31 -2.810 -4.426 7.576 297 HZ3 LYS 31 HZ3 LYS 31 -1.419 -4.084 8.382 298 H THR 32 H THR 32 -5.969 -8.895 9.791 299 HA THR 32 HA THR 32 -3.900 -9.413 7.700 300 HB THR 32 HB THR 32 -3.472 -10.803 9.688 301 HG1 THR 32 HG1 THR 32 -3.250 -12.723 8.598 302 HG21 THR 32 HG21 THR 32 -6.144 -12.130 9.088 303 HG22 THR 32 HG22 THR 32 -4.929 -12.682 10.261 304 HG23 THR 32 HG23 THR 32 -5.753 -11.138 10.513 305 H GLY 33 H GLY 33 -6.839 -8.373 7.870 306 HA2 GLY 33 HA2 GLY 33 -7.811 -9.768 5.441 307 HA3 GLY 33 HA3 GLY 33 -8.806 -9.911 6.893 308 H GLU 34 H GLU 34 -6.954 -7.069 5.775 309 HA GLU 34 HA GLU 34 -9.445 -5.457 6.021 310 HB2 GLU 34 HB2 GLU 34 -6.556 -4.591 6.360 311 HB3 GLU 34 HB3 GLU 34 -8.001 -3.606 6.630 312 HG2 GLU 34 HG2 GLU 34 -8.734 -5.349 8.355 313 HG3 GLU 34 HG3 GLU 34 -7.116 -6.042 8.221 314 H LEU 35 H LEU 35 -8.445 -6.787 3.402 315 HA LEU 35 HA LEU 35 -8.822 -4.417 1.706 316 HB2 LEU 35 HB2 LEU 35 -6.754 -6.620 1.253 317 HB3 LEU 35 HB3 LEU 35 -7.356 -5.537 0.011 318 HG LEU 35 HG LEU 35 -6.591 -3.619 1.668 319 HD11 LEU 35 HD11 LEU 35 -4.747 -5.926 2.445 320 HD12 LEU 35 HD12 LEU 35 -4.468 -4.213 2.825 321 HD13 LEU 35 HD13 LEU 35 -5.838 -5.060 3.539 322 HD21 LEU 35 HD21 LEU 35 -5.724 -3.987 -0.599 323 HD22 LEU 35 HD22 LEU 35 -4.398 -3.610 0.509 324 HD23 LEU 35 HD23 LEU 35 -4.682 -5.291 -0.013 325 H SER 36 H SER 36 -10.211 -4.698 0.224 326 HA SER 36 HA SER 36 -11.615 -7.309 -0.154 327 HB2 SER 36 HB2 SER 36 -12.801 -4.536 -0.278 328 HB3 SER 36 HB3 SER 36 -13.652 -6.062 -0.580 329 HG SER 36 HG SER 36 -13.936 -5.333 1.577 330 H GLU 37 H GLU 37 -11.460 -4.318 -2.030 331 HA GLU 37 HA GLU 37 -10.667 -5.776 -4.451 332 HB2 GLU 37 HB2 GLU 37 -12.741 -5.792 -5.585 333 HB3 GLU 37 HB3 GLU 37 -13.091 -6.412 -3.962 334 HG2 GLU 37 HG2 GLU 37 -13.950 -4.151 -3.321 335 HG3 GLU 37 HG3 GLU 37 -13.718 -3.624 -4.993 336 H GLU 38 H GLU 38 -11.880 -2.777 -3.033 337 HA GLU 38 HA GLU 38 -10.830 -1.173 -5.298 338 HB2 GLU 38 HB2 GLU 38 -11.980 -0.380 -2.593 339 HB3 GLU 38 HB3 GLU 38 -11.443 0.753 -3.842 340 HG2 GLU 38 HG2 GLU 38 -13.089 -0.250 -5.436 341 HG3 GLU 38 HG3 GLU 38 -13.688 -1.288 -4.141 342 H GLN 39 H GLN 39 -9.735 -2.400 -2.212 343 HA GLN 39 HA GLN 39 -7.746 -0.371 -1.683 344 HB2 GLN 39 HB2 GLN 39 -8.119 -3.183 -0.544 345 HB3 GLN 39 HB3 GLN 39 -7.092 -1.925 0.116 346 HG2 GLN 39 HG2 GLN 39 -9.019 -1.857 1.456 347 HG3 GLN 39 HG3 GLN 39 -9.171 -0.470 0.381 348 HE21 GLN 39 HE21 GLN 39 -12.520 -1.795 0.123 349 HE22 GLN 39 HE22 GLN 39 -11.533 -0.647 1.037 350 H LYS 40 H LYS 40 -7.539 -3.682 -2.989 351 HA LYS 40 HA LYS 40 -4.669 -3.574 -3.454 352 HB2 LYS 40 HB2 LYS 40 -4.983 -5.699 -4.597 353 HB3 LYS 40 HB3 LYS 40 -5.817 -5.650 -3.046 354 HG2 LYS 40 HG2 LYS 40 -7.934 -4.967 -4.471 355 HG3 LYS 40 HG3 LYS 40 -6.973 -5.494 -5.848 356 HD2 LYS 40 HD2 LYS 40 -8.534 -7.231 -5.041 357 HD3 LYS 40 HD3 LYS 40 -6.857 -7.774 -4.904 358 HE2 LYS 40 HE2 LYS 40 -6.853 -7.432 -2.498 359 HE3 LYS 40 HE3 LYS 40 -8.394 -6.576 -2.541 360 HZ1 LYS 40 HZ1 LYS 40 -8.129 -9.422 -3.347 361 HZ2 LYS 40 HZ2 LYS 40 -8.545 -8.948 -1.839 362 HZ3 LYS 40 HZ3 LYS 40 -9.519 -8.573 -3.084 363 H LYS 41 H LYS 41 -7.468 -2.607 -5.378 364 HA LYS 41 HA LYS 41 -5.964 -1.906 -7.760 365 HB2 LYS 41 HB2 LYS 41 -8.596 -0.808 -6.698 366 HB3 LYS 41 HB3 LYS 41 -7.919 -0.430 -8.278 367 HG2 LYS 41 HG2 LYS 41 -8.031 -2.760 -8.965 368 HG3 LYS 41 HG3 LYS 41 -8.604 -3.237 -7.360 369 HD2 LYS 41 HD2 LYS 41 -10.594 -1.707 -7.685 370 HD3 LYS 41 HD3 LYS 41 -10.072 -1.431 -9.347 371 HE2 LYS 41 HE2 LYS 41 -10.738 -4.154 -8.128 372 HE3 LYS 41 HE3 LYS 41 -11.884 -3.165 -9.035 373 HZ1 LYS 41 HZ1 LYS 41 -9.363 -4.274 -10.148 374 HZ2 LYS 41 HZ2 LYS 41 -10.867 -4.814 -10.472 375 HZ3 LYS 41 HZ3 LYS 41 -10.416 -3.330 -10.972 376 H ILE 42 H ILE 42 -5.690 -0.585 -4.691 377 HA ILE 42 HA ILE 42 -4.315 1.831 -5.816 378 HB ILE 42 HB ILE 42 -5.295 1.215 -3.027 379 HG12 ILE 42 HG12 ILE 42 -6.132 3.722 -4.420 380 HG13 ILE 42 HG13 ILE 42 -6.755 2.251 -5.144 381 HG21 ILE 42 HG21 ILE 42 -3.685 3.611 -3.986 382 HG22 ILE 42 HG22 ILE 42 -4.511 3.491 -2.418 383 HG23 ILE 42 HG23 ILE 42 -3.191 2.397 -2.782 384 HD11 ILE 42 HD11 ILE 42 -7.086 3.013 -2.221 385 HD12 ILE 42 HD12 ILE 42 -8.335 3.028 -3.496 386 HD13 ILE 42 HD13 ILE 42 -7.619 1.498 -2.966 387 H VAL 43 H VAL 43 -3.847 -0.824 -3.369 388 HA VAL 43 HA VAL 43 -1.081 -0.182 -3.024 389 HB VAL 43 HB VAL 43 -2.456 -2.824 -2.402 390 HG11 VAL 43 HG11 VAL 43 0.183 -1.613 -1.444 391 HG12 VAL 43 HG12 VAL 43 -0.572 -3.058 -0.752 392 HG13 VAL 43 HG13 VAL 43 -0.009 -3.086 -2.415 393 HG21 VAL 43 HG21 VAL 43 -3.521 -0.929 -1.217 394 HG22 VAL 43 HG22 VAL 43 -2.621 -1.949 -0.102 395 HG23 VAL 43 HG23 VAL 43 -1.936 -0.404 -0.625 396 H ALA 44 H ALA 44 -2.509 -2.965 -4.867 397 HA ALA 44 HA ALA 44 0.114 -3.773 -5.812 398 HB1 ALA 44 HB1 ALA 44 -2.627 -4.624 -6.802 399 HB2 ALA 44 HB2 ALA 44 -1.067 -5.429 -7.098 400 HB3 ALA 44 HB3 ALA 44 -1.727 -5.370 -5.454 401 H ASP 45 H ASP 45 -2.499 -1.756 -7.136 402 HA ASP 45 HA ASP 45 -1.356 -1.222 -9.693 403 HB2 ASP 45 HB2 ASP 45 -3.595 -0.512 -8.932 404 HB3 ASP 45 HB3 ASP 45 -2.852 0.676 -7.854 405 H TYR 46 H TYR 46 -0.489 0.221 -6.500 406 HA TYR 46 HA TYR 46 1.526 1.996 -7.574 407 HB2 TYR 46 HB2 TYR 46 0.233 1.872 -5.237 408 HB3 TYR 46 HB3 TYR 46 1.642 0.958 -4.748 409 HD1 TYR 46 HD1 TYR 46 0.425 3.747 -3.891 410 HD2 TYR 46 HD2 TYR 46 3.768 2.580 -6.326 411 HE1 TYR 46 HE1 TYR 46 1.588 5.860 -3.307 412 HE2 TYR 46 HE2 TYR 46 4.806 4.766 -5.994 413 HH TYR 46 HH TYR 46 3.402 7.229 -3.763 414 H ILE 47 H ILE 47 1.649 -1.363 -6.256 415 HA ILE 47 HA ILE 47 4.488 -1.685 -6.427 416 HB ILE 47 HB ILE 47 2.310 -3.775 -6.813 417 HG12 ILE 47 HG12 ILE 47 1.881 -3.066 -4.651 418 HG13 ILE 47 HG13 ILE 47 3.012 -4.352 -4.361 419 HG21 ILE 47 HG21 ILE 47 5.220 -4.193 -6.068 420 HG22 ILE 47 HG22 ILE 47 3.951 -5.438 -6.151 421 HG23 ILE 47 HG23 ILE 47 4.463 -4.619 -7.621 422 HD11 ILE 47 HD11 ILE 47 3.574 -1.356 -4.292 423 HD12 ILE 47 HD12 ILE 47 3.548 -2.484 -2.927 424 HD13 ILE 47 HD13 ILE 47 4.839 -2.597 -4.141 425 H SER 48 H SER 48 2.016 -1.942 -8.942 426 HA SER 48 HA SER 48 3.899 -2.589 -11.070 427 HB2 SER 48 HB2 SER 48 1.033 -1.588 -11.140 428 HB3 SER 48 HB3 SER 48 1.965 -2.095 -12.559 429 HG SER 48 HG SER 48 0.667 -3.797 -11.709 430 H GLU 49 H GLU 49 3.538 0.368 -9.401 431 HA GLU 49 HA GLU 49 4.019 2.022 -11.831 432 HB2 GLU 49 HB2 GLU 49 2.045 2.530 -10.523 433 HB3 GLU 49 HB3 GLU 49 3.011 2.709 -9.051 434 HG2 GLU 49 HG2 GLU 49 4.045 4.672 -9.810 435 HG3 GLU 49 HG3 GLU 49 3.533 4.412 -11.489 436 H VAL 50 H VAL 50 5.535 1.112 -8.738 437 HA VAL 50 HA VAL 50 7.910 2.778 -9.509 438 HB VAL 50 HB VAL 50 6.204 3.685 -7.749 439 HG11 VAL 50 HG11 VAL 50 7.825 1.914 -5.908 440 HG12 VAL 50 HG12 VAL 50 6.647 3.167 -5.490 441 HG13 VAL 50 HG13 VAL 50 6.109 1.704 -6.332 442 HG21 VAL 50 HG21 VAL 50 8.125 4.907 -8.324 443 HG22 VAL 50 HG22 VAL 50 8.062 4.834 -6.556 444 HG23 VAL 50 HG23 VAL 50 9.205 3.810 -7.464 445 H GLY 51 H GLY 51 6.944 -0.268 -8.048 446 HA2 GLY 51 HA2 GLY 51 8.878 -1.906 -8.721 447 HA3 GLY 51 HA3 GLY 51 9.797 -0.996 -7.518 448 H LEU 52 H LEU 52 9.140 -0.998 -5.378 449 HA LEU 52 HA LEU 52 6.982 -2.631 -4.370 450 HB2 LEU 52 HB2 LEU 52 8.692 -4.398 -4.922 451 HB3 LEU 52 HB3 LEU 52 9.851 -3.586 -3.881 452 HG LEU 52 HG LEU 52 8.418 -4.056 -1.903 453 HD11 LEU 52 HD11 LEU 52 6.566 -5.195 -4.016 454 HD12 LEU 52 HD12 LEU 52 6.581 -5.817 -2.363 455 HD13 LEU 52 HD13 LEU 52 6.193 -4.121 -2.636 456 HD21 LEU 52 HD21 LEU 52 10.128 -5.712 -2.628 457 HD22 LEU 52 HD22 LEU 52 8.749 -6.447 -1.803 458 HD23 LEU 52 HD23 LEU 52 8.882 -6.554 -3.576 459 H ASN 53 H ASN 53 10.071 -1.092 -3.596 460 HA ASN 53 HA ASN 53 9.055 -0.292 -0.916 461 HB2 ASN 53 HB2 ASN 53 11.853 -0.921 -1.932 462 HB3 ASN 53 HB3 ASN 53 11.491 -0.363 -0.301 463 HD21 ASN 53 HD21 ASN 53 11.128 -4.266 -1.053 464 HD22 ASN 53 HD22 ASN 53 11.844 -3.156 -2.213 465 H ASN 54 H ASN 54 9.367 1.275 -3.776 466 HA ASN 54 HA ASN 54 10.752 3.671 -2.688 467 HB2 ASN 54 HB2 ASN 54 9.727 3.106 -5.472 468 HB3 ASN 54 HB3 ASN 54 10.821 4.404 -5.000 469 HD21 ASN 54 HD21 ASN 54 12.352 0.862 -6.036 470 HD22 ASN 54 HD22 ASN 54 10.760 1.443 -6.506 471 H LEU 55 H LEU 55 7.545 2.503 -3.211 472 HA LEU 55 HA LEU 55 6.105 4.998 -3.176 473 HB2 LEU 55 HB2 LEU 55 4.190 3.619 -2.705 474 HB3 LEU 55 HB3 LEU 55 5.192 2.836 -3.902 475 HG LEU 55 HG LEU 55 6.156 1.565 -1.698 476 HD11 LEU 55 HD11 LEU 55 3.227 2.218 -1.119 477 HD12 LEU 55 HD12 LEU 55 4.141 0.911 -0.360 478 HD13 LEU 55 HD13 LEU 55 4.624 2.591 -0.084 479 HD21 LEU 55 HD21 LEU 55 5.291 0.526 -3.756 480 HD22 LEU 55 HD22 LEU 55 4.652 -0.263 -2.309 481 HD23 LEU 55 HD23 LEU 55 3.624 0.863 -3.230 482 H ASN 56 H ASN 56 4.737 5.731 -1.332 483 HA ASN 56 HA ASN 56 5.974 5.171 1.312 484 HB2 ASN 56 HB2 ASN 56 5.675 7.339 2.071 485 HB3 ASN 56 HB3 ASN 56 6.414 7.496 0.490 486 HD21 ASN 56 HD21 ASN 56 3.981 10.091 0.260 487 HD22 ASN 56 HD22 ASN 56 5.657 9.746 0.679 488 H ALA 57 H ALA 57 4.540 5.405 3.103 489 HA ALA 57 HA ALA 57 2.204 3.700 2.746 490 HB1 ALA 57 HB1 ALA 57 3.576 5.076 5.092 491 HB2 ALA 57 HB2 ALA 57 2.264 3.899 5.258 492 HB3 ALA 57 HB3 ALA 57 3.811 3.399 4.540 493 H THR 58 H THR 58 2.796 7.120 3.169 494 HA THR 58 HA THR 58 0.332 8.001 4.233 495 HB THR 58 HB THR 58 2.219 9.496 2.370 496 HG1 THR 58 HG1 THR 58 3.278 10.072 4.280 497 HG21 THR 58 HG21 THR 58 0.325 10.454 4.556 498 HG22 THR 58 HG22 THR 58 1.550 11.467 3.749 499 HG23 THR 58 HG23 THR 58 0.225 10.783 2.807 500 H GLU 59 H GLU 59 1.382 7.809 0.803 501 HA GLU 59 HA GLU 59 -1.051 8.747 -0.376 502 HB2 GLU 59 HB2 GLU 59 1.210 6.946 -1.326 503 HB3 GLU 59 HB3 GLU 59 -0.130 7.356 -2.386 504 HG2 GLU 59 HG2 GLU 59 1.704 9.406 -1.077 505 HG3 GLU 59 HG3 GLU 59 1.913 8.763 -2.701 506 H LEU 60 H LEU 60 -0.045 5.387 0.325 507 HA LEU 60 HA LEU 60 -2.487 4.085 -0.420 508 HB2 LEU 60 HB2 LEU 60 -0.245 3.495 1.536 509 HB3 LEU 60 HB3 LEU 60 -1.708 2.523 1.580 510 HG LEU 60 HG LEU 60 -1.424 1.796 -0.701 511 HD11 LEU 60 HD11 LEU 60 1.100 3.489 -0.763 512 HD12 LEU 60 HD12 LEU 60 0.645 2.270 -1.972 513 HD13 LEU 60 HD13 LEU 60 -0.359 3.710 -1.754 514 HD21 LEU 60 HD21 LEU 60 -0.281 0.555 1.118 515 HD22 LEU 60 HD22 LEU 60 0.649 0.474 -0.390 516 HD23 LEU 60 HD23 LEU 60 1.162 1.572 0.904 517 H SER 61 H SER 61 -1.519 5.385 2.781 518 HA SER 61 HA SER 61 -3.818 4.745 4.229 519 HB2 SER 61 HB2 SER 61 -1.948 7.103 4.605 520 HB3 SER 61 HB3 SER 61 -3.119 6.516 5.794 521 HG SER 61 HG SER 61 -0.876 5.156 4.707 522 H LYS 62 H LYS 62 -3.270 7.452 2.083 523 HA LYS 62 HA LYS 62 -5.628 9.006 2.896 524 HB2 LYS 62 HB2 LYS 62 -3.579 9.241 0.661 525 HB3 LYS 62 HB3 LYS 62 -4.940 10.358 0.818 526 HG2 LYS 62 HG2 LYS 62 -4.202 11.190 2.924 527 HG3 LYS 62 HG3 LYS 62 -3.071 9.872 3.162 528 HD2 LYS 62 HD2 LYS 62 -1.797 11.819 2.588 529 HD3 LYS 62 HD3 LYS 62 -1.687 10.665 1.261 530 HE2 LYS 62 HE2 LYS 62 -1.949 12.798 0.259 531 HE3 LYS 62 HE3 LYS 62 -3.507 11.995 0.070 532 HZ1 LYS 62 HZ1 LYS 62 -2.853 14.009 2.164 533 HZ2 LYS 62 HZ2 LYS 62 -3.752 14.295 0.837 534 HZ3 LYS 62 HZ3 LYS 62 -4.311 13.290 1.993 535 H ARG 63 H ARG 63 -5.148 6.404 0.688 536 HA ARG 63 HA ARG 63 -7.792 6.925 -0.657 537 HB2 ARG 63 HB2 ARG 63 -5.403 5.269 -1.510 538 HB3 ARG 63 HB3 ARG 63 -6.952 5.336 -2.376 539 HG2 ARG 63 HG2 ARG 63 -6.663 7.784 -2.703 540 HG3 ARG 63 HG3 ARG 63 -5.084 7.690 -1.899 541 HD2 ARG 63 HD2 ARG 63 -4.362 6.006 -3.638 542 HD3 ARG 63 HD3 ARG 63 -5.905 6.246 -4.454 543 HE ARG 63 HE ARG 63 -5.134 8.242 -5.337 544 HH11 ARG 63 HH11 ARG 63 -3.530 9.791 -5.837 545 HH12 ARG 63 HH12 ARG 63 -2.104 9.850 -4.812 546 HH21 ARG 63 HH21 ARG 63 -2.963 7.475 -2.642 547 HH22 ARG 63 HH22 ARG 63 -1.790 8.650 -3.255 548 H LEU 64 H LEU 64 -5.966 4.384 1.066 549 HA LEU 64 HA LEU 64 -8.297 2.593 1.164 550 HB2 LEU 64 HB2 LEU 64 -5.542 2.526 2.463 551 HB3 LEU 64 HB3 LEU 64 -6.826 1.405 2.880 552 HG LEU 64 HG LEU 64 -6.941 0.868 0.327 553 HD11 LEU 64 HD11 LEU 64 -4.090 1.925 0.559 554 HD12 LEU 64 HD12 LEU 64 -4.764 1.011 -0.803 555 HD13 LEU 64 HD13 LEU 64 -5.377 2.628 -0.446 556 HD21 LEU 64 HD21 LEU 64 -6.258 -0.717 2.042 557 HD22 LEU 64 HD22 LEU 64 -5.167 -0.847 0.650 558 HD23 LEU 64 HD23 LEU 64 -4.629 0.003 2.110 559 H ASN 65 H ASN 65 -7.129 5.266 3.075 560 HA ASN 65 HA ASN 65 -7.849 6.275 4.947 561 HB2 ASN 65 HB2 ASN 65 -10.046 6.167 3.737 562 HB3 ASN 65 HB3 ASN 65 -10.461 4.749 4.697 563 HD21 ASN 65 HD21 ASN 65 -10.892 6.665 7.732 564 HD22 ASN 65 HD22 ASN 65 -10.297 5.102 7.156 565 H ILE 66 H ILE 66 -6.043 4.895 5.620 566 HA ILE 66 HA ILE 66 -6.729 3.240 8.000 567 HB ILE 66 HB ILE 66 -4.593 1.899 7.479 568 HG12 ILE 66 HG12 ILE 66 -5.088 2.987 4.691 569 HG13 ILE 66 HG13 ILE 66 -3.690 3.298 5.742 570 HG21 ILE 66 HG21 ILE 66 -6.997 1.402 5.721 571 HG22 ILE 66 HG22 ILE 66 -5.789 0.222 6.312 572 HG23 ILE 66 HG23 ILE 66 -6.863 1.012 7.459 573 HD11 ILE 66 HD11 ILE 66 -4.430 0.631 4.496 574 HD12 ILE 66 HD12 ILE 66 -3.142 1.734 3.992 575 HD13 ILE 66 HD13 ILE 66 -3.047 0.931 5.585 576 H THR 67 H THR 67 -4.914 2.933 9.414 577 HA THR 67 HA THR 67 -3.479 5.321 10.230 578 HB THR 67 HB THR 67 -3.422 2.379 11.012 579 HG1 THR 67 HG1 THR 67 -4.438 3.193 12.851 580 HG21 THR 67 HG21 THR 67 -1.850 4.678 12.222 581 HG22 THR 67 HG22 THR 67 -2.170 3.133 13.052 582 HG23 THR 67 HG23 THR 67 -1.238 3.136 11.558 583 H VAL 68 H VAL 68 -1.438 5.925 9.614 584 HA VAL 68 HA VAL 68 -0.226 4.840 7.309 585 HB VAL 68 HB VAL 68 1.180 6.505 9.423 586 HG11 VAL 68 HG11 VAL 68 1.640 6.228 6.418 587 HG12 VAL 68 HG12 VAL 68 2.502 7.344 7.497 588 HG13 VAL 68 HG13 VAL 68 2.710 5.604 7.694 589 HG21 VAL 68 HG21 VAL 68 -0.894 7.666 8.768 590 HG22 VAL 68 HG22 VAL 68 0.496 8.467 8.040 591 HG23 VAL 68 HG23 VAL 68 -0.520 7.399 7.050 592 H ASP 69 H ASP 69 0.396 4.022 10.684 593 HA ASP 69 HA ASP 69 2.693 2.393 10.102 594 HB2 ASP 69 HB2 ASP 69 2.173 3.402 12.328 595 HB3 ASP 69 HB3 ASP 69 0.826 2.273 12.497 596 H LYS 70 H LYS 70 -0.758 1.666 9.883 597 HA LYS 70 HA LYS 70 -0.305 -1.230 9.646 598 HB2 LYS 70 HB2 LYS 70 -2.685 0.570 8.968 599 HB3 LYS 70 HB3 LYS 70 -2.613 -1.131 8.524 600 HG2 LYS 70 HG2 LYS 70 -2.260 -1.723 10.940 601 HG3 LYS 70 HG3 LYS 70 -2.558 -0.021 11.359 602 HD2 LYS 70 HD2 LYS 70 -4.812 -0.138 10.381 603 HD3 LYS 70 HD3 LYS 70 -4.487 -1.758 9.744 604 HE2 LYS 70 HE2 LYS 70 -4.115 -2.514 12.158 605 HE3 LYS 70 HE3 LYS 70 -4.774 -0.952 12.664 606 HZ1 LYS 70 HZ1 LYS 70 -6.187 -2.939 10.939 607 HZ2 LYS 70 HZ2 LYS 70 -6.499 -2.693 12.533 608 HZ3 LYS 70 HZ3 LYS 70 -6.820 -1.525 11.435 609 H ALA 71 H ALA 71 -0.341 1.542 7.460 610 HA ALA 71 HA ALA 71 -0.191 -0.099 5.030 611 HB1 ALA 71 HB1 ALA 71 0.396 2.847 5.577 612 HB2 ALA 71 HB2 ALA 71 0.393 2.094 3.966 613 HB3 ALA 71 HB3 ALA 71 -1.090 2.194 4.928 614 H LYS 72 H LYS 72 2.215 1.689 6.985 615 HA LYS 72 HA LYS 72 4.594 0.997 5.593 616 HB2 LYS 72 HB2 LYS 72 4.066 1.432 8.570 617 HB3 LYS 72 HB3 LYS 72 5.683 1.201 7.910 618 HG2 LYS 72 HG2 LYS 72 5.549 3.225 6.602 619 HG3 LYS 72 HG3 LYS 72 3.848 3.419 6.992 620 HD2 LYS 72 HD2 LYS 72 5.171 4.981 8.300 621 HD3 LYS 72 HD3 LYS 72 4.307 3.842 9.318 622 HE2 LYS 72 HE2 LYS 72 6.461 4.123 10.270 623 HE3 LYS 72 HE3 LYS 72 6.409 2.503 9.583 624 HZ1 LYS 72 HZ1 LYS 72 7.685 4.877 8.314 625 HZ2 LYS 72 HZ2 LYS 72 8.481 3.647 9.023 626 HZ3 LYS 72 HZ3 LYS 72 7.647 3.386 7.645 627 H THR 73 H THR 73 2.931 -0.914 8.147 628 HA THR 73 HA THR 73 5.014 -2.987 7.879 629 HB THR 73 HB THR 73 3.939 -2.220 10.064 630 HG1 THR 73 HG1 THR 73 4.324 -4.261 10.876 631 HG21 THR 73 HG21 THR 73 1.918 -4.380 9.330 632 HG22 THR 73 HG22 THR 73 2.023 -3.452 10.845 633 HG23 THR 73 HG23 THR 73 1.553 -2.639 9.340 634 H TYR 74 H TYR 74 1.629 -2.623 6.790 635 HA TYR 74 HA TYR 74 1.215 -5.337 6.032 636 HB2 TYR 74 HB2 TYR 74 -0.641 -3.825 6.160 637 HB3 TYR 74 HB3 TYR 74 0.106 -2.709 5.015 638 HD1 TYR 74 HD1 TYR 74 -0.675 -2.684 2.862 639 HD2 TYR 74 HD2 TYR 74 -0.915 -6.355 5.128 640 HE1 TYR 74 HE1 TYR 74 -1.727 -3.803 0.940 641 HE2 TYR 74 HE2 TYR 74 -1.917 -7.499 3.153 642 HH TYR 74 HH TYR 74 -2.423 -5.816 0.035 643 H ILE 75 H ILE 75 2.686 -2.629 4.225 644 HA ILE 75 HA ILE 75 3.153 -3.782 1.715 645 HB ILE 75 HB ILE 75 4.797 -1.919 3.457 646 HG12 ILE 75 HG12 ILE 75 3.326 -1.212 0.892 647 HG13 ILE 75 HG13 ILE 75 2.484 -1.256 2.426 648 HG21 ILE 75 HG21 ILE 75 5.327 -2.586 0.526 649 HG22 ILE 75 HG22 ILE 75 6.107 -1.284 1.454 650 HG23 ILE 75 HG23 ILE 75 6.406 -2.951 1.896 651 HD11 ILE 75 HD11 ILE 75 4.872 0.535 1.774 652 HD12 ILE 75 HD12 ILE 75 3.188 1.030 2.008 653 HD13 ILE 75 HD13 ILE 75 4.124 0.403 3.372 654 H LYS 76 H LYS 76 5.631 -3.843 4.311 655 HA LYS 76 HA LYS 76 7.081 -5.976 3.134 656 HB2 LYS 76 HB2 LYS 76 8.488 -5.922 5.082 657 HB3 LYS 76 HB3 LYS 76 8.069 -4.279 4.600 658 HG2 LYS 76 HG2 LYS 76 6.293 -4.275 6.412 659 HG3 LYS 76 HG3 LYS 76 6.861 -5.877 6.904 660 HD2 LYS 76 HD2 LYS 76 7.876 -4.366 8.396 661 HD3 LYS 76 HD3 LYS 76 9.160 -4.817 7.262 662 HE2 LYS 76 HE2 LYS 76 8.674 -2.703 5.967 663 HE3 LYS 76 HE3 LYS 76 7.446 -2.283 7.171 664 HZ1 LYS 76 HZ1 LYS 76 10.351 -2.627 7.735 665 HZ2 LYS 76 HZ2 LYS 76 9.575 -1.197 7.644 666 HZ3 LYS 76 HZ3 LYS 76 9.223 -2.238 8.852 667 H ASN 77 H ASN 77 4.410 -6.242 5.443 668 HA ASN 77 HA ASN 77 5.033 -9.056 5.990 669 HB2 ASN 77 HB2 ASN 77 2.731 -7.234 6.730 670 HB3 ASN 77 HB3 ASN 77 2.607 -8.976 6.941 671 HD21 ASN 77 HD21 ASN 77 5.190 -6.920 9.359 672 HD22 ASN 77 HD22 ASN 77 4.528 -6.142 7.930 673 H SER 78 H SER 78 3.038 -7.425 3.580 674 HA SER 78 HA SER 78 1.894 -9.918 2.551 675 HB2 SER 78 HB2 SER 78 0.825 -7.646 2.363 676 HB3 SER 78 HB3 SER 78 2.108 -7.196 1.220 677 HG SER 78 HG SER 78 0.178 -7.999 0.193 678 H ASN 79 H ASN 79 4.502 -7.710 1.598 679 HA ASN 79 HA ASN 79 5.904 -9.841 0.104 680 HB2 ASN 79 HB2 ASN 79 6.076 -8.133 -1.868 681 HB3 ASN 79 HB3 ASN 79 4.663 -9.164 -1.701 682 HD21 ASN 79 HD21 ASN 79 4.073 -5.206 -0.754 683 HD22 ASN 79 HD22 ASN 79 5.584 -5.986 -0.278 684 H ARG 80 H ARG 80 7.369 -9.650 1.829 685 HA ARG 80 HA ARG 80 8.903 -7.280 2.377 686 HB2 ARG 80 HB2 ARG 80 8.637 -9.386 3.839 687 HB3 ARG 80 HB3 ARG 80 9.833 -10.157 2.813 688 HG2 ARG 80 HG2 ARG 80 11.512 -8.507 3.433 689 HG3 ARG 80 HG3 ARG 80 10.300 -7.511 4.262 690 HD2 ARG 80 HD2 ARG 80 9.915 -9.265 5.921 691 HD3 ARG 80 HD3 ARG 80 11.055 -10.342 5.111 692 HE ARG 80 HE ARG 80 11.657 -8.038 6.835 693 HH11 ARG 80 HH11 ARG 80 13.742 -7.644 7.467 694 HH12 ARG 80 HH12 ARG 80 15.060 -8.463 6.686 695 HH21 ARG 80 HH21 ARG 80 13.096 -10.253 4.522 696 HH22 ARG 80 HH22 ARG 80 14.712 -9.894 5.061 697 H MET 81 H MET 81 9.569 -10.018 0.288 698 HA MET 81 HA MET 81 11.821 -8.537 -1.046 699 HB2 MET 81 HB2 MET 81 11.644 -11.516 -0.438 700 HB3 MET 81 HB3 MET 81 12.928 -10.718 -1.357 701 HG2 MET 81 HG2 MET 81 13.480 -9.332 0.644 702 HG3 MET 81 HG3 MET 81 12.230 -10.178 1.552 703 HE1 MET 81 HE1 MET 81 15.833 -10.251 0.120 704 HE2 MET 81 HE2 MET 81 16.309 -11.955 0.274 705 HE3 MET 81 HE3 MET 81 15.115 -11.478 -0.950 706 H GLY 82 H GLY 82 8.932 -10.441 -1.515 707 HA2 GLY 82 HA2 GLY 82 7.538 -9.750 -3.352 708 HA3 GLY 82 HA3 GLY 82 8.956 -9.605 -4.384 709 H ARG 83 H ARG 83 10.031 -12.236 -3.519 710 HA ARG 83 HA ARG 83 8.018 -14.194 -4.584 711 HB2 ARG 83 HB2 ARG 83 10.934 -13.871 -5.321 712 HB3 ARG 83 HB3 ARG 83 10.098 -15.423 -5.503 713 HG2 ARG 83 HG2 ARG 83 8.375 -14.438 -6.895 714 HG3 ARG 83 HG3 ARG 83 9.099 -12.828 -6.737 715 HD2 ARG 83 HD2 ARG 83 11.035 -13.462 -7.985 716 HD3 ARG 83 HD3 ARG 83 10.671 -15.179 -7.806 717 HE ARG 83 HE ARG 83 9.319 -15.123 -9.639 718 HH11 ARG 83 HH11 ARG 83 8.163 -14.335 -11.338 719 HH12 ARG 83 HH12 ARG 83 7.920 -12.623 -11.512 720 HH21 ARG 83 HH21 ARG 83 9.663 -11.764 -8.688 721 HH22 ARG 83 HH22 ARG 83 8.732 -11.202 -10.049 722 H THR 84 H THR 84 8.410 -13.470 -1.887 723 HA THR 84 HA THR 84 8.763 -14.283 0.218 724 HB THR 84 HB THR 84 7.811 -16.937 -0.854 725 HG1 THR 84 HG1 THR 84 5.757 -16.034 -0.976 726 HG21 THR 84 HG21 THR 84 6.972 -15.216 1.536 727 HG22 THR 84 HG22 THR 84 6.320 -16.817 1.123 728 HG23 THR 84 HG23 THR 84 8.003 -16.658 1.634 729 H ASN 85 H ASN 85 11.181 -14.301 -1.145 730 HA ASN 85 HA ASN 85 13.193 -15.237 -1.493 731 HB2 ASN 85 HB2 ASN 85 14.434 -15.721 0.506 732 HB3 ASN 85 HB3 ASN 85 13.325 -14.390 0.786 733 HD21 ASN 85 HD21 ASN 85 12.726 -17.940 2.784 734 HD22 ASN 85 HD22 ASN 85 13.589 -17.940 1.241 735 H ASN 86 H ASN 86 11.077 -17.097 -2.298 736 HA ASN 86 HA ASN 86 12.336 -19.722 -1.816 737 HB2 ASN 86 HB2 ASN 86 10.314 -20.626 -1.925 738 HB3 ASN 86 HB3 ASN 86 9.739 -18.989 -1.645 739 HD21 ASN 86 HD21 ASN 86 8.700 -18.625 -5.124 740 HD22 ASN 86 HD22 ASN 86 9.474 -17.690 -3.844 741 H PHE 87 H PHE 87 12.604 -17.402 -4.191 742 HA PHE 87 HA PHE 87 12.566 -18.973 -6.577 743 HB2 PHE 87 HB2 PHE 87 13.073 -16.975 -7.682 744 HB3 PHE 87 HB3 PHE 87 12.092 -16.510 -6.306 745 HD1 PHE 87 HD1 PHE 87 15.229 -16.053 -8.027 746 HD2 PHE 87 HD2 PHE 87 13.275 -15.523 -4.217 747 HE1 PHE 87 HE1 PHE 87 17.039 -14.509 -7.305 748 HE2 PHE 87 HE2 PHE 87 15.094 -14.002 -3.493 749 HZ PHE 87 HZ PHE 87 16.978 -13.489 -5.036 750 H LYS 88 H LYS 88 14.520 -19.834 -4.446 751 HA LYS 88 HA LYS 88 17.231 -19.348 -5.494 752 HB2 LYS 88 HB2 LYS 88 17.911 -20.284 -3.330 753 HB3 LYS 88 HB3 LYS 88 16.722 -18.986 -3.158 754 HG2 LYS 88 HG2 LYS 88 14.952 -20.913 -3.013 755 HG3 LYS 88 HG3 LYS 88 16.339 -21.973 -2.751 756 HD2 LYS 88 HD2 LYS 88 16.915 -20.807 -0.700 757 HD3 LYS 88 HD3 LYS 88 15.831 -19.470 -1.095 758 HE2 LYS 88 HE2 LYS 88 14.662 -20.709 0.530 759 HE3 LYS 88 HE3 LYS 88 13.878 -21.054 -1.011 760 HZ1 LYS 88 HZ1 LYS 88 15.853 -22.822 0.356 761 HZ2 LYS 88 HZ2 LYS 88 14.247 -23.087 0.290 762 HZ3 LYS 88 HZ3 LYS 88 15.139 -23.168 -1.074 763 H THR 89 H THR 89 14.941 -21.605 -6.066 764 HA THR 89 HA THR 89 16.834 -23.819 -6.762 765 HB THR 89 HB THR 89 14.188 -23.997 -5.253 766 HG1 THR 89 HG1 THR 89 15.553 -24.892 -3.646 767 HG21 THR 89 HG21 THR 89 16.088 -26.154 -6.217 768 HG22 THR 89 HG22 THR 89 14.765 -26.407 -5.043 769 HG23 THR 89 HG23 THR 89 14.386 -25.908 -6.698 770 H ILE 90 H ILE 90 13.472 -22.610 -7.044 771 HA ILE 90 HA ILE 90 12.914 -23.859 -9.594 772 HB ILE 90 HB ILE 90 10.969 -22.357 -9.607 773 HG12 ILE 90 HG12 ILE 90 11.915 -21.386 -6.884 774 HG13 ILE 90 HG13 ILE 90 12.013 -20.439 -8.376 775 HG21 ILE 90 HG21 ILE 90 11.318 -23.871 -6.999 776 HG22 ILE 90 HG22 ILE 90 9.797 -23.527 -7.860 777 HG23 ILE 90 HG23 ILE 90 10.982 -24.612 -8.582 778 HD11 ILE 90 HD11 ILE 90 9.476 -21.428 -7.032 779 HD12 ILE 90 HD12 ILE 90 10.046 -19.754 -7.174 780 HD13 ILE 90 HD13 ILE 90 9.530 -20.644 -8.626 781 H LYS 91 H LYS 91 12.335 -22.639 -11.517 782 HA LYS 91 HA LYS 91 12.838 -21.379 -13.357 783 HB2 LYS 91 HB2 LYS 91 13.402 -19.322 -11.205 784 HB3 LYS 91 HB3 LYS 91 13.692 -18.964 -12.879 785 HG2 LYS 91 HG2 LYS 91 11.599 -18.102 -12.091 786 HG3 LYS 91 HG3 LYS 91 11.406 -19.146 -13.485 787 HD2 LYS 91 HD2 LYS 91 10.924 -20.157 -10.666 788 HD3 LYS 91 HD3 LYS 91 9.699 -19.215 -11.493 789 HE2 LYS 91 HE2 LYS 91 10.859 -21.803 -12.603 790 HE3 LYS 91 HE3 LYS 91 9.381 -21.701 -11.652 791 HZ1 LYS 91 HZ1 LYS 91 9.812 -20.403 -14.290 792 HZ2 LYS 91 HZ2 LYS 91 8.872 -21.698 -13.996 793 HZ3 LYS 91 HZ3 LYS 91 8.453 -20.245 -13.387 794 H MET 92 H MET 92 15.443 -22.383 -11.441 795 HA MET 92 HA MET 92 17.489 -21.359 -13.308 796 HB2 MET 92 HB2 MET 92 17.771 -23.122 -10.851 797 HB3 MET 92 HB3 MET 92 19.092 -22.446 -11.814 798 HG2 MET 92 HG2 MET 92 18.057 -20.141 -11.325 799 HG3 MET 92 HG3 MET 92 17.097 -20.954 -10.089 800 HE1 MET 92 HE1 MET 92 19.536 -23.194 -9.171 801 HE2 MET 92 HE2 MET 92 19.947 -22.319 -7.683 802 HE3 MET 92 HE3 MET 92 18.247 -22.469 -8.185 803 H PHE 93 H PHE 93 16.211 -24.597 -12.393 804 HA PHE 93 HA PHE 93 17.727 -25.779 -14.675 805 HB2 PHE 93 HB2 PHE 93 17.777 -27.814 -13.503 806 HB3 PHE 93 HB3 PHE 93 18.265 -26.561 -12.382 807 HD1 PHE 93 HD1 PHE 93 15.661 -29.043 -13.233 808 HD2 PHE 93 HD2 PHE 93 16.850 -25.986 -10.430 809 HE1 PHE 93 HE1 PHE 93 13.971 -29.870 -11.612 810 HE2 PHE 93 HE2 PHE 93 15.164 -26.820 -8.814 811 HZ PHE 93 HZ PHE 93 13.720 -28.759 -9.399 812 H GLU 94 H GLU 94 14.616 -24.800 -14.032 813 HA GLU 94 HA GLU 94 13.124 -26.956 -15.334 814 HB2 GLU 94 HB2 GLU 94 12.391 -24.126 -14.492 815 HB3 GLU 94 HB3 GLU 94 11.253 -25.275 -15.205 816 HG2 GLU 94 HG2 GLU 94 11.556 -26.826 -13.342 817 HG3 GLU 94 HG3 GLU 94 12.798 -25.795 -12.623 818 H ASP 95 H ASP 95 11.855 -26.649 -17.303 819 HA ASP 95 HA ASP 95 13.364 -25.396 -19.475 820 HB2 ASP 95 HB2 ASP 95 10.703 -26.864 -19.420 821 HB3 ASP 95 HB3 ASP 95 11.467 -26.227 -20.874 822 H ASP 96 H ASP 96 13.177 -23.375 -20.125 823 HA ASP 96 HA ASP 96 10.589 -21.931 -20.086 824 HB2 ASP 96 HB2 ASP 96 13.166 -20.964 -18.788 825 HB3 ASP 96 HB3 ASP 96 11.961 -19.847 -19.411 826 H VAL 97 H VAL 97 10.364 -20.442 -21.725 827 HA VAL 97 HA VAL 97 12.444 -20.482 -23.895 828 HB VAL 97 HB VAL 97 9.419 -20.562 -24.211 829 HG11 VAL 97 HG11 VAL 97 11.650 -20.743 -26.285 830 HG12 VAL 97 HG12 VAL 97 9.920 -20.992 -26.602 831 HG13 VAL 97 HG13 VAL 97 10.496 -19.402 -26.101 832 HG21 VAL 97 HG21 VAL 97 10.234 -22.745 -23.426 833 HG22 VAL 97 HG22 VAL 97 9.792 -22.843 -25.129 834 HG23 VAL 97 HG23 VAL 97 11.506 -22.740 -24.667 835 H SER 98 H SER 98 9.687 -18.634 -22.552 836 HA SER 98 HA SER 98 10.860 -16.117 -23.620 837 HB2 SER 98 HB2 SER 98 8.556 -15.235 -23.446 838 HB3 SER 98 HB3 SER 98 8.683 -16.642 -24.514 839 HG SER 98 HG SER 98 6.890 -16.799 -23.076 840 H SER 99 H SER 99 10.955 -17.723 -20.781 841 HA SER 99 HA SER 99 11.121 -15.271 -19.168 842 HB2 SER 99 HB2 SER 99 8.855 -16.537 -18.994 843 HB3 SER 99 HB3 SER 99 9.759 -17.715 -18.029 844 HG SER 99 HG SER 99 8.775 -16.039 -16.765 845 H ALA 100 H ALA 100 13.157 -17.002 -20.354 846 HA ALA 100 HA ALA 100 14.466 -18.449 -18.168 847 HB1 ALA 100 HB1 ALA 100 15.408 -17.736 -20.978 848 HB2 ALA 100 HB2 ALA 100 16.181 -18.890 -19.872 849 HB3 ALA 100 HB3 ALA 100 14.565 -19.233 -20.512 850 H SER 101 H SER 101 16.844 -17.968 -17.776 851 HA SER 101 HA SER 101 17.471 -15.055 -17.600 852 HB2 SER 101 HB2 SER 101 16.559 -15.900 -15.433 853 HB3 SER 101 HB3 SER 101 17.911 -17.047 -15.350 854 HG SER 101 HG SER 101 18.219 -14.983 -14.234 855 H ALA 102 H ALA 102 19.807 -14.719 -17.047 856 HA ALA 102 HA ALA 102 21.410 -16.075 -19.066 857 HB1 ALA 102 HB1 ALA 102 22.049 -13.755 -17.208 858 HB2 ALA 102 HB2 ALA 102 22.971 -14.237 -18.652 859 HB3 ALA 102 HB3 ALA 102 21.318 -13.616 -18.827 860 H GLN 103 H GLN 103 20.741 -17.668 -16.755 861 HA GLN 103 HA GLN 103 21.534 -19.004 -15.074 862 HB2 GLN 103 HB2 GLN 103 23.614 -19.157 -17.248 863 HB3 GLN 103 HB3 GLN 103 23.622 -20.266 -15.864 864 HG2 GLN 103 HG2 GLN 103 21.562 -21.255 -16.452 865 HG3 GLN 103 HG3 GLN 103 21.105 -19.935 -17.526 866 HE21 GLN 103 HE21 GLN 103 22.953 -21.116 -20.329 867 HE22 GLN 103 HE22 GLN 103 22.192 -19.705 -19.599 868 HA PRO 104 HA PRO 104 24.466 -15.926 -13.127 869 HB2 PRO 104 HB2 PRO 104 22.862 -14.585 -11.416 870 HB3 PRO 104 HB3 PRO 104 22.829 -14.265 -13.172 871 HG2 PRO 104 HG2 PRO 104 20.976 -16.113 -11.613 872 HG3 PRO 104 HG3 PRO 104 20.519 -14.772 -12.713 873 HD2 PRO 104 HD2 PRO 104 20.668 -17.361 -13.584 874 HD3 PRO 104 HD3 PRO 104 21.147 -15.983 -14.616 875 H ASN 105 H ASN 105 24.785 -18.457 -12.618 876 HA ASN 105 HA ASN 105 24.888 -18.719 -9.655 877 HB2 ASN 105 HB2 ASN 105 22.877 -19.950 -10.494 878 HB3 ASN 105 HB3 ASN 105 23.917 -20.914 -11.544 879 HD21 ASN 105 HD21 ASN 105 23.904 -21.597 -7.487 880 HD22 ASN 105 HD22 ASN 105 23.244 -20.096 -8.118 881 H LEU 106 H LEU 106 27.017 -18.253 -9.632 882 HA LEU 106 HA LEU 106 28.916 -20.115 -10.998 883 HB2 LEU 106 HB2 LEU 106 28.921 -17.844 -11.928 884 HB3 LEU 106 HB3 LEU 106 29.254 -17.177 -10.332 885 HG LEU 106 HG LEU 106 31.445 -18.407 -10.298 886 HD11 LEU 106 HD11 LEU 106 30.705 -19.129 -13.170 887 HD12 LEU 106 HD12 LEU 106 32.318 -19.312 -12.447 888 HD13 LEU 106 HD13 LEU 106 30.972 -20.269 -11.830 889 HD21 LEU 106 HD21 LEU 106 31.303 -16.072 -11.074 890 HD22 LEU 106 HD22 LEU 106 32.559 -16.965 -11.945 891 HD23 LEU 106 HD23 LEU 106 31.000 -16.633 -12.734 892 HA PRO 107 HA PRO 107 29.448 -20.790 -6.467 893 HB2 PRO 107 HB2 PRO 107 30.097 -23.441 -6.527 894 HB3 PRO 107 HB3 PRO 107 28.417 -22.836 -6.671 895 HG2 PRO 107 HG2 PRO 107 30.304 -23.647 -8.906 896 HG3 PRO 107 HG3 PRO 107 28.593 -24.126 -8.671 897 HD2 PRO 107 HD2 PRO 107 29.322 -22.093 -10.331 898 HD3 PRO 107 HD3 PRO 107 27.808 -22.024 -9.382 Start of MODEL 4 1 H1 GLY -5 H1 GLY -5 1.430 -14.946 49.790 2 H2 GLY -5 H2 GLY -5 0.870 -13.415 49.629 3 H3 GLY -5 H3 GLY -5 -0.036 -14.543 50.397 4 HA2 GLY -5 HA2 GLY -5 0.946 -13.065 52.011 5 HA3 GLY -5 HA3 GLY -5 1.569 -14.715 52.182 6 H SER -4 H SER -4 3.691 -14.611 52.681 7 HA SER -4 HA SER -4 5.458 -12.458 51.836 8 HB2 SER -4 HB2 SER -4 5.606 -13.855 53.982 9 HB3 SER -4 HB3 SER -4 6.309 -15.137 52.967 10 HG SER -4 HG SER -4 7.882 -13.719 53.935 11 H HIS -3 H HIS -3 7.547 -12.904 50.733 12 HA HIS -3 HA HIS -3 7.580 -15.134 48.795 13 HB2 HIS -3 HB2 HIS -3 6.501 -13.045 47.733 14 HB3 HIS -3 HB3 HIS -3 8.103 -12.318 47.797 15 HD2 HIS -3 HD2 HIS -3 10.097 -13.863 46.419 16 HE1 HIS -3 HE1 HIS -3 7.275 -15.568 43.709 17 HE2 HIS -3 HE2 HIS -3 9.750 -15.160 44.147 18 H MET -2 H MET -2 9.515 -16.028 48.703 19 HA MET -2 HA MET -2 11.989 -14.488 49.392 20 HB2 MET -2 HB2 MET -2 11.083 -17.198 50.427 21 HB3 MET -2 HB3 MET -2 12.774 -16.710 50.428 22 HG2 MET -2 HG2 MET -2 10.540 -15.184 51.812 23 HG3 MET -2 HG3 MET -2 11.604 -16.342 52.598 24 HE1 MET -2 HE1 MET -2 14.550 -15.704 51.452 25 HE2 MET -2 HE2 MET -2 15.063 -14.567 52.712 26 HE3 MET -2 HE3 MET -2 14.109 -16.000 53.151 27 H ALA -1 H ALA -1 12.858 -14.272 47.446 28 HA ALA -1 HA ALA -1 13.859 -16.735 46.090 29 HB1 ALA -1 HB1 ALA -1 12.392 -14.456 44.712 30 HB2 ALA -1 HB2 ALA -1 13.288 -15.748 43.879 31 HB3 ALA -1 HB3 ALA -1 11.861 -16.143 44.852 32 H SER 0 H SER 0 14.088 -13.190 46.353 33 HA SER 0 HA SER 0 15.712 -11.671 46.109 34 HB2 SER 0 HB2 SER 0 17.435 -13.857 47.293 35 HB3 SER 0 HB3 SER 0 17.805 -12.122 47.286 36 HG SER 0 HG SER 0 16.791 -12.792 49.243 37 H MET 1 H MET 1 16.229 -14.346 44.095 38 HA MET 1 HA MET 1 18.302 -12.892 42.502 39 HB2 MET 1 HB2 MET 1 17.705 -15.866 42.720 40 HB3 MET 1 HB3 MET 1 18.948 -15.150 41.686 41 HG2 MET 1 HG2 MET 1 20.078 -14.214 43.674 42 HG3 MET 1 HG3 MET 1 18.883 -14.971 44.726 43 HE1 MET 1 HE1 MET 1 18.431 -17.901 43.582 44 HE2 MET 1 HE2 MET 1 19.669 -18.758 44.519 45 HE3 MET 1 HE3 MET 1 18.709 -17.474 45.285 46 H ASP 2 H ASP 2 15.110 -13.805 42.423 47 HA ASP 2 HA ASP 2 14.862 -13.232 39.487 48 HB2 ASP 2 HB2 ASP 2 14.410 -15.621 40.177 49 HB3 ASP 2 HB3 ASP 2 13.095 -15.036 41.189 50 H GLN 3 H GLN 3 14.801 -11.605 42.046 51 HA GLN 3 HA GLN 3 12.078 -10.400 42.157 52 HB2 GLN 3 HB2 GLN 3 12.084 -12.619 43.209 53 HB3 GLN 3 HB3 GLN 3 13.443 -12.180 44.217 54 HG2 GLN 3 HG2 GLN 3 11.102 -10.394 44.593 55 HG3 GLN 3 HG3 GLN 3 10.709 -12.082 44.822 56 HE21 GLN 3 HE21 GLN 3 13.196 -10.305 47.555 57 HE22 GLN 3 HE22 GLN 3 12.792 -9.462 46.056 58 H LEU 4 H LEU 4 15.185 -9.604 41.981 59 HA LEU 4 HA LEU 4 14.922 -7.248 43.728 60 HB2 LEU 4 HB2 LEU 4 16.299 -9.538 44.627 61 HB3 LEU 4 HB3 LEU 4 17.579 -8.540 43.963 62 HG LEU 4 HG LEU 4 16.745 -6.639 45.437 63 HD11 LEU 4 HD11 LEU 4 15.039 -8.888 46.595 64 HD12 LEU 4 HD12 LEU 4 15.280 -7.298 47.360 65 HD13 LEU 4 HD13 LEU 4 14.420 -7.424 45.818 66 HD21 LEU 4 HD21 LEU 4 18.641 -8.083 46.098 67 HD22 LEU 4 HD22 LEU 4 17.681 -7.612 47.512 68 HD23 LEU 4 HD23 LEU 4 17.512 -9.246 46.828 69 H ASP 5 H ASP 5 15.788 -5.480 42.895 70 HA ASP 5 HA ASP 5 16.532 -4.029 41.358 71 HB2 ASP 5 HB2 ASP 5 18.902 -5.913 41.287 72 HB3 ASP 5 HB3 ASP 5 18.900 -4.263 40.671 73 H GLU 6 H GLU 6 15.041 -6.499 40.198 74 HA GLU 6 HA GLU 6 15.847 -6.250 37.359 75 HB2 GLU 6 HB2 GLU 6 15.803 -8.479 38.487 76 HB3 GLU 6 HB3 GLU 6 14.054 -8.310 38.700 77 HG2 GLU 6 HG2 GLU 6 13.835 -8.026 36.219 78 HG3 GLU 6 HG3 GLU 6 15.578 -8.226 36.061 79 H ILE 7 H ILE 7 14.946 -4.164 37.096 80 HA ILE 7 HA ILE 7 11.997 -4.184 36.619 81 HB ILE 7 HB ILE 7 13.506 -1.679 37.439 82 HG12 ILE 7 HG12 ILE 7 11.879 -1.998 39.534 83 HG13 ILE 7 HG13 ILE 7 12.053 -3.705 39.164 84 HG21 ILE 7 HG21 ILE 7 10.531 -2.360 37.233 85 HG22 ILE 7 HG22 ILE 7 11.221 -0.789 37.694 86 HG23 ILE 7 HG23 ILE 7 11.442 -1.392 36.055 87 HD11 ILE 7 HD11 ILE 7 14.283 -1.714 39.804 88 HD12 ILE 7 HD12 ILE 7 13.657 -2.984 40.874 89 HD13 ILE 7 HD13 ILE 7 14.558 -3.421 39.418 90 H ILE 8 H ILE 8 12.833 -5.176 34.677 91 HA ILE 8 HA ILE 8 13.517 -3.187 32.561 92 HB ILE 8 HB ILE 8 14.669 -5.997 32.795 93 HG12 ILE 8 HG12 ILE 8 16.023 -3.270 33.075 94 HG13 ILE 8 HG13 ILE 8 15.743 -4.429 34.377 95 HG21 ILE 8 HG21 ILE 8 15.141 -3.834 30.683 96 HG22 ILE 8 HG22 ILE 8 15.944 -5.418 30.749 97 HG23 ILE 8 HG23 ILE 8 14.229 -5.340 30.436 98 HD11 ILE 8 HD11 ILE 8 17.662 -4.772 32.056 99 HD12 ILE 8 HD12 ILE 8 18.028 -4.604 33.775 100 HD13 ILE 8 HD13 ILE 8 17.224 -6.075 33.193 101 H GLU 9 H GLU 9 12.334 -3.369 30.723 102 HA GLU 9 HA GLU 9 10.493 -5.638 30.291 103 HB2 GLU 9 HB2 GLU 9 9.387 -3.884 31.793 104 HB3 GLU 9 HB3 GLU 9 9.538 -2.742 30.463 105 HG2 GLU 9 HG2 GLU 9 7.287 -3.639 30.578 106 HG3 GLU 9 HG3 GLU 9 8.037 -4.142 29.078 107 H GLN 10 H GLN 10 9.545 -5.620 28.109 108 HA GLN 10 HA GLN 10 11.387 -4.828 26.057 109 HB2 GLN 10 HB2 GLN 10 9.942 -6.753 25.802 110 HB3 GLN 10 HB3 GLN 10 8.490 -5.739 25.901 111 HG2 GLN 10 HG2 GLN 10 9.059 -4.607 23.818 112 HG3 GLN 10 HG3 GLN 10 10.630 -5.403 23.756 113 HE21 GLN 10 HE21 GLN 10 9.304 -8.468 22.425 114 HE22 GLN 10 HE22 GLN 10 10.706 -7.722 23.179 115 H ILE 11 H ILE 11 11.390 -3.206 24.565 116 HA ILE 11 HA ILE 11 9.412 -1.049 24.652 117 HB ILE 11 HB ILE 11 11.236 0.632 24.620 118 HG12 ILE 11 HG12 ILE 11 13.049 -1.619 25.621 119 HG13 ILE 11 HG13 ILE 11 13.160 -0.863 24.033 120 HG21 ILE 11 HG21 ILE 11 11.122 -1.055 27.151 121 HG22 ILE 11 HG22 ILE 11 11.382 0.705 27.048 122 HG23 ILE 11 HG23 ILE 11 9.817 0.006 26.600 123 HD11 ILE 11 HD11 ILE 11 13.656 0.506 26.698 124 HD12 ILE 11 HD12 ILE 11 14.841 0.084 25.456 125 HD13 ILE 11 HD13 ILE 11 13.626 1.332 25.115 126 H GLN 12 H GLN 12 8.941 -0.316 22.811 127 HA GLN 12 HA GLN 12 10.519 -0.934 20.338 128 HB2 GLN 12 HB2 GLN 12 7.513 -1.288 20.609 129 HB3 GLN 12 HB3 GLN 12 8.461 -1.555 19.161 130 HG2 GLN 12 HG2 GLN 12 9.104 -3.646 19.802 131 HG3 GLN 12 HG3 GLN 12 9.301 -3.226 21.496 132 HE21 GLN 12 HE21 GLN 12 5.799 -3.748 22.316 133 HE22 GLN 12 HE22 GLN 12 7.121 -2.666 22.705 134 H LYS 13 H LYS 13 7.329 0.540 20.789 135 HA LYS 13 HA LYS 13 8.264 3.297 20.330 136 HB2 LYS 13 HB2 LYS 13 8.048 2.038 18.109 137 HB3 LYS 13 HB3 LYS 13 6.310 1.979 18.390 138 HG2 LYS 13 HG2 LYS 13 6.137 4.391 18.184 139 HG3 LYS 13 HG3 LYS 13 7.880 4.592 18.384 140 HD2 LYS 13 HD2 LYS 13 7.249 4.941 16.054 141 HD3 LYS 13 HD3 LYS 13 8.313 3.556 16.229 142 HE2 LYS 13 HE2 LYS 13 6.667 2.960 14.628 143 HE3 LYS 13 HE3 LYS 13 6.322 2.025 16.078 144 HZ1 LYS 13 HZ1 LYS 13 4.918 4.562 15.418 145 HZ2 LYS 13 HZ2 LYS 13 4.354 3.102 14.964 146 HZ3 LYS 13 HZ3 LYS 13 4.486 3.477 16.562 147 H GLU 14 H GLU 14 6.841 1.821 22.537 148 HA GLU 14 HA GLU 14 4.061 2.558 22.429 149 HB2 GLU 14 HB2 GLU 14 5.176 0.719 23.889 150 HB3 GLU 14 HB3 GLU 14 5.546 2.040 25.006 151 HG2 GLU 14 HG2 GLU 14 2.906 2.547 24.671 152 HG3 GLU 14 HG3 GLU 14 2.878 0.862 24.203 153 H ALA 15 H ALA 15 6.892 4.212 23.496 154 HA ALA 15 HA ALA 15 7.346 6.096 24.699 155 HB1 ALA 15 HB1 ALA 15 4.948 7.172 23.173 156 HB2 ALA 15 HB2 ALA 15 6.279 8.123 23.866 157 HB3 ALA 15 HB3 ALA 15 6.598 7.000 22.531 158 H ILE 16 H ILE 16 5.718 4.208 26.126 159 HA ILE 16 HA ILE 16 4.470 3.862 27.948 160 HB ILE 16 HB ILE 16 5.508 6.606 28.667 161 HG12 ILE 16 HG12 ILE 16 6.985 4.948 30.216 162 HG13 ILE 16 HG13 ILE 16 6.607 3.796 28.952 163 HG21 ILE 16 HG21 ILE 16 4.249 4.605 30.549 164 HG22 ILE 16 HG22 ILE 16 5.253 5.979 31.066 165 HG23 ILE 16 HG23 ILE 16 3.759 6.288 30.221 166 HD11 ILE 16 HD11 ILE 16 7.946 6.514 28.527 167 HD12 ILE 16 HD12 ILE 16 8.803 4.973 28.712 168 HD13 ILE 16 HD13 ILE 16 7.774 5.230 27.304 169 H ASN 17 H ASN 17 3.236 5.447 25.618 170 HA ASN 17 HA ASN 17 1.158 6.920 26.882 171 HB2 ASN 17 HB2 ASN 17 0.699 7.738 24.825 172 HB3 ASN 17 HB3 ASN 17 2.236 7.005 24.386 173 HD21 ASN 17 HD21 ASN 17 0.624 4.341 22.521 174 HD22 ASN 17 HD22 ASN 17 2.092 4.761 23.404 175 H SER 18 H SER 18 1.381 3.567 26.330 176 HA SER 18 HA SER 18 -1.580 3.185 26.162 177 HB2 SER 18 HB2 SER 18 0.630 1.135 25.835 178 HB3 SER 18 HB3 SER 18 -1.106 0.868 25.622 179 HG SER 18 HG SER 18 -0.088 1.265 23.622 180 H ASN 19 H ASN 19 1.194 2.074 28.191 181 HA ASN 19 HA ASN 19 -0.595 0.659 29.948 182 HB2 ASN 19 HB2 ASN 19 1.303 -0.029 31.143 183 HB3 ASN 19 HB3 ASN 19 1.806 0.050 29.460 184 HD21 ASN 19 HD21 ASN 19 4.193 2.633 30.079 185 HD22 ASN 19 HD22 ASN 19 3.228 1.877 28.808 186 H VAL 20 H VAL 20 0.138 3.951 29.891 187 HA VAL 20 HA VAL 20 -0.742 4.412 32.705 188 HB VAL 20 HB VAL 20 0.295 6.322 30.586 189 HG11 VAL 20 HG11 VAL 20 -0.462 6.881 33.489 190 HG12 VAL 20 HG12 VAL 20 0.443 7.987 32.432 191 HG13 VAL 20 HG13 VAL 20 -1.226 7.582 32.044 192 HG21 VAL 20 HG21 VAL 20 2.020 4.830 31.556 193 HG22 VAL 20 HG22 VAL 20 2.241 6.489 32.124 194 HG23 VAL 20 HG23 VAL 20 1.503 5.278 33.194 195 H VAL 21 H VAL 21 -1.985 4.664 29.405 196 HA VAL 21 HA VAL 21 -4.624 5.576 30.480 197 HB VAL 21 HB VAL 21 -3.429 6.560 27.864 198 HG11 VAL 21 HG11 VAL 21 -5.914 7.390 29.441 199 HG12 VAL 21 HG12 VAL 21 -5.335 8.135 27.936 200 HG13 VAL 21 HG13 VAL 21 -5.917 6.470 27.921 201 HG21 VAL 21 HG21 VAL 21 -2.177 7.617 29.670 202 HG22 VAL 21 HG22 VAL 21 -3.309 8.779 28.988 203 HG23 VAL 21 HG23 VAL 21 -3.683 7.997 30.540 204 H LEU 22 H LEU 22 -5.312 3.455 30.543 205 HA LEU 22 HA LEU 22 -6.109 2.318 27.918 206 HB2 LEU 22 HB2 LEU 22 -4.098 1.221 29.625 207 HB3 LEU 22 HB3 LEU 22 -5.505 0.207 29.857 208 HG LEU 22 HG LEU 22 -4.268 0.881 27.146 209 HD11 LEU 22 HD11 LEU 22 -4.120 -1.666 28.817 210 HD12 LEU 22 HD12 LEU 22 -3.436 -1.433 27.191 211 HD13 LEU 22 HD13 LEU 22 -2.793 -0.513 28.558 212 HD21 LEU 22 HD21 LEU 22 -6.640 0.319 26.886 213 HD22 LEU 22 HD22 LEU 22 -5.656 -1.034 26.340 214 HD23 LEU 22 HD23 LEU 22 -6.442 -1.117 27.929 215 H LYS 23 H LYS 23 -8.183 1.791 27.814 216 HA LYS 23 HA LYS 23 -9.759 1.135 30.250 217 HB2 LYS 23 HB2 LYS 23 -9.878 3.634 28.722 218 HB3 LYS 23 HB3 LYS 23 -11.435 2.829 28.670 219 HG2 LYS 23 HG2 LYS 23 -11.454 2.645 31.135 220 HG3 LYS 23 HG3 LYS 23 -9.869 3.438 31.213 221 HD2 LYS 23 HD2 LYS 23 -10.811 5.459 30.143 222 HD3 LYS 23 HD3 LYS 23 -12.405 4.703 30.065 223 HE2 LYS 23 HE2 LYS 23 -10.851 5.224 32.644 224 HE3 LYS 23 HE3 LYS 23 -12.047 6.334 31.971 225 HZ1 LYS 23 HZ1 LYS 23 -12.628 3.555 32.849 226 HZ2 LYS 23 HZ2 LYS 23 -13.052 4.914 33.642 227 HZ3 LYS 23 HZ3 LYS 23 -13.723 4.580 32.195 228 H ASN 24 H ASN 24 -8.818 -0.352 27.764 229 HA ASN 24 HA ASN 24 -11.424 -1.666 27.159 230 HB2 ASN 24 HB2 ASN 24 -10.995 -0.038 25.370 231 HB3 ASN 24 HB3 ASN 24 -9.399 -0.740 25.082 232 HD21 ASN 24 HD21 ASN 24 -12.708 -2.921 23.944 233 HD22 ASN 24 HD22 ASN 24 -12.834 -1.877 25.352 234 HA PRO 25 HA PRO 25 -8.224 -4.857 28.008 235 HB2 PRO 25 HB2 PRO 25 -9.182 -6.032 30.252 236 HB3 PRO 25 HB3 PRO 25 -8.376 -4.439 30.297 237 HG2 PRO 25 HG2 PRO 25 -11.367 -4.985 30.193 238 HG3 PRO 25 HG3 PRO 25 -10.478 -3.931 31.338 239 HD2 PRO 25 HD2 PRO 25 -11.681 -2.975 29.059 240 HD3 PRO 25 HD3 PRO 25 -10.180 -2.266 29.727 241 H ARG 26 H ARG 26 -9.446 -5.215 25.901 242 HA ARG 26 HA ARG 26 -10.916 -7.844 25.982 243 HB2 ARG 26 HB2 ARG 26 -11.685 -5.297 24.527 244 HB3 ARG 26 HB3 ARG 26 -12.205 -6.889 23.954 245 HG2 ARG 26 HG2 ARG 26 -13.264 -7.365 26.127 246 HG3 ARG 26 HG3 ARG 26 -12.812 -5.754 26.718 247 HD2 ARG 26 HD2 ARG 26 -14.206 -4.659 25.102 248 HD3 ARG 26 HD3 ARG 26 -14.449 -6.136 24.177 249 HE ARG 26 HE ARG 26 -15.807 -5.342 26.671 250 HH11 ARG 26 HH11 ARG 26 -17.604 -6.486 27.306 251 HH12 ARG 26 HH12 ARG 26 -17.974 -8.013 26.560 252 HH21 ARG 26 HH21 ARG 26 -15.283 -8.004 24.441 253 HH22 ARG 26 HH22 ARG 26 -16.704 -8.851 24.983 254 H VAL 27 H VAL 27 -9.273 -5.645 23.721 255 HA VAL 27 HA VAL 27 -8.285 -6.015 21.704 256 HB VAL 27 HB VAL 27 -6.713 -7.911 23.449 257 HG11 VAL 27 HG11 VAL 27 -5.842 -6.147 21.094 258 HG12 VAL 27 HG12 VAL 27 -4.760 -7.132 22.101 259 HG13 VAL 27 HG13 VAL 27 -5.933 -7.919 21.056 260 HG21 VAL 27 HG21 VAL 27 -6.968 -5.808 24.650 261 HG22 VAL 27 HG22 VAL 27 -5.333 -5.916 24.015 262 HG23 VAL 27 HG23 VAL 27 -6.524 -4.885 23.195 263 HA PRO 28 HA PRO 28 -10.434 -9.996 20.631 264 HB2 PRO 28 HB2 PRO 28 -12.346 -9.142 18.901 265 HB3 PRO 28 HB3 PRO 28 -12.529 -9.063 20.682 266 HG2 PRO 28 HG2 PRO 28 -11.669 -6.849 18.798 267 HG3 PRO 28 HG3 PRO 28 -12.876 -6.767 20.116 268 HD2 PRO 28 HD2 PRO 28 -10.286 -5.928 20.449 269 HD3 PRO 28 HD3 PRO 28 -11.219 -6.689 21.769 270 H THR 29 H THR 29 -10.550 -11.214 18.731 271 HA THR 29 HA THR 29 -8.301 -10.859 16.959 272 HB THR 29 HB THR 29 -9.102 -13.195 16.219 273 HG1 THR 29 HG1 THR 29 -10.537 -14.181 17.631 274 HG21 THR 29 HG21 THR 29 -8.448 -12.745 19.164 275 HG22 THR 29 HG22 THR 29 -8.237 -14.260 18.257 276 HG23 THR 29 HG23 THR 29 -7.266 -12.840 17.840 277 H GLN 30 H GLN 30 -9.472 -8.879 16.179 278 HA GLN 30 HA GLN 30 -11.466 -9.275 14.157 279 HB2 GLN 30 HB2 GLN 30 -11.579 -6.839 14.119 280 HB3 GLN 30 HB3 GLN 30 -11.453 -7.419 15.777 281 HG2 GLN 30 HG2 GLN 30 -8.825 -7.022 15.378 282 HG3 GLN 30 HG3 GLN 30 -9.399 -5.953 14.104 283 HE21 GLN 30 HE21 GLN 30 -9.835 -4.910 18.049 284 HE22 GLN 30 HE22 GLN 30 -9.358 -6.557 17.625 285 H LYS 31 H LYS 31 -8.882 -10.453 13.505 286 HA LYS 31 HA LYS 31 -7.644 -8.817 11.411 287 HB2 LYS 31 HB2 LYS 31 -6.425 -9.997 13.231 288 HB3 LYS 31 HB3 LYS 31 -6.950 -11.535 12.591 289 HG2 LYS 31 HG2 LYS 31 -4.603 -10.957 12.052 290 HG3 LYS 31 HG3 LYS 31 -5.567 -11.299 10.627 291 HD2 LYS 31 HD2 LYS 31 -3.944 -9.404 10.418 292 HD3 LYS 31 HD3 LYS 31 -5.602 -9.009 9.958 293 HE2 LYS 31 HE2 LYS 31 -5.988 -7.702 11.877 294 HE3 LYS 31 HE3 LYS 31 -4.655 -8.434 12.778 295 HZ1 LYS 31 HZ1 LYS 31 -4.177 -6.777 10.359 296 HZ2 LYS 31 HZ2 LYS 31 -4.179 -6.150 11.880 297 HZ3 LYS 31 HZ3 LYS 31 -3.075 -7.278 11.440 298 H THR 32 H THR 32 -9.767 -8.959 10.254 299 HA THR 32 HA THR 32 -9.773 -11.152 8.230 300 HB THR 32 HB THR 32 -11.000 -11.851 10.268 301 HG1 THR 32 HG1 THR 32 -12.811 -12.590 9.218 302 HG21 THR 32 HG21 THR 32 -12.963 -9.627 9.585 303 HG22 THR 32 HG22 THR 32 -13.171 -10.882 10.828 304 HG23 THR 32 HG23 THR 32 -11.886 -9.679 10.998 305 H GLY 33 H GLY 33 -9.608 -8.006 8.333 306 HA2 GLY 33 HA2 GLY 33 -11.489 -7.481 6.066 307 HA3 GLY 33 HA3 GLY 33 -11.643 -6.545 7.551 308 H GLU 34 H GLU 34 -8.526 -7.524 6.098 309 HA GLU 34 HA GLU 34 -7.610 -4.793 6.396 310 HB2 GLU 34 HB2 GLU 34 -6.154 -7.182 5.216 311 HB3 GLU 34 HB3 GLU 34 -5.437 -5.638 5.702 312 HG2 GLU 34 HG2 GLU 34 -6.365 -6.068 8.043 313 HG3 GLU 34 HG3 GLU 34 -6.745 -7.709 7.513 314 H LEU 35 H LEU 35 -8.051 -6.811 3.479 315 HA LEU 35 HA LEU 35 -8.347 -4.422 1.802 316 HB2 LEU 35 HB2 LEU 35 -6.173 -6.504 1.360 317 HB3 LEU 35 HB3 LEU 35 -6.942 -5.658 0.034 318 HG LEU 35 HG LEU 35 -6.306 -3.464 1.390 319 HD11 LEU 35 HD11 LEU 35 -4.204 -5.476 2.288 320 HD12 LEU 35 HD12 LEU 35 -4.030 -3.706 2.386 321 HD13 LEU 35 HD13 LEU 35 -5.252 -4.525 3.344 322 HD21 LEU 35 HD21 LEU 35 -5.580 -4.039 -0.893 323 HD22 LEU 35 HD22 LEU 35 -4.244 -3.370 0.045 324 HD23 LEU 35 HD23 LEU 35 -4.335 -5.119 -0.237 325 H SER 36 H SER 36 -9.852 -4.650 0.429 326 HA SER 36 HA SER 36 -11.308 -7.205 0.031 327 HB2 SER 36 HB2 SER 36 -13.137 -5.803 -0.793 328 HB3 SER 36 HB3 SER 36 -12.646 -5.400 0.859 329 HG SER 36 HG SER 36 -12.978 -3.553 -0.525 330 H GLU 37 H GLU 37 -11.246 -4.597 -2.253 331 HA GLU 37 HA GLU 37 -9.808 -6.142 -4.325 332 HB2 GLU 37 HB2 GLU 37 -11.699 -6.580 -5.680 333 HB3 GLU 37 HB3 GLU 37 -12.090 -7.123 -4.036 334 HG2 GLU 37 HG2 GLU 37 -13.378 -5.022 -3.676 335 HG3 GLU 37 HG3 GLU 37 -13.098 -4.593 -5.369 336 H GLU 38 H GLU 38 -11.789 -3.284 -3.556 337 HA GLU 38 HA GLU 38 -10.733 -1.596 -5.683 338 HB2 GLU 38 HB2 GLU 38 -11.981 -0.992 -2.962 339 HB3 GLU 38 HB3 GLU 38 -11.516 0.251 -4.131 340 HG2 GLU 38 HG2 GLU 38 -13.045 -0.674 -5.800 341 HG3 GLU 38 HG3 GLU 38 -13.519 -1.971 -4.696 342 H GLN 39 H GLN 39 -9.693 -2.520 -2.450 343 HA GLN 39 HA GLN 39 -7.690 -0.468 -2.118 344 HB2 GLN 39 HB2 GLN 39 -8.221 -3.084 -0.680 345 HB3 GLN 39 HB3 GLN 39 -7.069 -1.847 -0.146 346 HG2 GLN 39 HG2 GLN 39 -8.832 -0.187 0.115 347 HG3 GLN 39 HG3 GLN 39 -10.031 -1.227 -0.633 348 HE21 GLN 39 HE21 GLN 39 -10.702 -3.108 2.273 349 HE22 GLN 39 HE22 GLN 39 -10.926 -3.051 0.528 350 H LYS 40 H LYS 40 -7.600 -3.743 -3.432 351 HA LYS 40 HA LYS 40 -4.761 -3.856 -4.022 352 HB2 LYS 40 HB2 LYS 40 -7.282 -5.207 -4.940 353 HB3 LYS 40 HB3 LYS 40 -5.948 -5.263 -6.077 354 HG2 LYS 40 HG2 LYS 40 -4.717 -6.675 -4.899 355 HG3 LYS 40 HG3 LYS 40 -5.048 -5.923 -3.348 356 HD2 LYS 40 HD2 LYS 40 -7.403 -7.328 -4.558 357 HD3 LYS 40 HD3 LYS 40 -6.026 -8.373 -4.135 358 HE2 LYS 40 HE2 LYS 40 -5.988 -7.258 -1.857 359 HE3 LYS 40 HE3 LYS 40 -7.505 -6.447 -2.290 360 HZ1 LYS 40 HZ1 LYS 40 -7.192 -9.410 -2.296 361 HZ2 LYS 40 HZ2 LYS 40 -7.764 -8.578 -1.009 362 HZ3 LYS 40 HZ3 LYS 40 -8.594 -8.549 -2.401 363 H LYS 41 H LYS 41 -7.489 -2.626 -5.929 364 HA LYS 41 HA LYS 41 -5.928 -1.675 -8.151 365 HB2 LYS 41 HB2 LYS 41 -8.533 -0.497 -7.104 366 HB3 LYS 41 HB3 LYS 41 -7.788 -0.139 -8.651 367 HG2 LYS 41 HG2 LYS 41 -8.035 -2.475 -9.373 368 HG3 LYS 41 HG3 LYS 41 -8.768 -2.896 -7.816 369 HD2 LYS 41 HD2 LYS 41 -10.596 -1.250 -8.238 370 HD3 LYS 41 HD3 LYS 41 -9.871 -0.874 -9.816 371 HE2 LYS 41 HE2 LYS 41 -10.144 -3.258 -10.492 372 HE3 LYS 41 HE3 LYS 41 -10.891 -3.611 -8.926 373 HZ1 LYS 41 HZ1 LYS 41 -11.978 -1.717 -10.947 374 HZ2 LYS 41 HZ2 LYS 41 -12.569 -3.205 -10.638 375 HZ3 LYS 41 HZ3 LYS 41 -12.672 -2.039 -9.503 376 H ILE 42 H ILE 42 -5.814 -0.510 -4.959 377 HA ILE 42 HA ILE 42 -4.358 1.940 -5.838 378 HB ILE 42 HB ILE 42 -5.310 1.088 -3.098 379 HG12 ILE 42 HG12 ILE 42 -6.232 3.688 -4.185 380 HG13 ILE 42 HG13 ILE 42 -6.758 2.350 -5.176 381 HG21 ILE 42 HG21 ILE 42 -3.816 3.622 -3.912 382 HG22 ILE 42 HG22 ILE 42 -4.531 3.308 -2.319 383 HG23 ILE 42 HG23 ILE 42 -3.194 2.321 -2.878 384 HD11 ILE 42 HD11 ILE 42 -7.216 2.465 -2.167 385 HD12 ILE 42 HD12 ILE 42 -8.409 2.908 -3.416 386 HD13 ILE 42 HD13 ILE 42 -7.820 1.252 -3.296 387 H VAL 43 H VAL 43 -3.829 -0.872 -3.576 388 HA VAL 43 HA VAL 43 -1.043 -0.244 -3.288 389 HB VAL 43 HB VAL 43 -2.444 -2.873 -2.678 390 HG11 VAL 43 HG11 VAL 43 0.209 -1.767 -1.636 391 HG12 VAL 43 HG12 VAL 43 -0.567 -3.295 -1.159 392 HG13 VAL 43 HG13 VAL 43 0.050 -3.116 -2.782 393 HG21 VAL 43 HG21 VAL 43 -3.438 -1.026 -1.405 394 HG22 VAL 43 HG22 VAL 43 -2.454 -2.028 -0.340 395 HG23 VAL 43 HG23 VAL 43 -1.827 -0.476 -0.903 396 H ALA 44 H ALA 44 -2.559 -2.940 -5.176 397 HA ALA 44 HA ALA 44 -0.012 -3.943 -6.088 398 HB1 ALA 44 HB1 ALA 44 -2.805 -4.376 -7.235 399 HB2 ALA 44 HB2 ALA 44 -1.366 -5.363 -7.544 400 HB3 ALA 44 HB3 ALA 44 -2.071 -5.322 -5.917 401 H ASP 45 H ASP 45 -2.345 -1.621 -7.362 402 HA ASP 45 HA ASP 45 -1.098 -1.104 -9.890 403 HB2 ASP 45 HB2 ASP 45 -3.375 -0.387 -9.197 404 HB3 ASP 45 HB3 ASP 45 -2.652 0.809 -8.116 405 H TYR 46 H TYR 46 -0.317 0.202 -6.634 406 HA TYR 46 HA TYR 46 1.699 2.071 -7.589 407 HB2 TYR 46 HB2 TYR 46 0.292 1.886 -5.330 408 HB3 TYR 46 HB3 TYR 46 1.647 0.923 -4.787 409 HD1 TYR 46 HD1 TYR 46 3.743 2.770 -6.431 410 HD2 TYR 46 HD2 TYR 46 0.593 3.496 -3.597 411 HE1 TYR 46 HE1 TYR 46 4.742 4.930 -5.932 412 HE2 TYR 46 HE2 TYR 46 1.690 5.640 -2.943 413 HH TYR 46 HH TYR 46 4.653 6.832 -4.577 414 H ILE 47 H ILE 47 1.783 -1.312 -6.372 415 HA ILE 47 HA ILE 47 4.643 -1.686 -6.607 416 HB ILE 47 HB ILE 47 2.207 -3.438 -6.485 417 HG12 ILE 47 HG12 ILE 47 3.170 -4.331 -4.521 418 HG13 ILE 47 HG13 ILE 47 4.784 -3.773 -4.934 419 HG21 ILE 47 HG21 ILE 47 4.957 -4.498 -7.175 420 HG22 ILE 47 HG22 ILE 47 3.576 -5.480 -6.649 421 HG23 ILE 47 HG23 ILE 47 3.489 -4.616 -8.192 422 HD11 ILE 47 HD11 ILE 47 2.494 -1.981 -4.039 423 HD12 ILE 47 HD12 ILE 47 3.899 -2.494 -3.078 424 HD13 ILE 47 HD13 ILE 47 4.124 -1.444 -4.486 425 H SER 48 H SER 48 2.058 -1.771 -9.035 426 HA SER 48 HA SER 48 3.916 -2.281 -11.235 427 HB2 SER 48 HB2 SER 48 1.010 -1.431 -11.194 428 HB3 SER 48 HB3 SER 48 1.943 -1.759 -12.665 429 HG SER 48 HG SER 48 0.773 -3.606 -11.921 430 H GLU 49 H GLU 49 3.533 0.544 -9.375 431 HA GLU 49 HA GLU 49 3.956 2.378 -11.672 432 HB2 GLU 49 HB2 GLU 49 2.156 2.813 -9.995 433 HB3 GLU 49 HB3 GLU 49 3.401 2.972 -8.745 434 HG2 GLU 49 HG2 GLU 49 4.400 4.844 -9.931 435 HG3 GLU 49 HG3 GLU 49 3.226 4.667 -11.248 436 H VAL 50 H VAL 50 5.524 1.328 -8.618 437 HA VAL 50 HA VAL 50 8.009 2.777 -9.471 438 HB VAL 50 HB VAL 50 6.432 3.823 -7.691 439 HG11 VAL 50 HG11 VAL 50 7.831 1.860 -5.864 440 HG12 VAL 50 HG12 VAL 50 6.797 3.232 -5.423 441 HG13 VAL 50 HG13 VAL 50 6.108 1.854 -6.297 442 HG21 VAL 50 HG21 VAL 50 8.506 4.807 -8.264 443 HG22 VAL 50 HG22 VAL 50 8.364 4.790 -6.501 444 HG23 VAL 50 HG23 VAL 50 9.423 3.621 -7.334 445 H GLY 51 H GLY 51 6.805 -0.171 -8.014 446 HA2 GLY 51 HA2 GLY 51 8.640 -1.967 -8.670 447 HA3 GLY 51 HA3 GLY 51 9.560 -1.143 -7.400 448 H LEU 52 H LEU 52 8.775 -1.072 -5.327 449 HA LEU 52 HA LEU 52 6.490 -2.516 -4.341 450 HB2 LEU 52 HB2 LEU 52 7.907 -4.448 -4.943 451 HB3 LEU 52 HB3 LEU 52 9.260 -3.816 -4.028 452 HG LEU 52 HG LEU 52 6.714 -4.138 -2.519 453 HD11 LEU 52 HD11 LEU 52 8.350 -6.535 -3.449 454 HD12 LEU 52 HD12 LEU 52 7.028 -6.597 -2.273 455 HD13 LEU 52 HD13 LEU 52 6.675 -6.156 -3.945 456 HD21 LEU 52 HD21 LEU 52 8.743 -3.518 -1.291 457 HD22 LEU 52 HD22 LEU 52 8.215 -5.120 -0.798 458 HD23 LEU 52 HD23 LEU 52 9.585 -4.958 -1.911 459 H ASN 53 H ASN 53 9.727 -1.481 -3.631 460 HA ASN 53 HA ASN 53 9.076 -0.762 -0.867 461 HB2 ASN 53 HB2 ASN 53 11.380 -1.117 -0.435 462 HB3 ASN 53 HB3 ASN 53 10.870 -2.397 -1.534 463 HD21 ASN 53 HD21 ASN 53 13.208 -1.496 -4.017 464 HD22 ASN 53 HD22 ASN 53 11.960 -2.620 -3.517 465 H ASN 54 H ASN 54 9.344 1.071 -3.720 466 HA ASN 54 HA ASN 54 10.698 3.340 -2.400 467 HB2 ASN 54 HB2 ASN 54 9.665 3.034 -5.222 468 HB3 ASN 54 HB3 ASN 54 10.698 4.333 -4.640 469 HD21 ASN 54 HD21 ASN 54 12.382 0.923 -5.922 470 HD22 ASN 54 HD22 ASN 54 10.706 1.338 -6.232 471 H LEU 55 H LEU 55 7.478 2.283 -3.010 472 HA LEU 55 HA LEU 55 6.107 4.743 -3.226 473 HB2 LEU 55 HB2 LEU 55 4.129 3.446 -2.876 474 HB3 LEU 55 HB3 LEU 55 5.246 2.569 -3.888 475 HG LEU 55 HG LEU 55 5.882 1.429 -1.498 476 HD11 LEU 55 HD11 LEU 55 2.961 2.311 -1.279 477 HD12 LEU 55 HD12 LEU 55 3.690 1.010 -0.332 478 HD13 LEU 55 HD13 LEU 55 4.271 2.668 -0.127 479 HD21 LEU 55 HD21 LEU 55 5.154 0.280 -3.552 480 HD22 LEU 55 HD22 LEU 55 4.338 -0.366 -2.128 481 HD23 LEU 55 HD23 LEU 55 3.468 0.732 -3.224 482 H ASN 56 H ASN 56 4.474 5.611 -1.756 483 HA ASN 56 HA ASN 56 5.658 6.087 0.922 484 HB2 ASN 56 HB2 ASN 56 5.483 7.977 -0.648 485 HB3 ASN 56 HB3 ASN 56 3.744 7.729 -0.776 486 HD21 ASN 56 HD21 ASN 56 4.149 10.458 1.624 487 HD22 ASN 56 HD22 ASN 56 4.293 10.176 -0.106 488 H ALA 57 H ALA 57 4.726 5.268 2.638 489 HA ALA 57 HA ALA 57 2.331 3.725 2.672 490 HB1 ALA 57 HB1 ALA 57 3.987 5.021 4.887 491 HB2 ALA 57 HB2 ALA 57 2.789 3.737 5.126 492 HB3 ALA 57 HB3 ALA 57 4.247 3.415 4.167 493 H THR 58 H THR 58 2.865 7.202 3.264 494 HA THR 58 HA THR 58 0.315 7.726 4.493 495 HB THR 58 HB THR 58 2.139 9.596 2.946 496 HG1 THR 58 HG1 THR 58 2.900 10.099 5.000 497 HG21 THR 58 HG21 THR 58 -0.109 10.152 4.930 498 HG22 THR 58 HG22 THR 58 1.057 11.364 4.342 499 HG23 THR 58 HG23 THR 58 -0.062 10.601 3.209 500 H GLU 59 H GLU 59 1.391 7.866 1.068 501 HA GLU 59 HA GLU 59 -1.098 8.745 -0.037 502 HB2 GLU 59 HB2 GLU 59 1.116 7.050 -1.245 503 HB3 GLU 59 HB3 GLU 59 -0.214 7.755 -2.161 504 HG2 GLU 59 HG2 GLU 59 1.885 9.318 -0.598 505 HG3 GLU 59 HG3 GLU 59 1.881 9.064 -2.335 506 H LEU 60 H LEU 60 0.072 5.407 0.649 507 HA LEU 60 HA LEU 60 -2.354 4.108 -0.228 508 HB2 LEU 60 HB2 LEU 60 -0.400 3.302 1.972 509 HB3 LEU 60 HB3 LEU 60 -1.690 2.292 1.335 510 HG LEU 60 HG LEU 60 0.800 3.223 -0.143 511 HD11 LEU 60 HD11 LEU 60 -0.275 0.474 0.637 512 HD12 LEU 60 HD12 LEU 60 1.234 0.791 -0.239 513 HD13 LEU 60 HD13 LEU 60 1.048 1.337 1.438 514 HD21 LEU 60 HD21 LEU 60 -0.965 3.256 -1.796 515 HD22 LEU 60 HD22 LEU 60 -0.054 1.754 -2.013 516 HD23 LEU 60 HD23 LEU 60 -1.634 1.729 -1.192 517 H SER 61 H SER 61 -1.461 5.377 3.021 518 HA SER 61 HA SER 61 -3.805 4.604 4.340 519 HB2 SER 61 HB2 SER 61 -3.074 5.896 6.128 520 HB3 SER 61 HB3 SER 61 -1.587 5.490 5.292 521 HG SER 61 HG SER 61 -1.907 7.634 4.207 522 H LYS 62 H LYS 62 -3.343 7.278 2.221 523 HA LYS 62 HA LYS 62 -5.709 8.842 2.967 524 HB2 LYS 62 HB2 LYS 62 -3.697 8.895 0.687 525 HB3 LYS 62 HB3 LYS 62 -5.103 9.955 0.689 526 HG2 LYS 62 HG2 LYS 62 -4.430 11.107 2.631 527 HG3 LYS 62 HG3 LYS 62 -3.207 9.906 3.062 528 HD2 LYS 62 HD2 LYS 62 -1.795 10.494 1.230 529 HD3 LYS 62 HD3 LYS 62 -3.033 11.495 0.463 530 HE2 LYS 62 HE2 LYS 62 -1.817 12.105 3.194 531 HE3 LYS 62 HE3 LYS 62 -1.149 12.711 1.673 532 HZ1 LYS 62 HZ1 LYS 62 -3.891 13.296 2.660 533 HZ2 LYS 62 HZ2 LYS 62 -2.636 14.338 2.660 534 HZ3 LYS 62 HZ3 LYS 62 -3.265 13.830 1.245 535 H ARG 63 H ARG 63 -5.097 6.202 0.775 536 HA ARG 63 HA ARG 63 -7.784 6.503 -0.541 537 HB2 ARG 63 HB2 ARG 63 -5.156 5.239 -1.341 538 HB3 ARG 63 HB3 ARG 63 -6.669 4.670 -2.036 539 HG2 ARG 63 HG2 ARG 63 -5.701 6.223 -3.543 540 HG3 ARG 63 HG3 ARG 63 -7.195 6.899 -2.897 541 HD2 ARG 63 HD2 ARG 63 -5.910 8.395 -1.419 542 HD3 ARG 63 HD3 ARG 63 -4.407 7.607 -1.899 543 HE ARG 63 HE ARG 63 -4.389 8.759 -3.904 544 HH11 ARG 63 HH11 ARG 63 -4.975 10.334 -5.343 545 HH12 ARG 63 HH12 ARG 63 -6.509 11.136 -5.184 546 HH21 ARG 63 HH21 ARG 63 -7.508 9.380 -2.413 547 HH22 ARG 63 HH22 ARG 63 -7.908 10.614 -3.576 548 H LEU 64 H LEU 64 -5.819 4.113 1.249 549 HA LEU 64 HA LEU 64 -8.041 2.193 1.367 550 HB2 LEU 64 HB2 LEU 64 -5.265 2.284 2.617 551 HB3 LEU 64 HB3 LEU 64 -6.480 1.113 3.097 552 HG LEU 64 HG LEU 64 -6.678 0.429 0.648 553 HD11 LEU 64 HD11 LEU 64 -4.002 1.865 0.461 554 HD12 LEU 64 HD12 LEU 64 -4.689 0.763 -0.751 555 HD13 LEU 64 HD13 LEU 64 -5.484 2.296 -0.420 556 HD21 LEU 64 HD21 LEU 64 -5.588 -0.948 2.352 557 HD22 LEU 64 HD22 LEU 64 -4.730 -1.061 0.813 558 HD23 LEU 64 HD23 LEU 64 -4.062 -0.058 2.120 559 H ASN 65 H ASN 65 -7.084 4.967 3.220 560 HA ASN 65 HA ASN 65 -7.943 5.988 5.013 561 HB2 ASN 65 HB2 ASN 65 -10.041 5.898 3.779 562 HB3 ASN 65 HB3 ASN 65 -10.432 4.329 4.490 563 HD21 ASN 65 HD21 ASN 65 -10.565 7.610 6.986 564 HD22 ASN 65 HD22 ASN 65 -9.366 7.583 5.702 565 H ILE 66 H ILE 66 -6.144 4.728 5.784 566 HA ILE 66 HA ILE 66 -6.758 3.235 8.289 567 HB ILE 66 HB ILE 66 -4.657 1.888 7.858 568 HG12 ILE 66 HG12 ILE 66 -4.986 2.900 5.005 569 HG13 ILE 66 HG13 ILE 66 -3.672 3.322 6.117 570 HG21 ILE 66 HG21 ILE 66 -6.893 1.396 5.867 571 HG22 ILE 66 HG22 ILE 66 -5.772 0.199 6.569 572 HG23 ILE 66 HG23 ILE 66 -6.958 1.002 7.600 573 HD11 ILE 66 HD11 ILE 66 -4.210 0.576 4.928 574 HD12 ILE 66 HD12 ILE 66 -2.944 1.719 4.467 575 HD13 ILE 66 HD13 ILE 66 -2.909 0.972 6.086 576 H THR 67 H THR 67 -4.610 3.197 9.640 577 HA THR 67 HA THR 67 -3.412 5.906 9.705 578 HB THR 67 HB THR 67 -3.891 4.925 11.849 579 HG1 THR 67 HG1 THR 67 -1.902 5.338 12.708 580 HG21 THR 67 HG21 THR 67 -1.806 2.802 11.222 581 HG22 THR 67 HG22 THR 67 -2.671 3.024 12.750 582 HG23 THR 67 HG23 THR 67 -3.554 2.488 11.313 583 H VAL 68 H VAL 68 -1.238 6.328 9.313 584 HA VAL 68 HA VAL 68 0.052 5.015 7.126 585 HB VAL 68 HB VAL 68 1.359 6.739 9.270 586 HG11 VAL 68 HG11 VAL 68 2.074 6.253 6.342 587 HG12 VAL 68 HG12 VAL 68 2.886 7.406 7.419 588 HG13 VAL 68 HG13 VAL 68 2.995 5.677 7.751 589 HG21 VAL 68 HG21 VAL 68 -0.561 7.991 8.396 590 HG22 VAL 68 HG22 VAL 68 0.929 8.663 7.736 591 HG23 VAL 68 HG23 VAL 68 -0.079 7.607 6.731 592 H ASP 69 H ASP 69 0.191 4.459 10.604 593 HA ASP 69 HA ASP 69 2.568 2.873 10.563 594 HB2 ASP 69 HB2 ASP 69 1.565 4.132 12.524 595 HB3 ASP 69 HB3 ASP 69 0.329 2.885 12.629 596 H LYS 70 H LYS 70 -0.792 1.985 9.978 597 HA LYS 70 HA LYS 70 -0.175 -0.908 9.893 598 HB2 LYS 70 HB2 LYS 70 -2.585 0.784 9.068 599 HB3 LYS 70 HB3 LYS 70 -2.424 -0.911 8.602 600 HG2 LYS 70 HG2 LYS 70 -2.242 -1.571 10.984 601 HG3 LYS 70 HG3 LYS 70 -2.507 0.116 11.467 602 HD2 LYS 70 HD2 LYS 70 -4.718 0.105 10.362 603 HD3 LYS 70 HD3 LYS 70 -4.432 -1.543 9.766 604 HE2 LYS 70 HE2 LYS 70 -4.262 -2.354 12.114 605 HE3 LYS 70 HE3 LYS 70 -4.606 -0.721 12.699 606 HZ1 LYS 70 HZ1 LYS 70 -6.453 -2.354 11.030 607 HZ2 LYS 70 HZ2 LYS 70 -6.617 -2.094 12.632 608 HZ3 LYS 70 HZ3 LYS 70 -6.775 -0.851 11.589 609 H ALA 71 H ALA 71 -0.208 1.834 7.674 610 HA ALA 71 HA ALA 71 -0.104 0.185 5.281 611 HB1 ALA 71 HB1 ALA 71 0.699 3.095 5.720 612 HB2 ALA 71 HB2 ALA 71 0.472 2.298 4.149 613 HB3 ALA 71 HB3 ALA 71 -0.902 2.525 5.247 614 H LYS 72 H LYS 72 2.418 1.846 7.186 615 HA LYS 72 HA LYS 72 4.545 0.908 5.485 616 HB2 LYS 72 HB2 LYS 72 6.045 1.983 6.913 617 HB3 LYS 72 HB3 LYS 72 4.592 2.977 6.853 618 HG2 LYS 72 HG2 LYS 72 3.899 1.906 9.070 619 HG3 LYS 72 HG3 LYS 72 5.508 1.159 9.121 620 HD2 LYS 72 HD2 LYS 72 6.512 3.464 8.867 621 HD3 LYS 72 HD3 LYS 72 4.877 4.143 8.999 622 HE2 LYS 72 HE2 LYS 72 4.640 3.119 11.255 623 HE3 LYS 72 HE3 LYS 72 6.242 2.391 11.100 624 HZ1 LYS 72 HZ1 LYS 72 5.708 5.317 11.120 625 HZ2 LYS 72 HZ2 LYS 72 6.333 4.466 12.363 626 HZ3 LYS 72 HZ3 LYS 72 7.186 4.635 10.984 627 H THR 73 H THR 73 2.965 -0.762 8.117 628 HA THR 73 HA THR 73 5.130 -2.821 8.055 629 HB THR 73 HB THR 73 4.079 -1.994 10.219 630 HG1 THR 73 HG1 THR 73 4.348 -4.050 11.069 631 HG21 THR 73 HG21 THR 73 1.947 -4.063 9.531 632 HG22 THR 73 HG22 THR 73 2.143 -3.173 11.054 633 HG23 THR 73 HG23 THR 73 1.670 -2.303 9.590 634 H TYR 74 H TYR 74 1.675 -2.479 7.118 635 HA TYR 74 HA TYR 74 1.227 -5.106 6.238 636 HB2 TYR 74 HB2 TYR 74 -0.615 -3.605 6.345 637 HB3 TYR 74 HB3 TYR 74 0.194 -2.412 5.324 638 HD1 TYR 74 HD1 TYR 74 -1.108 -5.945 5.168 639 HD2 TYR 74 HD2 TYR 74 -0.203 -2.290 3.052 640 HE1 TYR 74 HE1 TYR 74 -1.905 -6.971 3.041 641 HE2 TYR 74 HE2 TYR 74 -0.998 -3.317 0.948 642 HH TYR 74 HH TYR 74 -2.075 -6.734 0.773 643 H ILE 75 H ILE 75 2.725 -2.404 4.404 644 HA ILE 75 HA ILE 75 3.110 -3.564 1.900 645 HB ILE 75 HB ILE 75 4.824 -1.711 3.574 646 HG12 ILE 75 HG12 ILE 75 3.342 -1.090 0.988 647 HG13 ILE 75 HG13 ILE 75 2.530 -1.045 2.541 648 HG21 ILE 75 HG21 ILE 75 5.373 -2.502 0.670 649 HG22 ILE 75 HG22 ILE 75 6.150 -1.158 1.524 650 HG23 ILE 75 HG23 ILE 75 6.443 -2.793 2.062 651 HD11 ILE 75 HD11 ILE 75 4.910 0.678 1.720 652 HD12 ILE 75 HD12 ILE 75 3.252 1.201 2.048 653 HD13 ILE 75 HD13 ILE 75 4.261 0.602 3.366 654 H LYS 76 H LYS 76 5.595 -3.781 4.528 655 HA LYS 76 HA LYS 76 7.027 -5.816 3.028 656 HB2 LYS 76 HB2 LYS 76 8.451 -5.942 5.125 657 HB3 LYS 76 HB3 LYS 76 8.369 -4.351 4.354 658 HG2 LYS 76 HG2 LYS 76 6.847 -3.525 6.056 659 HG3 LYS 76 HG3 LYS 76 6.658 -5.147 6.734 660 HD2 LYS 76 HD2 LYS 76 9.057 -5.174 7.357 661 HD3 LYS 76 HD3 LYS 76 9.227 -3.519 6.726 662 HE2 LYS 76 HE2 LYS 76 7.536 -2.717 8.337 663 HE3 LYS 76 HE3 LYS 76 7.278 -4.367 8.921 664 HZ1 LYS 76 HZ1 LYS 76 9.834 -2.863 9.152 665 HZ2 LYS 76 HZ2 LYS 76 8.791 -3.144 10.376 666 HZ3 LYS 76 HZ3 LYS 76 9.592 -4.387 9.690 667 H ASN 77 H ASN 77 4.705 -6.064 5.688 668 HA ASN 77 HA ASN 77 5.376 -8.848 6.166 669 HB2 ASN 77 HB2 ASN 77 3.145 -7.029 7.127 670 HB3 ASN 77 HB3 ASN 77 3.178 -8.746 7.498 671 HD21 ASN 77 HD21 ASN 77 5.494 -8.321 10.097 672 HD22 ASN 77 HD22 ASN 77 4.202 -9.289 9.388 673 H SER 78 H SER 78 2.943 -7.286 4.103 674 HA SER 78 HA SER 78 1.796 -9.883 3.331 675 HB2 SER 78 HB2 SER 78 0.436 -7.805 3.559 676 HB3 SER 78 HB3 SER 78 1.278 -7.146 2.141 677 HG SER 78 HG SER 78 -0.371 -9.480 2.286 678 H ASN 79 H ASN 79 3.731 -7.345 1.704 679 HA ASN 79 HA ASN 79 4.466 -9.355 -0.377 680 HB2 ASN 79 HB2 ASN 79 4.691 -7.519 -1.976 681 HB3 ASN 79 HB3 ASN 79 3.055 -7.857 -1.435 682 HD21 ASN 79 HD21 ASN 79 4.706 -4.221 -0.555 683 HD22 ASN 79 HD22 ASN 79 5.764 -5.619 -0.705 684 H ARG 80 H ARG 80 6.113 -10.146 0.827 685 HA ARG 80 HA ARG 80 8.587 -8.486 0.961 686 HB2 ARG 80 HB2 ARG 80 9.556 -10.282 2.275 687 HB3 ARG 80 HB3 ARG 80 8.128 -9.624 3.019 688 HG2 ARG 80 HG2 ARG 80 7.866 -12.127 1.342 689 HG3 ARG 80 HG3 ARG 80 8.612 -12.221 2.933 690 HD2 ARG 80 HD2 ARG 80 6.603 -11.321 4.013 691 HD3 ARG 80 HD3 ARG 80 5.801 -11.157 2.442 692 HE ARG 80 HE ARG 80 6.758 -13.841 2.781 693 HH11 ARG 80 HH11 ARG 80 5.384 -15.532 3.100 694 HH12 ARG 80 HH12 ARG 80 3.796 -15.253 3.747 695 HH21 ARG 80 HH21 ARG 80 4.136 -11.863 4.092 696 HH22 ARG 80 HH22 ARG 80 3.106 -13.253 4.254 697 H MET 81 H MET 81 7.197 -10.562 -1.290 698 HA MET 81 HA MET 81 9.736 -11.810 -2.148 699 HB2 MET 81 HB2 MET 81 6.894 -12.138 -3.176 700 HB3 MET 81 HB3 MET 81 8.309 -13.039 -3.742 701 HG2 MET 81 HG2 MET 81 8.670 -13.915 -1.451 702 HG3 MET 81 HG3 MET 81 7.221 -13.065 -0.901 703 HE1 MET 81 HE1 MET 81 6.240 -15.267 0.127 704 HE2 MET 81 HE2 MET 81 6.109 -16.802 -0.757 705 HE3 MET 81 HE3 MET 81 7.711 -16.128 -0.382 706 H GLY 82 H GLY 82 7.311 -9.622 -3.660 707 HA2 GLY 82 HA2 GLY 82 7.775 -7.886 -5.213 708 HA3 GLY 82 HA3 GLY 82 9.354 -8.576 -5.561 709 H ARG 83 H ARG 83 6.608 -7.921 -6.996 710 HA ARG 83 HA ARG 83 5.196 -8.771 -8.621 711 HB2 ARG 83 HB2 ARG 83 7.977 -9.613 -9.459 712 HB3 ARG 83 HB3 ARG 83 6.611 -9.919 -10.519 713 HG2 ARG 83 HG2 ARG 83 7.402 -7.157 -9.531 714 HG3 ARG 83 HG3 ARG 83 7.850 -7.869 -11.084 715 HD2 ARG 83 HD2 ARG 83 5.391 -8.178 -11.598 716 HD3 ARG 83 HD3 ARG 83 5.016 -7.228 -10.164 717 HE ARG 83 HE ARG 83 5.970 -6.279 -12.742 718 HH11 ARG 83 HH11 ARG 83 6.095 -4.097 -13.123 719 HH12 ARG 83 HH12 ARG 83 6.156 -2.982 -11.785 720 HH21 ARG 83 HH21 ARG 83 5.896 -5.374 -9.356 721 HH22 ARG 83 HH22 ARG 83 5.909 -3.669 -9.704 722 H THR 84 H THR 84 5.071 -10.330 -6.363 723 HA THR 84 HA THR 84 4.656 -12.357 -5.446 724 HB THR 84 HB THR 84 2.990 -13.042 -7.860 725 HG1 THR 84 HG1 THR 84 1.474 -11.553 -7.132 726 HG21 THR 84 HG21 THR 84 2.487 -13.051 -4.837 727 HG22 THR 84 HG22 THR 84 1.347 -13.617 -6.082 728 HG23 THR 84 HG23 THR 84 2.862 -14.486 -5.811 729 H ASN 85 H ASN 85 7.121 -12.425 -6.793 730 HA ASN 85 HA ASN 85 8.718 -13.696 -7.648 731 HB2 ASN 85 HB2 ASN 85 7.965 -14.844 -5.419 732 HB3 ASN 85 HB3 ASN 85 7.422 -16.154 -6.458 733 HD21 ASN 85 HD21 ASN 85 10.832 -17.026 -7.393 734 HD22 ASN 85 HD22 ASN 85 9.217 -16.868 -8.101 735 H ASN 86 H ASN 86 6.492 -13.251 -9.482 736 HA ASN 86 HA ASN 86 6.721 -15.605 -11.262 737 HB2 ASN 86 HB2 ASN 86 4.671 -15.190 -11.960 738 HB3 ASN 86 HB3 ASN 86 4.525 -14.140 -10.558 739 HD21 ASN 86 HD21 ASN 86 4.762 -11.133 -12.537 740 HD22 ASN 86 HD22 ASN 86 5.184 -11.803 -10.955 741 H PHE 87 H PHE 87 8.378 -12.729 -10.870 742 HA PHE 87 HA PHE 87 8.806 -11.960 -13.608 743 HB2 PHE 87 HB2 PHE 87 10.169 -10.245 -12.704 744 HB3 PHE 87 HB3 PHE 87 8.803 -10.447 -11.628 745 HD1 PHE 87 HD1 PHE 87 9.133 -11.677 -9.389 746 HD2 PHE 87 HD2 PHE 87 12.421 -10.504 -11.933 747 HE1 PHE 87 HE1 PHE 87 10.709 -12.041 -7.520 748 HE2 PHE 87 HE2 PHE 87 13.996 -10.876 -10.050 749 HZ PHE 87 HZ PHE 87 13.145 -11.649 -7.842 750 H LYS 88 H LYS 88 9.671 -14.751 -12.802 751 HA LYS 88 HA LYS 88 12.602 -14.823 -12.879 752 HB2 LYS 88 HB2 LYS 88 12.265 -17.199 -12.357 753 HB3 LYS 88 HB3 LYS 88 11.358 -16.129 -11.287 754 HG2 LYS 88 HG2 LYS 88 9.373 -16.600 -13.038 755 HG3 LYS 88 HG3 LYS 88 10.344 -18.017 -13.431 756 HD2 LYS 88 HD2 LYS 88 10.162 -18.845 -11.147 757 HD3 LYS 88 HD3 LYS 88 9.570 -17.286 -10.579 758 HE2 LYS 88 HE2 LYS 88 7.634 -18.587 -10.652 759 HE3 LYS 88 HE3 LYS 88 7.538 -17.563 -12.081 760 HZ1 LYS 88 HZ1 LYS 88 8.443 -20.405 -12.047 761 HZ2 LYS 88 HZ2 LYS 88 7.009 -19.881 -12.614 762 HZ3 LYS 88 HZ3 LYS 88 8.384 -19.476 -13.393 763 H THR 89 H THR 89 10.722 -14.306 -15.278 764 HA THR 89 HA THR 89 12.040 -16.025 -17.328 765 HB THR 89 HB THR 89 9.036 -15.585 -16.987 766 HG1 THR 89 HG1 THR 89 9.003 -17.798 -16.523 767 HG21 THR 89 HG21 THR 89 10.646 -17.309 -18.891 768 HG22 THR 89 HG22 THR 89 8.865 -17.323 -18.729 769 HG23 THR 89 HG23 THR 89 9.686 -15.863 -19.313 770 H ILE 90 H ILE 90 9.812 -13.346 -16.632 771 HA ILE 90 HA ILE 90 10.206 -11.934 -19.168 772 HB ILE 90 HB ILE 90 8.920 -11.095 -16.540 773 HG12 ILE 90 HG12 ILE 90 7.389 -11.963 -19.025 774 HG13 ILE 90 HG13 ILE 90 7.897 -13.156 -17.844 775 HG21 ILE 90 HG21 ILE 90 8.708 -9.829 -19.301 776 HG22 ILE 90 HG22 ILE 90 7.625 -9.441 -17.958 777 HG23 ILE 90 HG23 ILE 90 9.324 -9.080 -17.802 778 HD11 ILE 90 HD11 ILE 90 6.063 -10.816 -17.241 779 HD12 ILE 90 HD12 ILE 90 5.634 -12.530 -17.359 780 HD13 ILE 90 HD13 ILE 90 6.688 -11.977 -16.045 781 H LYS 91 H LYS 91 11.028 -9.646 -19.163 782 HA LYS 91 HA LYS 91 12.655 -8.171 -19.004 783 HB2 LYS 91 HB2 LYS 91 11.494 -8.376 -16.514 784 HB3 LYS 91 HB3 LYS 91 13.176 -8.650 -16.109 785 HG2 LYS 91 HG2 LYS 91 13.253 -6.414 -15.976 786 HG3 LYS 91 HG3 LYS 91 13.447 -6.481 -17.737 787 HD2 LYS 91 HD2 LYS 91 10.828 -6.062 -16.228 788 HD3 LYS 91 HD3 LYS 91 11.780 -4.797 -17.014 789 HE2 LYS 91 HE2 LYS 91 11.445 -5.886 -19.215 790 HE3 LYS 91 HE3 LYS 91 10.501 -7.168 -18.450 791 HZ1 LYS 91 HZ1 LYS 91 9.761 -4.289 -18.474 792 HZ2 LYS 91 HZ2 LYS 91 9.063 -5.453 -19.379 793 HZ3 LYS 91 HZ3 LYS 91 8.888 -5.469 -17.756 794 H MET 92 H MET 92 13.658 -11.349 -18.418 795 HA MET 92 HA MET 92 16.494 -10.658 -18.008 796 HB2 MET 92 HB2 MET 92 15.155 -13.362 -18.324 797 HB3 MET 92 HB3 MET 92 16.837 -13.068 -17.862 798 HG2 MET 92 HG2 MET 92 15.904 -11.703 -15.891 799 HG3 MET 92 HG3 MET 92 14.344 -12.429 -16.273 800 HE1 MET 92 HE1 MET 92 15.798 -15.453 -17.275 801 HE2 MET 92 HE2 MET 92 15.249 -16.303 -15.818 802 HE3 MET 92 HE3 MET 92 14.169 -15.145 -16.634 803 H PHE 93 H PHE 93 14.523 -11.871 -20.708 804 HA PHE 93 HA PHE 93 16.955 -12.180 -22.392 805 HB2 PHE 93 HB2 PHE 93 15.608 -13.466 -23.868 806 HB3 PHE 93 HB3 PHE 93 15.359 -14.053 -22.238 807 HD1 PHE 93 HD1 PHE 93 13.816 -12.300 -25.111 808 HD2 PHE 93 HD2 PHE 93 13.175 -13.795 -21.117 809 HE1 PHE 93 HE1 PHE 93 11.365 -12.029 -25.401 810 HE2 PHE 93 HE2 PHE 93 10.725 -13.508 -21.404 811 HZ PHE 93 HZ PHE 93 9.816 -12.625 -23.546 812 H GLU 94 H GLU 94 14.620 -9.829 -21.786 813 HA GLU 94 HA GLU 94 14.205 -8.859 -24.485 814 HB2 GLU 94 HB2 GLU 94 13.381 -7.714 -21.792 815 HB3 GLU 94 HB3 GLU 94 12.791 -7.177 -23.373 816 HG2 GLU 94 HG2 GLU 94 11.820 -9.408 -23.796 817 HG3 GLU 94 HG3 GLU 94 12.393 -9.975 -22.225 818 H ASP 95 H ASP 95 16.910 -8.814 -24.150 819 HA ASP 95 HA ASP 95 17.874 -6.153 -23.362 820 HB2 ASP 95 HB2 ASP 95 19.184 -8.693 -24.364 821 HB3 ASP 95 HB3 ASP 95 20.082 -7.184 -24.293 822 H ASP 96 H ASP 96 19.191 -4.834 -24.629 823 HA ASP 96 HA ASP 96 19.521 -3.330 -26.211 824 HB2 ASP 96 HB2 ASP 96 20.261 -5.602 -27.373 825 HB3 ASP 96 HB3 ASP 96 18.979 -5.153 -28.518 826 H VAL 97 H VAL 97 18.688 -2.054 -28.000 827 HA VAL 97 HA VAL 97 15.707 -1.920 -28.119 828 HB VAL 97 HB VAL 97 17.446 0.414 -27.211 829 HG11 VAL 97 HG11 VAL 97 14.411 0.149 -27.409 830 HG12 VAL 97 HG12 VAL 97 15.286 1.530 -26.710 831 HG13 VAL 97 HG13 VAL 97 15.449 1.176 -28.428 832 HG21 VAL 97 HG21 VAL 97 17.285 -1.167 -25.349 833 HG22 VAL 97 HG22 VAL 97 16.273 0.234 -25.023 834 HG23 VAL 97 HG23 VAL 97 15.523 -1.287 -25.560 835 H SER 98 H SER 98 18.790 -0.562 -29.238 836 HA SER 98 HA SER 98 17.541 0.048 -31.892 837 HB2 SER 98 HB2 SER 98 19.561 1.744 -30.396 838 HB3 SER 98 HB3 SER 98 18.908 2.073 -32.012 839 HG SER 98 HG SER 98 17.770 3.251 -30.438 840 H SER 99 H SER 99 19.372 -2.165 -30.724 841 HA SER 99 HA SER 99 21.044 -3.511 -31.384 842 HB2 SER 99 HB2 SER 99 19.683 -3.439 -33.508 843 HB3 SER 99 HB3 SER 99 20.899 -2.329 -34.165 844 HG SER 99 HG SER 99 21.339 -4.549 -34.650 845 H ALA 100 H ALA 100 22.186 -2.064 -29.849 846 HA ALA 100 HA ALA 100 24.266 -0.275 -30.858 847 HB1 ALA 100 HB1 ALA 100 23.828 -1.522 -28.113 848 HB2 ALA 100 HB2 ALA 100 24.968 -0.216 -28.497 849 HB3 ALA 100 HB3 ALA 100 23.225 0.063 -28.656 850 H SER 101 H SER 101 26.507 -0.635 -30.911 851 HA SER 101 HA SER 101 27.508 -3.462 -30.759 852 HB2 SER 101 HB2 SER 101 27.852 -1.554 -33.102 853 HB3 SER 101 HB3 SER 101 28.733 -3.077 -32.888 854 HG SER 101 HG SER 101 26.874 -3.302 -34.235 855 H ALA 102 H ALA 102 29.190 -3.505 -29.431 856 HA ALA 102 HA ALA 102 30.901 -2.896 -28.105 857 HB1 ALA 102 HB1 ALA 102 31.902 -1.467 -30.581 858 HB2 ALA 102 HB2 ALA 102 32.880 -2.054 -29.217 859 HB3 ALA 102 HB3 ALA 102 32.038 -3.214 -30.264 860 H GLN 103 H GLN 103 28.647 -1.216 -27.923 861 HA GLN 103 HA GLN 103 29.733 1.423 -27.025 862 HB2 GLN 103 HB2 GLN 103 27.154 0.631 -28.392 863 HB3 GLN 103 HB3 GLN 103 27.310 2.177 -27.564 864 HG2 GLN 103 HG2 GLN 103 28.814 3.060 -29.074 865 HG3 GLN 103 HG3 GLN 103 29.424 1.505 -29.601 866 HE21 GLN 103 HE21 GLN 103 27.311 2.964 -32.340 867 HE22 GLN 103 HE22 GLN 103 28.687 3.567 -31.426 868 HA PRO 104 HA PRO 104 27.858 0.356 -23.090 869 HB2 PRO 104 HB2 PRO 104 28.033 2.690 -21.735 870 HB3 PRO 104 HB3 PRO 104 29.485 1.828 -22.312 871 HG2 PRO 104 HG2 PRO 104 28.055 4.140 -23.672 872 HG3 PRO 104 HG3 PRO 104 29.801 3.989 -23.299 873 HD2 PRO 104 HD2 PRO 104 28.749 3.327 -25.748 874 HD3 PRO 104 HD3 PRO 104 30.147 2.466 -25.039 875 H ASN 105 H ASN 105 25.908 0.085 -24.686 876 HA ASN 105 HA ASN 105 23.768 0.379 -25.340 877 HB2 ASN 105 HB2 ASN 105 23.536 -0.340 -22.956 878 HB3 ASN 105 HB3 ASN 105 23.333 1.349 -22.490 879 HD21 ASN 105 HD21 ASN 105 20.292 -0.516 -24.557 880 HD22 ASN 105 HD22 ASN 105 21.939 -1.075 -24.801 881 H LEU 106 H LEU 106 25.343 2.361 -26.256 882 HA LEU 106 HA LEU 106 23.829 4.921 -26.016 883 HB2 LEU 106 HB2 LEU 106 26.153 4.670 -25.065 884 HB3 LEU 106 HB3 LEU 106 26.756 4.559 -26.712 885 HG LEU 106 HG LEU 106 25.224 6.904 -25.487 886 HD11 LEU 106 HD11 LEU 106 28.172 6.593 -26.206 887 HD12 LEU 106 HD12 LEU 106 27.400 8.057 -25.552 888 HD13 LEU 106 HD13 LEU 106 27.493 6.593 -24.563 889 HD21 LEU 106 HD21 LEU 106 24.834 6.952 -27.884 890 HD22 LEU 106 HD22 LEU 106 26.029 8.183 -27.490 891 HD23 LEU 106 HD23 LEU 106 26.557 6.649 -28.217 892 HA PRO 107 HA PRO 107 23.171 3.712 -30.394 893 HB2 PRO 107 HB2 PRO 107 20.779 4.927 -30.825 894 HB3 PRO 107 HB3 PRO 107 20.954 3.421 -29.871 895 HG2 PRO 107 HG2 PRO 107 20.737 6.262 -28.831 896 HG3 PRO 107 HG3 PRO 107 19.839 4.810 -28.288 897 HD2 PRO 107 HD2 PRO 107 22.087 5.725 -27.018 898 HD3 PRO 107 HD3 PRO 107 21.690 3.982 -27.115 Start of MODEL 5 1 H1 GLY -5 H1 GLY -5 15.647 -9.697 47.337 2 H2 GLY -5 H2 GLY -5 15.265 -11.072 48.140 3 H3 GLY -5 H3 GLY -5 16.659 -10.981 47.290 4 HA2 GLY -5 HA2 GLY -5 17.111 -10.807 49.645 5 HA3 GLY -5 HA3 GLY -5 17.577 -9.345 48.755 6 H SER -4 H SER -4 17.424 -8.708 51.182 7 HA SER -4 HA SER -4 14.780 -8.206 52.278 8 HB2 SER -4 HB2 SER -4 16.064 -6.987 54.050 9 HB3 SER -4 HB3 SER -4 16.487 -8.688 53.828 10 HG SER -4 HG SER -4 18.342 -7.350 54.039 11 H HIS -3 H HIS -3 13.544 -6.467 52.201 12 HA HIS -3 HA HIS -3 14.530 -3.773 51.583 13 HB2 HIS -3 HB2 HIS -3 14.174 -4.885 49.347 14 HB3 HIS -3 HB3 HIS -3 12.485 -5.105 49.753 15 HD2 HIS -3 HD2 HIS -3 12.829 -1.729 51.003 16 HE1 HIS -3 HE1 HIS -3 12.538 -1.082 46.808 17 HE2 HIS -3 HE2 HIS -3 12.366 0.015 49.088 18 H MET -2 H MET -2 13.657 -2.800 53.341 19 HA MET -2 HA MET -2 10.695 -2.845 53.697 20 HB2 MET -2 HB2 MET -2 12.736 -3.215 55.928 21 HB3 MET -2 HB3 MET -2 11.033 -2.804 56.167 22 HG2 MET -2 HG2 MET -2 10.384 -4.913 54.994 23 HG3 MET -2 HG3 MET -2 12.092 -5.326 54.848 24 HE1 MET -2 HE1 MET -2 8.976 -5.056 57.156 25 HE2 MET -2 HE2 MET -2 9.633 -5.353 58.780 26 HE3 MET -2 HE3 MET -2 9.981 -3.823 57.954 27 H ALA -1 H ALA -1 10.475 -0.853 52.755 28 HA ALA -1 HA ALA -1 11.162 1.461 54.401 29 HB1 ALA -1 HB1 ALA -1 12.191 1.244 51.541 30 HB2 ALA -1 HB2 ALA -1 12.219 2.703 52.560 31 HB3 ALA -1 HB3 ALA -1 13.178 1.287 53.019 32 H SER 0 H SER 0 9.049 1.752 54.709 33 HA SER 0 HA SER 0 7.225 2.358 52.416 34 HB2 SER 0 HB2 SER 0 5.443 1.593 53.952 35 HB3 SER 0 HB3 SER 0 6.660 0.343 53.622 36 HG SER 0 HG SER 0 6.131 0.494 55.866 37 H MET 1 H MET 1 8.924 4.040 54.514 38 HA MET 1 HA MET 1 6.896 6.182 54.977 39 HB2 MET 1 HB2 MET 1 7.361 6.260 57.345 40 HB3 MET 1 HB3 MET 1 6.929 4.610 56.904 41 HG2 MET 1 HG2 MET 1 9.462 4.133 56.768 42 HG3 MET 1 HG3 MET 1 9.692 5.717 57.503 43 HE1 MET 1 HE1 MET 1 8.783 1.986 57.992 44 HE2 MET 1 HE2 MET 1 7.977 1.943 59.569 45 HE3 MET 1 HE3 MET 1 7.146 2.652 58.172 46 H ASP 2 H ASP 2 9.996 5.522 54.039 47 HA ASP 2 HA ASP 2 10.881 8.366 54.302 48 HB2 ASP 2 HB2 ASP 2 11.891 6.823 56.030 49 HB3 ASP 2 HB3 ASP 2 12.617 5.900 54.717 50 H GLN 3 H GLN 3 9.769 6.438 52.145 51 HA GLN 3 HA GLN 3 11.738 6.876 49.954 52 HB2 GLN 3 HB2 GLN 3 12.175 4.763 51.230 53 HB3 GLN 3 HB3 GLN 3 10.559 4.213 50.848 54 HG2 GLN 3 HG2 GLN 3 11.928 4.868 48.359 55 HG3 GLN 3 HG3 GLN 3 13.018 3.929 49.366 56 HE21 GLN 3 HE21 GLN 3 9.428 2.142 48.345 57 HE22 GLN 3 HE22 GLN 3 9.530 3.905 48.452 58 H LEU 4 H LEU 4 8.883 7.817 50.706 59 HA LEU 4 HA LEU 4 7.446 7.050 48.184 60 HB2 LEU 4 HB2 LEU 4 6.417 7.490 51.004 61 HB3 LEU 4 HB3 LEU 4 5.400 7.766 49.601 62 HG LEU 4 HG LEU 4 5.664 5.445 48.861 63 HD11 LEU 4 HD11 LEU 4 7.196 5.085 51.465 64 HD12 LEU 4 HD12 LEU 4 6.437 3.751 50.565 65 HD13 LEU 4 HD13 LEU 4 7.730 4.673 49.817 66 HD21 LEU 4 HD21 LEU 4 3.771 6.179 50.270 67 HD22 LEU 4 HD22 LEU 4 4.200 4.493 50.583 68 HD23 LEU 4 HD23 LEU 4 4.693 5.758 51.731 69 H ASP 5 H ASP 5 8.835 8.748 47.291 70 HA ASP 5 HA ASP 5 7.596 11.458 47.580 71 HB2 ASP 5 HB2 ASP 5 9.725 11.183 48.907 72 HB3 ASP 5 HB3 ASP 5 10.576 10.879 47.395 73 H GLU 6 H GLU 6 8.311 9.014 45.363 74 HA GLU 6 HA GLU 6 8.707 10.857 43.074 75 HB2 GLU 6 HB2 GLU 6 10.258 8.962 43.435 76 HB3 GLU 6 HB3 GLU 6 8.915 7.828 43.245 77 HG2 GLU 6 HG2 GLU 6 8.519 8.691 40.959 78 HG3 GLU 6 HG3 GLU 6 9.803 9.879 41.181 79 H ILE 7 H ILE 7 6.605 11.746 43.072 80 HA ILE 7 HA ILE 7 4.555 10.018 41.771 81 HB ILE 7 HB ILE 7 3.749 12.180 43.748 82 HG12 ILE 7 HG12 ILE 7 2.931 10.012 45.071 83 HG13 ILE 7 HG13 ILE 7 4.318 9.258 44.301 84 HG21 ILE 7 HG21 ILE 7 2.255 9.839 42.468 85 HG22 ILE 7 HG22 ILE 7 1.562 11.066 43.551 86 HG23 ILE 7 HG23 ILE 7 2.134 11.534 41.952 87 HD11 ILE 7 HD11 ILE 7 4.296 11.698 46.138 88 HD12 ILE 7 HD12 ILE 7 4.916 10.078 46.518 89 HD13 ILE 7 HD13 ILE 7 5.751 11.094 45.334 90 H ILE 8 H ILE 8 5.707 10.832 39.923 91 HA ILE 8 HA ILE 8 4.767 13.505 38.972 92 HB ILE 8 HB ILE 8 7.540 12.294 38.652 93 HG12 ILE 8 HG12 ILE 8 7.259 13.386 40.841 94 HG13 ILE 8 HG13 ILE 8 8.429 14.191 39.823 95 HG21 ILE 8 HG21 ILE 8 6.382 14.790 37.348 96 HG22 ILE 8 HG22 ILE 8 8.117 14.416 37.434 97 HG23 ILE 8 HG23 ILE 8 7.038 13.343 36.551 98 HD11 ILE 8 HD11 ILE 8 5.578 15.186 40.265 99 HD12 ILE 8 HD12 ILE 8 7.030 15.787 41.080 100 HD13 ILE 8 HD13 ILE 8 6.849 16.010 39.335 101 H GLU 9 H GLU 9 4.158 13.594 36.838 102 HA GLU 9 HA GLU 9 4.436 11.149 35.145 103 HB2 GLU 9 HB2 GLU 9 1.965 12.901 35.406 104 HB3 GLU 9 HB3 GLU 9 2.230 11.700 34.137 105 HG2 GLU 9 HG2 GLU 9 2.397 9.913 35.850 106 HG3 GLU 9 HG3 GLU 9 2.093 11.099 37.124 107 H GLN 10 H GLN 10 5.483 11.550 33.334 108 HA GLN 10 HA GLN 10 5.148 14.050 31.827 109 HB2 GLN 10 HB2 GLN 10 6.943 14.537 33.548 110 HB3 GLN 10 HB3 GLN 10 7.935 13.277 32.808 111 HG2 GLN 10 HG2 GLN 10 7.926 14.534 30.663 112 HG3 GLN 10 HG3 GLN 10 6.844 15.739 31.367 113 HE21 GLN 10 HE21 GLN 10 10.056 17.414 31.642 114 HE22 GLN 10 HE22 GLN 10 8.770 17.108 30.478 115 H ILE 11 H ILE 11 7.055 10.997 32.099 116 HA ILE 11 HA ILE 11 6.349 10.180 29.412 117 HB ILE 11 HB ILE 11 8.224 11.490 28.823 118 HG12 ILE 11 HG12 ILE 11 9.220 8.637 29.084 119 HG13 ILE 11 HG13 ILE 11 7.994 9.160 27.926 120 HG21 ILE 11 HG21 ILE 11 9.897 10.160 30.996 121 HG22 ILE 11 HG22 ILE 11 10.452 11.370 29.823 122 HG23 ILE 11 HG23 ILE 11 9.276 11.821 31.048 123 HD11 ILE 11 HD11 ILE 11 10.902 10.075 27.999 124 HD12 ILE 11 HD12 ILE 11 10.130 9.035 26.793 125 HD13 ILE 11 HD13 ILE 11 9.657 10.741 26.913 126 H GLN 12 H GLN 12 5.858 8.110 29.552 127 HA GLN 12 HA GLN 12 7.085 6.295 31.582 128 HB2 GLN 12 HB2 GLN 12 4.089 6.689 31.127 129 HB3 GLN 12 HB3 GLN 12 4.817 5.442 32.114 130 HG2 GLN 12 HG2 GLN 12 4.003 7.033 33.616 131 HG3 GLN 12 HG3 GLN 12 5.760 7.181 33.638 132 HE21 GLN 12 HE21 GLN 12 3.779 10.260 31.708 133 HE22 GLN 12 HE22 GLN 12 3.251 8.614 31.401 134 H LYS 13 H LYS 13 6.364 3.993 31.194 135 HA LYS 13 HA LYS 13 6.386 3.201 28.370 136 HB2 LYS 13 HB2 LYS 13 7.570 1.939 30.205 137 HB3 LYS 13 HB3 LYS 13 6.007 1.521 30.883 138 HG2 LYS 13 HG2 LYS 13 6.756 -0.365 29.633 139 HG3 LYS 13 HG3 LYS 13 5.425 0.339 28.734 140 HD2 LYS 13 HD2 LYS 13 7.123 -0.340 27.189 141 HD3 LYS 13 HD3 LYS 13 7.082 1.425 27.182 142 HE2 LYS 13 HE2 LYS 13 9.064 1.481 28.677 143 HE3 LYS 13 HE3 LYS 13 9.052 -0.285 28.771 144 HZ1 LYS 13 HZ1 LYS 13 9.515 1.281 26.290 145 HZ2 LYS 13 HZ2 LYS 13 10.660 0.487 27.136 146 HZ3 LYS 13 HZ3 LYS 13 9.491 -0.351 26.373 147 H GLU 14 H GLU 14 4.512 4.537 27.883 148 HA GLU 14 HA GLU 14 1.848 3.770 28.745 149 HB2 GLU 14 HB2 GLU 14 2.958 5.639 26.644 150 HB3 GLU 14 HB3 GLU 14 1.239 5.189 26.648 151 HG2 GLU 14 HG2 GLU 14 0.958 5.913 28.920 152 HG3 GLU 14 HG3 GLU 14 2.678 6.300 29.073 153 H ALA 15 H ALA 15 1.206 1.820 28.338 154 HA ALA 15 HA ALA 15 1.043 0.920 25.509 155 HB1 ALA 15 HB1 ALA 15 1.687 -0.817 27.927 156 HB2 ALA 15 HB2 ALA 15 1.396 -1.413 26.277 157 HB3 ALA 15 HB3 ALA 15 2.796 -0.374 26.613 158 H ILE 16 H ILE 16 -0.308 -0.259 28.585 159 HA ILE 16 HA ILE 16 -3.039 -0.123 27.397 160 HB ILE 16 HB ILE 16 -1.543 -2.292 28.853 161 HG12 ILE 16 HG12 ILE 16 -3.208 -2.327 26.299 162 HG13 ILE 16 HG13 ILE 16 -1.455 -2.169 26.374 163 HG21 ILE 16 HG21 ILE 16 -4.579 -2.256 28.510 164 HG22 ILE 16 HG22 ILE 16 -3.619 -3.642 29.085 165 HG23 ILE 16 HG23 ILE 16 -3.699 -2.187 30.055 166 HD11 ILE 16 HD11 ILE 16 -3.062 -4.621 27.145 167 HD12 ILE 16 HD12 ILE 16 -1.923 -4.425 25.809 168 HD13 ILE 16 HD13 ILE 16 -1.323 -4.420 27.478 169 H ASN 17 H ASN 17 -1.274 1.090 29.813 170 HA ASN 17 HA ASN 17 -3.278 1.008 31.888 171 HB2 ASN 17 HB2 ASN 17 -0.779 2.756 31.669 172 HB3 ASN 17 HB3 ASN 17 -1.731 2.518 33.133 173 HD21 ASN 17 HD21 ASN 17 1.132 -0.145 32.311 174 HD22 ASN 17 HD22 ASN 17 1.010 1.407 31.503 175 H SER 18 H SER 18 -2.985 3.006 29.163 176 HA SER 18 HA SER 18 -4.520 5.287 30.264 177 HB2 SER 18 HB2 SER 18 -4.137 6.217 27.966 178 HB3 SER 18 HB3 SER 18 -2.662 5.867 28.886 179 HG SER 18 HG SER 18 -2.507 5.095 26.737 180 H ASN 19 H ASN 19 -4.810 3.266 27.348 181 HA ASN 19 HA ASN 19 -7.485 4.061 26.864 182 HB2 ASN 19 HB2 ASN 19 -7.376 2.564 24.941 183 HB3 ASN 19 HB3 ASN 19 -5.878 3.472 25.097 184 HD21 ASN 19 HD21 ASN 19 -3.890 0.573 25.543 185 HD22 ASN 19 HD22 ASN 19 -3.924 2.321 25.516 186 H VAL 20 H VAL 20 -6.501 1.653 29.020 187 HA VAL 20 HA VAL 20 -8.920 0.047 28.862 188 HB VAL 20 HB VAL 20 -6.706 -0.754 29.702 189 HG11 VAL 20 HG11 VAL 20 -7.496 0.514 32.352 190 HG12 VAL 20 HG12 VAL 20 -6.045 -0.431 31.983 191 HG13 VAL 20 HG13 VAL 20 -6.244 1.179 31.274 192 HG21 VAL 20 HG21 VAL 20 -8.779 -2.043 30.002 193 HG22 VAL 20 HG22 VAL 20 -7.618 -2.295 31.316 194 HG23 VAL 20 HG23 VAL 20 -9.036 -1.263 31.578 195 H VAL 21 H VAL 21 -8.207 3.129 30.222 196 HA VAL 21 HA VAL 21 -10.861 3.195 31.609 197 HB VAL 21 HB VAL 21 -8.472 4.906 32.388 198 HG11 VAL 21 HG11 VAL 21 -11.164 4.359 33.739 199 HG12 VAL 21 HG12 VAL 21 -9.867 5.396 34.370 200 HG13 VAL 21 HG13 VAL 21 -10.724 5.863 32.901 201 HG21 VAL 21 HG21 VAL 21 -7.895 2.659 33.041 202 HG22 VAL 21 HG22 VAL 21 -8.429 3.525 34.476 203 HG23 VAL 21 HG23 VAL 21 -9.527 2.365 33.691 204 H LEU 22 H LEU 22 -11.644 3.589 29.443 205 HA LEU 22 HA LEU 22 -11.466 6.443 28.650 206 HB2 LEU 22 HB2 LEU 22 -9.906 4.664 27.364 207 HB3 LEU 22 HB3 LEU 22 -11.406 4.303 26.524 208 HG LEU 22 HG LEU 22 -11.535 6.833 26.016 209 HD11 LEU 22 HD11 LEU 22 -8.613 6.691 26.878 210 HD12 LEU 22 HD12 LEU 22 -9.390 8.058 26.053 211 HD13 LEU 22 HD13 LEU 22 -9.881 7.624 27.694 212 HD21 LEU 22 HD21 LEU 22 -10.880 5.181 24.322 213 HD22 LEU 22 HD22 LEU 22 -9.921 6.659 24.146 214 HD23 LEU 22 HD23 LEU 22 -9.202 5.222 24.904 215 H LYS 23 H LYS 23 -13.229 7.254 27.466 216 HA LYS 23 HA LYS 23 -15.782 5.695 27.676 217 HB2 LYS 23 HB2 LYS 23 -15.253 8.568 28.533 218 HB3 LYS 23 HB3 LYS 23 -16.842 7.791 28.484 219 HG2 LYS 23 HG2 LYS 23 -16.080 6.093 30.119 220 HG3 LYS 23 HG3 LYS 23 -14.515 6.922 30.245 221 HD2 LYS 23 HD2 LYS 23 -15.652 8.987 30.991 222 HD3 LYS 23 HD3 LYS 23 -17.222 8.184 30.896 223 HE2 LYS 23 HE2 LYS 23 -14.912 7.288 32.684 224 HE3 LYS 23 HE3 LYS 23 -16.219 8.351 33.209 225 HZ1 LYS 23 HZ1 LYS 23 -16.591 5.560 32.264 226 HZ2 LYS 23 HZ2 LYS 23 -16.698 6.066 33.809 227 HZ3 LYS 23 HZ3 LYS 23 -17.800 6.564 32.717 228 H ASN 24 H ASN 24 -14.546 5.661 25.325 229 HA ASN 24 HA ASN 24 -14.633 6.131 23.099 230 HB2 ASN 24 HB2 ASN 24 -16.680 4.910 23.474 231 HB3 ASN 24 HB3 ASN 24 -17.554 6.395 23.859 232 HD21 ASN 24 HD21 ASN 24 -16.591 5.714 19.912 233 HD22 ASN 24 HD22 ASN 24 -15.495 5.111 21.135 234 HA PRO 25 HA PRO 25 -14.580 10.753 23.088 235 HB2 PRO 25 HB2 PRO 25 -11.939 11.221 22.743 236 HB3 PRO 25 HB3 PRO 25 -12.630 10.787 24.331 237 HG2 PRO 25 HG2 PRO 25 -11.286 8.931 22.339 238 HG3 PRO 25 HG3 PRO 25 -10.949 9.103 24.091 239 HD2 PRO 25 HD2 PRO 25 -12.620 7.171 23.086 240 HD3 PRO 25 HD3 PRO 25 -12.893 7.940 24.679 241 H ARG 26 H ARG 26 -15.794 9.617 21.226 242 HA ARG 26 HA ARG 26 -16.332 9.307 19.030 243 HB2 ARG 26 HB2 ARG 26 -14.623 11.796 18.676 244 HB3 ARG 26 HB3 ARG 26 -15.672 11.092 17.450 245 HG2 ARG 26 HG2 ARG 26 -16.938 12.805 18.330 246 HG3 ARG 26 HG3 ARG 26 -17.619 11.339 19.046 247 HD2 ARG 26 HD2 ARG 26 -16.570 11.828 21.182 248 HD3 ARG 26 HD3 ARG 26 -15.604 13.135 20.456 249 HE ARG 26 HE ARG 26 -18.428 13.603 20.098 250 HH11 ARG 26 HH11 ARG 26 -19.462 15.216 21.217 251 HH12 ARG 26 HH12 ARG 26 -18.752 15.863 22.667 252 HH21 ARG 26 HH21 ARG 26 -15.966 13.867 22.580 253 HH22 ARG 26 HH22 ARG 26 -16.826 15.126 23.423 254 H VAL 27 H VAL 27 -14.846 7.409 19.602 255 HA VAL 27 HA VAL 27 -12.934 7.001 17.318 256 HB VAL 27 HB VAL 27 -12.887 5.524 19.963 257 HG11 VAL 27 HG11 VAL 27 -10.986 5.520 17.563 258 HG12 VAL 27 HG12 VAL 27 -10.725 4.664 19.098 259 HG13 VAL 27 HG13 VAL 27 -12.047 4.180 18.033 260 HG21 VAL 27 HG21 VAL 27 -12.116 7.823 20.303 261 HG22 VAL 27 HG22 VAL 27 -10.743 6.717 20.328 262 HG23 VAL 27 HG23 VAL 27 -11.055 7.707 18.883 263 HA PRO 28 HA PRO 28 -16.353 4.063 16.373 264 HB2 PRO 28 HB2 PRO 28 -16.384 4.369 13.682 265 HB3 PRO 28 HB3 PRO 28 -17.264 5.463 14.796 266 HG2 PRO 28 HG2 PRO 28 -14.539 5.913 13.524 267 HG3 PRO 28 HG3 PRO 28 -15.907 7.062 13.632 268 HD2 PRO 28 HD2 PRO 28 -13.792 7.082 15.361 269 HD3 PRO 28 HD3 PRO 28 -15.447 7.510 15.891 270 H THR 29 H THR 29 -16.304 2.171 15.019 271 HA THR 29 HA THR 29 -13.591 0.969 14.870 272 HB THR 29 HB THR 29 -14.934 -1.029 15.761 273 HG1 THR 29 HG1 THR 29 -16.785 -0.518 16.912 274 HG21 THR 29 HG21 THR 29 -14.635 1.396 17.581 275 HG22 THR 29 HG22 THR 29 -14.726 -0.302 18.098 276 HG23 THR 29 HG23 THR 29 -13.336 0.260 17.155 277 H GLN 30 H GLN 30 -13.740 1.561 12.634 278 HA GLN 30 HA GLN 30 -15.345 -0.254 10.958 279 HB2 GLN 30 HB2 GLN 30 -14.745 1.221 9.082 280 HB3 GLN 30 HB3 GLN 30 -15.555 2.065 10.384 281 HG2 GLN 30 HG2 GLN 30 -12.514 2.054 10.135 282 HG3 GLN 30 HG3 GLN 30 -13.525 3.215 9.271 283 HE21 GLN 30 HE21 GLN 30 -12.748 3.869 13.186 284 HE22 GLN 30 HE22 GLN 30 -11.837 2.728 12.200 285 H LYS 31 H LYS 31 -13.038 -1.269 12.410 286 HA LYS 31 HA LYS 31 -10.932 -1.827 10.458 287 HB2 LYS 31 HB2 LYS 31 -10.798 -1.279 12.966 288 HB3 LYS 31 HB3 LYS 31 -11.209 -2.949 13.270 289 HG2 LYS 31 HG2 LYS 31 -8.793 -2.018 11.617 290 HG3 LYS 31 HG3 LYS 31 -8.773 -2.249 13.354 291 HD2 LYS 31 HD2 LYS 31 -7.885 -4.233 12.770 292 HD3 LYS 31 HD3 LYS 31 -9.582 -4.702 12.804 293 HE2 LYS 31 HE2 LYS 31 -9.619 -4.271 10.274 294 HE3 LYS 31 HE3 LYS 31 -7.881 -3.983 10.363 295 HZ1 LYS 31 HZ1 LYS 31 -9.245 -6.516 11.116 296 HZ2 LYS 31 HZ2 LYS 31 -8.353 -6.287 9.765 297 HZ3 LYS 31 HZ3 LYS 31 -7.634 -6.263 11.229 298 H THR 32 H THR 32 -12.826 -2.740 9.114 299 HA THR 32 HA THR 32 -12.861 -5.719 9.347 300 HB THR 32 HB THR 32 -14.810 -4.617 10.484 301 HG1 THR 32 HG1 THR 32 -16.272 -6.092 9.688 302 HG21 THR 32 HG21 THR 32 -15.792 -4.031 7.661 303 HG22 THR 32 HG22 THR 32 -16.683 -3.805 9.180 304 HG23 THR 32 HG23 THR 32 -15.261 -2.809 8.840 305 H GLY 33 H GLY 33 -11.752 -3.522 7.388 306 HA2 GLY 33 HA2 GLY 33 -13.057 -3.924 4.861 307 HA3 GLY 33 HA3 GLY 33 -11.455 -3.231 5.115 308 H GLU 34 H GLU 34 -9.956 -5.232 6.090 309 HA GLU 34 HA GLU 34 -8.629 -6.968 5.482 310 HB2 GLU 34 HB2 GLU 34 -11.313 -8.361 5.247 311 HB3 GLU 34 HB3 GLU 34 -9.741 -9.150 5.431 312 HG2 GLU 34 HG2 GLU 34 -9.412 -7.902 7.588 313 HG3 GLU 34 HG3 GLU 34 -11.071 -7.318 7.460 314 H LEU 35 H LEU 35 -9.042 -5.271 3.296 315 HA LEU 35 HA LEU 35 -8.764 -4.997 1.105 316 HB2 LEU 35 HB2 LEU 35 -6.903 -7.123 1.884 317 HB3 LEU 35 HB3 LEU 35 -7.321 -7.220 0.187 318 HG LEU 35 HG LEU 35 -6.745 -4.810 -0.095 319 HD11 LEU 35 HD11 LEU 35 -5.599 -5.099 2.724 320 HD12 LEU 35 HD12 LEU 35 -5.312 -3.735 1.627 321 HD13 LEU 35 HD13 LEU 35 -6.936 -4.025 2.264 322 HD21 LEU 35 HD21 LEU 35 -5.181 -6.595 -0.684 323 HD22 LEU 35 HD22 LEU 35 -4.306 -5.203 -0.023 324 HD23 LEU 35 HD23 LEU 35 -4.593 -6.641 0.987 325 H SER 36 H SER 36 -10.763 -4.915 0.321 326 HA SER 36 HA SER 36 -12.201 -7.361 -0.482 327 HB2 SER 36 HB2 SER 36 -13.396 -5.567 0.690 328 HB3 SER 36 HB3 SER 36 -13.080 -4.480 -0.672 329 HG SER 36 HG SER 36 -15.140 -5.546 -0.792 330 H GLU 37 H GLU 37 -11.670 -4.383 -2.289 331 HA GLU 37 HA GLU 37 -10.558 -5.808 -4.580 332 HB2 GLU 37 HB2 GLU 37 -13.340 -5.933 -4.260 333 HB3 GLU 37 HB3 GLU 37 -13.152 -4.512 -5.304 334 HG2 GLU 37 HG2 GLU 37 -11.643 -5.920 -6.773 335 HG3 GLU 37 HG3 GLU 37 -12.007 -7.295 -5.720 336 H GLU 38 H GLU 38 -12.029 -2.829 -3.331 337 HA GLU 38 HA GLU 38 -10.613 -1.131 -5.244 338 HB2 GLU 38 HB2 GLU 38 -12.760 -0.531 -4.149 339 HB3 GLU 38 HB3 GLU 38 -11.931 -0.435 -2.589 340 HG2 GLU 38 HG2 GLU 38 -10.556 1.420 -3.386 341 HG3 GLU 38 HG3 GLU 38 -11.164 1.220 -5.032 342 H GLN 39 H GLN 39 -9.909 -2.455 -2.018 343 HA GLN 39 HA GLN 39 -7.869 -0.569 -1.313 344 HB2 GLN 39 HB2 GLN 39 -8.444 -3.389 -0.338 345 HB3 GLN 39 HB3 GLN 39 -7.295 -2.284 0.416 346 HG2 GLN 39 HG2 GLN 39 -9.263 -2.127 1.716 347 HG3 GLN 39 HG3 GLN 39 -9.192 -0.647 0.766 348 HE21 GLN 39 HE21 GLN 39 -12.629 -1.302 0.192 349 HE22 GLN 39 HE22 GLN 39 -11.461 -0.316 1.066 350 H LYS 40 H LYS 40 -7.609 -3.817 -2.763 351 HA LYS 40 HA LYS 40 -4.724 -3.684 -3.085 352 HB2 LYS 40 HB2 LYS 40 -4.976 -5.735 -4.391 353 HB3 LYS 40 HB3 LYS 40 -5.837 -5.789 -2.862 354 HG2 LYS 40 HG2 LYS 40 -7.915 -4.998 -4.372 355 HG3 LYS 40 HG3 LYS 40 -6.918 -5.623 -5.677 356 HD2 LYS 40 HD2 LYS 40 -8.501 -7.317 -4.925 357 HD3 LYS 40 HD3 LYS 40 -6.865 -7.851 -4.517 358 HE2 LYS 40 HE2 LYS 40 -7.179 -7.230 -2.171 359 HE3 LYS 40 HE3 LYS 40 -8.705 -6.423 -2.528 360 HZ1 LYS 40 HZ1 LYS 40 -8.269 -9.349 -2.843 361 HZ2 LYS 40 HZ2 LYS 40 -9.033 -8.628 -1.574 362 HZ3 LYS 40 HZ3 LYS 40 -9.692 -8.537 -3.048 363 H LYS 41 H LYS 41 -7.396 -2.540 -5.066 364 HA LYS 41 HA LYS 41 -5.689 -1.710 -7.290 365 HB2 LYS 41 HB2 LYS 41 -8.489 -0.829 -6.498 366 HB3 LYS 41 HB3 LYS 41 -7.653 -0.322 -7.966 367 HG2 LYS 41 HG2 LYS 41 -7.481 -2.619 -8.744 368 HG3 LYS 41 HG3 LYS 41 -8.212 -3.212 -7.248 369 HD2 LYS 41 HD2 LYS 41 -10.302 -1.942 -7.785 370 HD3 LYS 41 HD3 LYS 41 -9.566 -1.428 -9.320 371 HE2 LYS 41 HE2 LYS 41 -9.315 -3.822 -9.979 372 HE3 LYS 41 HE3 LYS 41 -10.063 -4.313 -8.451 373 HZ1 LYS 41 HZ1 LYS 41 -11.402 -2.703 -10.560 374 HZ2 LYS 41 HZ2 LYS 41 -11.679 -4.281 -10.264 375 HZ3 LYS 41 HZ3 LYS 41 -12.095 -3.166 -9.152 376 H ILE 42 H ILE 42 -5.589 -0.651 -4.184 377 HA ILE 42 HA ILE 42 -4.382 1.963 -5.026 378 HB ILE 42 HB ILE 42 -5.527 1.028 -2.390 379 HG12 ILE 42 HG12 ILE 42 -6.292 3.628 -3.690 380 HG13 ILE 42 HG13 ILE 42 -6.834 2.180 -4.517 381 HG21 ILE 42 HG21 ILE 42 -3.972 3.588 -2.901 382 HG22 ILE 42 HG22 ILE 42 -4.923 3.221 -1.442 383 HG23 ILE 42 HG23 ILE 42 -3.505 2.251 -1.824 384 HD11 ILE 42 HD11 ILE 42 -7.406 2.802 -1.608 385 HD12 ILE 42 HD12 ILE 42 -8.547 2.876 -2.980 386 HD13 ILE 42 HD13 ILE 42 -7.867 1.323 -2.477 387 H VAL 43 H VAL 43 -3.773 -0.977 -2.997 388 HA VAL 43 HA VAL 43 -0.981 -0.210 -2.662 389 HB VAL 43 HB VAL 43 -2.207 -2.913 -2.026 390 HG11 VAL 43 HG11 VAL 43 0.372 -1.495 -1.179 391 HG12 VAL 43 HG12 VAL 43 -0.224 -2.985 -0.443 392 HG13 VAL 43 HG13 VAL 43 0.250 -2.985 -2.136 393 HG21 VAL 43 HG21 VAL 43 -3.404 -1.218 -0.783 394 HG22 VAL 43 HG22 VAL 43 -2.298 -2.038 0.312 395 HG23 VAL 43 HG23 VAL 43 -1.890 -0.424 -0.299 396 H ALA 44 H ALA 44 -2.380 -3.089 -4.391 397 HA ALA 44 HA ALA 44 0.177 -3.782 -5.504 398 HB1 ALA 44 HB1 ALA 44 -2.607 -4.685 -6.325 399 HB2 ALA 44 HB2 ALA 44 -1.066 -5.474 -6.722 400 HB3 ALA 44 HB3 ALA 44 -1.609 -5.406 -5.036 401 H ASP 45 H ASP 45 -2.492 -1.797 -6.708 402 HA ASP 45 HA ASP 45 -1.440 -1.278 -9.338 403 HB2 ASP 45 HB2 ASP 45 -3.755 -0.770 -8.459 404 HB3 ASP 45 HB3 ASP 45 -3.051 0.540 -7.506 405 H TYR 46 H TYR 46 -0.213 -0.203 -6.256 406 HA TYR 46 HA TYR 46 1.461 1.910 -7.487 407 HB2 TYR 46 HB2 TYR 46 0.306 1.781 -5.080 408 HB3 TYR 46 HB3 TYR 46 1.784 0.949 -4.661 409 HD1 TYR 46 HD1 TYR 46 3.736 2.584 -6.337 410 HD2 TYR 46 HD2 TYR 46 0.458 3.736 -3.846 411 HE1 TYR 46 HE1 TYR 46 4.817 4.788 -6.018 412 HE2 TYR 46 HE2 TYR 46 1.625 5.860 -3.288 413 HH TYR 46 HH TYR 46 4.720 6.802 -4.858 414 H ILE 47 H ILE 47 1.709 -1.430 -6.257 415 HA ILE 47 HA ILE 47 4.544 -1.712 -6.423 416 HB ILE 47 HB ILE 47 2.342 -3.792 -6.692 417 HG12 ILE 47 HG12 ILE 47 1.992 -2.842 -4.582 418 HG13 ILE 47 HG13 ILE 47 2.962 -4.246 -4.230 419 HG21 ILE 47 HG21 ILE 47 5.237 -4.285 -5.933 420 HG22 ILE 47 HG22 ILE 47 3.918 -5.459 -5.927 421 HG23 ILE 47 HG23 ILE 47 4.457 -4.772 -7.455 422 HD11 ILE 47 HD11 ILE 47 3.873 -1.338 -4.320 423 HD12 ILE 47 HD12 ILE 47 3.731 -2.386 -2.897 424 HD13 ILE 47 HD13 ILE 47 4.990 -2.711 -4.110 425 H SER 48 H SER 48 2.209 -1.606 -8.982 426 HA SER 48 HA SER 48 4.184 -2.495 -11.002 427 HB2 SER 48 HB2 SER 48 2.364 -2.218 -12.613 428 HB3 SER 48 HB3 SER 48 1.951 -3.305 -11.278 429 HG SER 48 HG SER 48 0.271 -1.801 -11.777 430 H GLU 49 H GLU 49 3.664 0.481 -9.441 431 HA GLU 49 HA GLU 49 4.279 2.135 -11.835 432 HB2 GLU 49 HB2 GLU 49 3.722 2.865 -8.935 433 HB3 GLU 49 HB3 GLU 49 4.109 4.029 -10.195 434 HG2 GLU 49 HG2 GLU 49 1.788 2.126 -10.490 435 HG3 GLU 49 HG3 GLU 49 1.649 3.608 -9.548 436 H VAL 50 H VAL 50 5.614 1.657 -8.563 437 HA VAL 50 HA VAL 50 8.199 2.802 -9.540 438 HB VAL 50 HB VAL 50 8.520 3.738 -7.295 439 HG11 VAL 50 HG11 VAL 50 5.799 4.495 -8.392 440 HG12 VAL 50 HG12 VAL 50 6.894 5.486 -7.408 441 HG13 VAL 50 HG13 VAL 50 7.354 5.041 -9.059 442 HG21 VAL 50 HG21 VAL 50 7.287 2.102 -5.936 443 HG22 VAL 50 HG22 VAL 50 6.769 3.752 -5.647 444 HG23 VAL 50 HG23 VAL 50 5.786 2.655 -6.654 445 H GLY 51 H GLY 51 6.943 0.274 -7.389 446 HA2 GLY 51 HA2 GLY 51 8.488 -1.809 -8.064 447 HA3 GLY 51 HA3 GLY 51 9.617 -0.935 -7.030 448 H LEU 52 H LEU 52 9.039 -0.582 -4.834 449 HA LEU 52 HA LEU 52 6.840 -1.758 -3.478 450 HB2 LEU 52 HB2 LEU 52 7.860 -3.929 -4.131 451 HB3 LEU 52 HB3 LEU 52 9.412 -3.415 -3.484 452 HG LEU 52 HG LEU 52 8.421 -3.386 -1.182 453 HD11 LEU 52 HD11 LEU 52 5.988 -4.604 -2.557 454 HD12 LEU 52 HD12 LEU 52 6.249 -4.457 -0.800 455 HD13 LEU 52 HD13 LEU 52 6.045 -3.008 -1.782 456 HD21 LEU 52 HD21 LEU 52 9.593 -5.363 -2.067 457 HD22 LEU 52 HD22 LEU 52 8.310 -5.799 -0.924 458 HD23 LEU 52 HD23 LEU 52 8.052 -6.008 -2.676 459 H ASN 53 H ASN 53 10.295 -1.126 -3.231 460 HA ASN 53 HA ASN 53 10.070 -0.394 -0.385 461 HB2 ASN 53 HB2 ASN 53 12.519 -0.974 -2.085 462 HB3 ASN 53 HB3 ASN 53 12.522 -0.706 -0.343 463 HD21 ASN 53 HD21 ASN 53 11.895 -4.410 -1.617 464 HD22 ASN 53 HD22 ASN 53 12.576 -3.141 -2.619 465 H ASN 54 H ASN 54 9.281 1.330 -2.610 466 HA ASN 54 HA ASN 54 10.827 3.816 -2.168 467 HB2 ASN 54 HB2 ASN 54 10.897 3.882 -4.767 468 HB3 ASN 54 HB3 ASN 54 11.994 2.797 -3.919 469 HD21 ASN 54 HD21 ASN 54 10.890 0.573 -6.455 470 HD22 ASN 54 HD22 ASN 54 12.214 1.586 -5.891 471 H LEU 55 H LEU 55 7.784 2.431 -2.379 472 HA LEU 55 HA LEU 55 6.371 4.751 -3.495 473 HB2 LEU 55 HB2 LEU 55 4.396 3.467 -3.178 474 HB3 LEU 55 HB3 LEU 55 5.623 2.466 -3.915 475 HG LEU 55 HG LEU 55 6.016 1.586 -1.443 476 HD11 LEU 55 HD11 LEU 55 3.289 2.928 -1.309 477 HD12 LEU 55 HD12 LEU 55 3.664 1.510 -0.334 478 HD13 LEU 55 HD13 LEU 55 4.605 2.986 -0.115 479 HD21 LEU 55 HD21 LEU 55 5.163 0.285 -3.348 480 HD22 LEU 55 HD22 LEU 55 4.305 -0.126 -1.856 481 HD23 LEU 55 HD23 LEU 55 3.527 0.921 -3.069 482 H ASN 56 H ASN 56 4.653 5.851 -2.231 483 HA ASN 56 HA ASN 56 5.619 6.441 0.525 484 HB2 ASN 56 HB2 ASN 56 5.536 8.305 -1.055 485 HB3 ASN 56 HB3 ASN 56 3.809 8.031 -1.306 486 HD21 ASN 56 HD21 ASN 56 3.938 10.707 1.183 487 HD22 ASN 56 HD22 ASN 56 4.147 10.484 -0.548 488 H ALA 57 H ALA 57 4.687 5.383 2.072 489 HA ALA 57 HA ALA 57 2.274 3.904 1.986 490 HB1 ALA 57 HB1 ALA 57 3.879 5.027 4.323 491 HB2 ALA 57 HB2 ALA 57 2.710 3.691 4.419 492 HB3 ALA 57 HB3 ALA 57 4.204 3.492 3.486 493 H THR 58 H THR 58 2.778 7.330 2.709 494 HA THR 58 HA THR 58 0.298 7.858 4.055 495 HB THR 58 HB THR 58 2.045 9.659 2.358 496 HG1 THR 58 HG1 THR 58 2.867 10.254 4.357 497 HG21 THR 58 HG21 THR 58 -0.174 10.331 4.329 498 HG22 THR 58 HG22 THR 58 1.011 11.503 3.692 499 HG23 THR 58 HG23 THR 58 -0.112 10.700 2.587 500 H GLU 59 H GLU 59 1.130 7.758 0.573 501 HA GLU 59 HA GLU 59 -1.456 8.697 -0.328 502 HB2 GLU 59 HB2 GLU 59 0.559 7.002 -1.817 503 HB3 GLU 59 HB3 GLU 59 -0.730 7.969 -2.528 504 HG2 GLU 59 HG2 GLU 59 1.754 8.974 -1.079 505 HG3 GLU 59 HG3 GLU 59 1.414 9.100 -2.794 506 H LEU 60 H LEU 60 -0.154 5.439 0.273 507 HA LEU 60 HA LEU 60 -2.516 3.955 -0.431 508 HB2 LEU 60 HB2 LEU 60 -0.264 3.470 1.552 509 HB3 LEU 60 HB3 LEU 60 -1.653 2.400 1.479 510 HG LEU 60 HG LEU 60 -1.175 1.772 -0.808 511 HD11 LEU 60 HD11 LEU 60 1.201 3.656 -0.603 512 HD12 LEU 60 HD12 LEU 60 0.954 2.448 -1.886 513 HD13 LEU 60 HD13 LEU 60 -0.179 3.794 -1.714 514 HD21 LEU 60 HD21 LEU 60 -0.078 0.540 1.037 515 HD22 LEU 60 HD22 LEU 60 0.981 0.608 -0.386 516 HD23 LEU 60 HD23 LEU 60 1.284 1.678 0.994 517 H SER 61 H SER 61 -1.527 5.295 2.783 518 HA SER 61 HA SER 61 -3.872 4.403 4.099 519 HB2 SER 61 HB2 SER 61 -3.076 5.679 5.987 520 HB3 SER 61 HB3 SER 61 -1.729 4.844 5.198 521 HG SER 61 HG SER 61 -1.068 6.917 5.535 522 H LYS 62 H LYS 62 -3.235 7.403 2.433 523 HA LYS 62 HA LYS 62 -5.560 8.926 3.159 524 HB2 LYS 62 HB2 LYS 62 -3.768 8.807 0.718 525 HB3 LYS 62 HB3 LYS 62 -5.207 9.816 0.700 526 HG2 LYS 62 HG2 LYS 62 -4.440 11.227 2.431 527 HG3 LYS 62 HG3 LYS 62 -3.131 10.125 2.896 528 HD2 LYS 62 HD2 LYS 62 -1.973 10.491 0.790 529 HD3 LYS 62 HD3 LYS 62 -3.330 11.437 0.143 530 HE2 LYS 62 HE2 LYS 62 -2.935 13.183 1.849 531 HE3 LYS 62 HE3 LYS 62 -1.621 12.222 2.541 532 HZ1 LYS 62 HZ1 LYS 62 -1.674 13.398 -0.186 533 HZ2 LYS 62 HZ2 LYS 62 -0.675 13.825 1.033 534 HZ3 LYS 62 HZ3 LYS 62 -0.519 12.356 0.304 535 H ARG 63 H ARG 63 -5.123 6.680 0.387 536 HA ARG 63 HA ARG 63 -7.956 7.019 -0.381 537 HB2 ARG 63 HB2 ARG 63 -5.688 5.422 -1.634 538 HB3 ARG 63 HB3 ARG 63 -7.329 5.546 -2.287 539 HG2 ARG 63 HG2 ARG 63 -7.032 8.066 -2.354 540 HG3 ARG 63 HG3 ARG 63 -5.340 7.820 -1.913 541 HD2 ARG 63 HD2 ARG 63 -4.819 7.512 -4.057 542 HD3 ARG 63 HD3 ARG 63 -5.799 6.060 -4.115 543 HE ARG 63 HE ARG 63 -6.429 8.716 -5.176 544 HH11 ARG 63 HH11 ARG 63 -8.265 9.086 -6.342 545 HH12 ARG 63 HH12 ARG 63 -9.539 7.906 -6.358 546 HH21 ARG 63 HH21 ARG 63 -7.958 5.679 -4.301 547 HH22 ARG 63 HH22 ARG 63 -9.384 6.047 -5.232 548 H LEU 64 H LEU 64 -6.008 4.421 1.005 549 HA LEU 64 HA LEU 64 -8.198 2.482 0.991 550 HB2 LEU 64 HB2 LEU 64 -5.604 2.242 0.798 551 HB3 LEU 64 HB3 LEU 64 -5.615 2.262 2.555 552 HG LEU 64 HG LEU 64 -7.094 0.281 0.777 553 HD11 LEU 64 HD11 LEU 64 -4.418 0.011 2.199 554 HD12 LEU 64 HD12 LEU 64 -5.240 -1.258 1.265 555 HD13 LEU 64 HD13 LEU 64 -4.667 0.201 0.450 556 HD21 LEU 64 HD21 LEU 64 -8.083 0.176 2.985 557 HD22 LEU 64 HD22 LEU 64 -6.993 -1.195 2.841 558 HD23 LEU 64 HD23 LEU 64 -6.484 0.232 3.762 559 H ASN 65 H ASN 65 -7.107 5.012 3.116 560 HA ASN 65 HA ASN 65 -7.897 5.908 5.000 561 HB2 ASN 65 HB2 ASN 65 -10.053 5.728 3.735 562 HB3 ASN 65 HB3 ASN 65 -10.429 4.278 4.667 563 HD21 ASN 65 HD21 ASN 65 -10.960 6.139 7.729 564 HD22 ASN 65 HD22 ASN 65 -10.299 4.607 7.141 565 H ILE 66 H ILE 66 -6.069 4.681 5.720 566 HA ILE 66 HA ILE 66 -6.678 3.034 8.119 567 HB ILE 66 HB ILE 66 -4.445 1.798 7.620 568 HG12 ILE 66 HG12 ILE 66 -5.100 2.697 4.799 569 HG13 ILE 66 HG13 ILE 66 -3.704 3.171 5.790 570 HG21 ILE 66 HG21 ILE 66 -6.897 1.090 6.008 571 HG22 ILE 66 HG22 ILE 66 -5.579 0.001 6.526 572 HG23 ILE 66 HG23 ILE 66 -6.616 0.749 7.736 573 HD11 ILE 66 HD11 ILE 66 -4.246 0.397 4.690 574 HD12 ILE 66 HD12 ILE 66 -3.089 1.590 4.084 575 HD13 ILE 66 HD13 ILE 66 -2.854 0.873 5.700 576 H THR 67 H THR 67 -4.628 2.854 9.433 577 HA THR 67 HA THR 67 -3.436 5.456 10.074 578 HB THR 67 HB THR 67 -3.130 2.608 11.080 579 HG1 THR 67 HG1 THR 67 -4.028 3.564 12.930 580 HG21 THR 67 HG21 THR 67 -1.588 5.057 11.995 581 HG22 THR 67 HG22 THR 67 -1.773 3.562 12.949 582 HG23 THR 67 HG23 THR 67 -0.947 3.500 11.396 583 H VAL 68 H VAL 68 -1.396 6.141 9.428 584 HA VAL 68 HA VAL 68 -0.277 5.176 7.033 585 HB VAL 68 HB VAL 68 1.367 6.650 9.120 586 HG11 VAL 68 HG11 VAL 68 1.332 6.744 6.067 587 HG12 VAL 68 HG12 VAL 68 2.388 7.700 7.123 588 HG13 VAL 68 HG13 VAL 68 2.560 5.945 7.067 589 HG21 VAL 68 HG21 VAL 68 -0.708 7.916 9.025 590 HG22 VAL 68 HG22 VAL 68 0.537 8.779 8.130 591 HG23 VAL 68 HG23 VAL 68 -0.704 7.872 7.249 592 H ASP 69 H ASP 69 0.633 4.376 10.358 593 HA ASP 69 HA ASP 69 2.932 2.822 9.651 594 HB2 ASP 69 HB2 ASP 69 2.516 3.856 11.884 595 HB3 ASP 69 HB3 ASP 69 1.226 2.684 12.165 596 H LYS 70 H LYS 70 -0.481 1.967 9.693 597 HA LYS 70 HA LYS 70 0.003 -0.920 9.593 598 HB2 LYS 70 HB2 LYS 70 -2.456 0.750 8.912 599 HB3 LYS 70 HB3 LYS 70 -2.381 -1.010 8.798 600 HG2 LYS 70 HG2 LYS 70 -1.792 -1.157 11.204 601 HG3 LYS 70 HG3 LYS 70 -1.942 0.602 11.350 602 HD2 LYS 70 HD2 LYS 70 -4.320 0.443 10.606 603 HD3 LYS 70 HD3 LYS 70 -4.179 -1.315 10.522 604 HE2 LYS 70 HE2 LYS 70 -3.774 0.368 13.044 605 HE3 LYS 70 HE3 LYS 70 -5.281 -0.441 12.608 606 HZ1 LYS 70 HZ1 LYS 70 -2.708 -1.824 13.162 607 HZ2 LYS 70 HZ2 LYS 70 -4.011 -1.800 14.139 608 HZ3 LYS 70 HZ3 LYS 70 -4.089 -2.574 12.706 609 H ALA 71 H ALA 71 -0.179 1.691 7.225 610 HA ALA 71 HA ALA 71 -0.051 -0.125 4.899 611 HB1 ALA 71 HB1 ALA 71 0.625 2.851 5.149 612 HB2 ALA 71 HB2 ALA 71 0.431 1.934 3.644 613 HB3 ALA 71 HB3 ALA 71 -0.956 2.199 4.717 614 H LYS 72 H LYS 72 2.306 1.841 6.741 615 HA LYS 72 HA LYS 72 4.659 1.168 5.305 616 HB2 LYS 72 HB2 LYS 72 4.260 1.877 8.223 617 HB3 LYS 72 HB3 LYS 72 5.850 1.675 7.479 618 HG2 LYS 72 HG2 LYS 72 5.481 3.508 5.958 619 HG3 LYS 72 HG3 LYS 72 3.801 3.658 6.459 620 HD2 LYS 72 HD2 LYS 72 5.142 5.429 7.466 621 HD3 LYS 72 HD3 LYS 72 4.417 4.385 8.676 622 HE2 LYS 72 HE2 LYS 72 6.634 4.894 9.397 623 HE3 LYS 72 HE3 LYS 72 6.594 3.190 8.953 624 HZ1 LYS 72 HZ1 LYS 72 7.659 5.385 7.242 625 HZ2 LYS 72 HZ2 LYS 72 8.567 4.321 8.075 626 HZ3 LYS 72 HZ3 LYS 72 7.655 3.802 6.827 627 H THR 73 H THR 73 3.149 -0.681 7.977 628 HA THR 73 HA THR 73 5.269 -2.731 7.749 629 HB THR 73 HB THR 73 4.249 -2.020 9.929 630 HG1 THR 73 HG1 THR 73 4.476 -4.087 10.710 631 HG21 THR 73 HG21 THR 73 2.031 -3.985 9.206 632 HG22 THR 73 HG22 THR 73 2.250 -3.095 10.726 633 HG23 THR 73 HG23 THR 73 1.821 -2.222 9.249 634 H TYR 74 H TYR 74 1.843 -2.466 6.717 635 HA TYR 74 HA TYR 74 1.528 -5.173 5.936 636 HB2 TYR 74 HB2 TYR 74 -0.370 -3.746 6.205 637 HB3 TYR 74 HB3 TYR 74 0.232 -2.613 4.983 638 HD1 TYR 74 HD1 TYR 74 -0.814 -6.207 5.386 639 HD2 TYR 74 HD2 TYR 74 -0.427 -2.793 2.769 640 HE1 TYR 74 HE1 TYR 74 -1.765 -7.537 3.509 641 HE2 TYR 74 HE2 TYR 74 -1.432 -4.098 0.931 642 HH TYR 74 HH TYR 74 -2.209 -7.588 1.263 643 H ILE 75 H ILE 75 2.894 -2.428 4.113 644 HA ILE 75 HA ILE 75 3.260 -3.499 1.561 645 HB ILE 75 HB ILE 75 4.984 -1.724 3.314 646 HG12 ILE 75 HG12 ILE 75 3.501 -0.974 0.756 647 HG13 ILE 75 HG13 ILE 75 2.670 -1.019 2.295 648 HG21 ILE 75 HG21 ILE 75 5.486 -2.372 0.385 649 HG22 ILE 75 HG22 ILE 75 6.286 -1.074 1.286 650 HG23 ILE 75 HG23 ILE 75 6.576 -2.741 1.746 651 HD11 ILE 75 HD11 ILE 75 5.018 0.777 1.565 652 HD12 ILE 75 HD12 ILE 75 3.361 1.252 1.974 653 HD13 ILE 75 HD13 ILE 75 4.418 0.584 3.220 654 H LYS 76 H LYS 76 5.310 -4.166 4.438 655 HA LYS 76 HA LYS 76 6.918 -6.156 2.913 656 HB2 LYS 76 HB2 LYS 76 6.949 -5.144 5.812 657 HB3 LYS 76 HB3 LYS 76 8.035 -6.413 5.223 658 HG2 LYS 76 HG2 LYS 76 9.009 -4.983 3.590 659 HG3 LYS 76 HG3 LYS 76 7.870 -3.672 3.930 660 HD2 LYS 76 HD2 LYS 76 9.902 -4.742 5.937 661 HD3 LYS 76 HD3 LYS 76 10.147 -3.320 4.910 662 HE2 LYS 76 HE2 LYS 76 8.125 -2.250 5.913 663 HE3 LYS 76 HE3 LYS 76 7.927 -3.642 6.984 664 HZ1 LYS 76 HZ1 LYS 76 10.300 -1.851 6.950 665 HZ2 LYS 76 HZ2 LYS 76 9.129 -1.842 8.086 666 HZ3 LYS 76 HZ3 LYS 76 10.112 -3.136 7.943 667 H ASN 77 H ASN 77 4.367 -6.213 5.371 668 HA ASN 77 HA ASN 77 4.771 -8.981 5.886 669 HB2 ASN 77 HB2 ASN 77 2.487 -7.079 6.455 670 HB3 ASN 77 HB3 ASN 77 2.261 -8.804 6.709 671 HD21 ASN 77 HD21 ASN 77 4.723 -6.774 9.260 672 HD22 ASN 77 HD22 ASN 77 4.261 -6.017 7.750 673 H SER 78 H SER 78 2.893 -7.352 3.397 674 HA SER 78 HA SER 78 1.641 -9.768 2.356 675 HB2 SER 78 HB2 SER 78 0.647 -7.517 2.208 676 HB3 SER 78 HB3 SER 78 1.942 -7.010 1.116 677 HG SER 78 HG SER 78 -0.036 -7.751 0.077 678 H ASN 79 H ASN 79 4.290 -7.683 1.166 679 HA ASN 79 HA ASN 79 4.712 -9.509 -1.101 680 HB2 ASN 79 HB2 ASN 79 6.032 -6.851 -0.502 681 HB3 ASN 79 HB3 ASN 79 6.114 -7.737 -2.019 682 HD21 ASN 79 HD21 ASN 79 2.887 -5.445 -1.149 683 HD22 ASN 79 HD22 ASN 79 4.228 -5.689 -0.012 684 H ARG 80 H ARG 80 6.404 -8.634 1.775 685 HA ARG 80 HA ARG 80 8.402 -8.893 2.587 686 HB2 ARG 80 HB2 ARG 80 6.991 -11.122 2.835 687 HB3 ARG 80 HB3 ARG 80 8.224 -11.825 1.810 688 HG2 ARG 80 HG2 ARG 80 8.881 -12.296 4.048 689 HG3 ARG 80 HG3 ARG 80 9.967 -11.019 3.513 690 HD2 ARG 80 HD2 ARG 80 9.260 -10.524 5.773 691 HD3 ARG 80 HD3 ARG 80 8.534 -9.339 4.703 692 HE ARG 80 HE ARG 80 6.408 -10.287 4.992 693 HH11 ARG 80 HH11 ARG 80 4.867 -11.514 6.085 694 HH12 ARG 80 HH12 ARG 80 5.382 -12.626 7.317 695 HH21 ARG 80 HH21 ARG 80 8.731 -12.121 6.873 696 HH22 ARG 80 HH22 ARG 80 7.492 -12.999 7.727 697 H MET 81 H MET 81 8.772 -7.924 0.117 698 HA MET 81 HA MET 81 10.262 -7.520 -1.554 699 HB2 MET 81 HB2 MET 81 12.329 -8.754 0.291 700 HB3 MET 81 HB3 MET 81 12.634 -7.666 -1.063 701 HG2 MET 81 HG2 MET 81 11.427 -5.852 0.073 702 HG3 MET 81 HG3 MET 81 11.010 -6.932 1.400 703 HE1 MET 81 HE1 MET 81 13.866 -4.825 -0.304 704 HE2 MET 81 HE2 MET 81 15.293 -5.307 0.629 705 HE3 MET 81 HE3 MET 81 14.542 -6.460 -0.491 706 H GLY 82 H GLY 82 8.850 -10.145 -1.683 707 HA2 GLY 82 HA2 GLY 82 10.771 -11.873 -3.205 708 HA3 GLY 82 HA3 GLY 82 9.202 -12.347 -2.550 709 H ARG 83 H ARG 83 10.128 -9.526 -4.391 710 HA ARG 83 HA ARG 83 8.947 -8.153 -5.724 711 HB2 ARG 83 HB2 ARG 83 8.143 -10.696 -7.168 712 HB3 ARG 83 HB3 ARG 83 7.615 -9.085 -7.639 713 HG2 ARG 83 HG2 ARG 83 9.423 -9.664 -9.030 714 HG3 ARG 83 HG3 ARG 83 9.978 -8.384 -7.951 715 HD2 ARG 83 HD2 ARG 83 11.188 -10.069 -6.587 716 HD3 ARG 83 HD3 ARG 83 10.555 -11.352 -7.620 717 HE ARG 83 HE ARG 83 11.898 -10.562 -9.443 718 HH11 ARG 83 HH11 ARG 83 13.800 -9.797 -10.193 719 HH12 ARG 83 HH12 ARG 83 14.832 -8.825 -9.184 720 HH21 ARG 83 HH21 ARG 83 12.737 -8.899 -6.473 721 HH22 ARG 83 HH22 ARG 83 14.250 -8.331 -7.124 722 H THR 84 H THR 84 6.727 -10.800 -5.459 723 HA THR 84 HA THR 84 4.779 -9.250 -3.840 724 HB THR 84 HB THR 84 2.945 -9.551 -5.406 725 HG1 THR 84 HG1 THR 84 3.267 -10.457 -7.383 726 HG21 THR 84 HG21 THR 84 5.277 -8.418 -6.994 727 HG22 THR 84 HG22 THR 84 3.567 -7.948 -7.064 728 HG23 THR 84 HG23 THR 84 4.534 -7.582 -5.615 729 H ASN 85 H ASN 85 6.390 -11.786 -3.551 730 HA ASN 85 HA ASN 85 6.253 -13.865 -2.797 731 HB2 ASN 85 HB2 ASN 85 4.743 -12.598 -1.127 732 HB3 ASN 85 HB3 ASN 85 3.408 -13.466 -1.881 733 HD21 ASN 85 HD21 ASN 85 4.557 -16.671 -0.599 734 HD22 ASN 85 HD22 ASN 85 3.886 -15.951 -2.070 735 H ASN 86 H ASN 86 5.829 -13.499 -5.521 736 HA ASN 86 HA ASN 86 3.968 -15.647 -6.323 737 HB2 ASN 86 HB2 ASN 86 4.396 -14.936 -8.605 738 HB3 ASN 86 HB3 ASN 86 3.935 -13.576 -7.589 739 HD21 ASN 86 HD21 ASN 86 6.881 -11.814 -8.309 740 HD22 ASN 86 HD22 ASN 86 5.272 -11.799 -7.581 741 H PHE 87 H PHE 87 7.092 -15.726 -5.234 742 HA PHE 87 HA PHE 87 8.387 -17.439 -7.132 743 HB2 PHE 87 HB2 PHE 87 10.151 -17.542 -5.401 744 HB3 PHE 87 HB3 PHE 87 9.623 -15.917 -5.773 745 HD1 PHE 87 HD1 PHE 87 9.265 -18.664 -3.246 746 HD2 PHE 87 HD2 PHE 87 8.813 -14.460 -4.067 747 HE1 PHE 87 HE1 PHE 87 8.739 -18.259 -0.856 748 HE2 PHE 87 HE2 PHE 87 8.305 -14.064 -1.645 749 HZ PHE 87 HZ PHE 87 8.257 -15.951 -0.060 750 H LYS 88 H LYS 88 5.796 -18.481 -5.924 751 HA LYS 88 HA LYS 88 6.536 -20.995 -4.543 752 HB2 LYS 88 HB2 LYS 88 4.111 -21.252 -4.278 753 HB3 LYS 88 HB3 LYS 88 4.688 -19.698 -3.687 754 HG2 LYS 88 HG2 LYS 88 3.971 -19.077 -6.318 755 HG3 LYS 88 HG3 LYS 88 2.805 -20.333 -5.908 756 HD2 LYS 88 HD2 LYS 88 2.079 -19.029 -3.927 757 HD3 LYS 88 HD3 LYS 88 3.375 -17.866 -4.212 758 HE2 LYS 88 HE2 LYS 88 1.440 -16.815 -5.035 759 HE3 LYS 88 HE3 LYS 88 2.360 -17.321 -6.452 760 HZ1 LYS 88 HZ1 LYS 88 0.018 -18.772 -5.316 761 HZ2 LYS 88 HZ2 LYS 88 -0.008 -17.863 -6.669 762 HZ3 LYS 88 HZ3 LYS 88 0.852 -19.249 -6.639 763 H THR 89 H THR 89 6.326 -19.961 -7.648 764 HA THR 89 HA THR 89 5.917 -22.669 -8.835 765 HB THR 89 HB THR 89 4.785 -20.017 -9.831 766 HG1 THR 89 HG1 THR 89 2.793 -20.966 -9.303 767 HG21 THR 89 HG21 THR 89 4.431 -22.876 -10.788 768 HG22 THR 89 HG22 THR 89 3.530 -21.455 -11.393 769 HG23 THR 89 HG23 THR 89 5.281 -21.563 -11.646 770 H ILE 90 H ILE 90 7.056 -19.300 -9.371 771 HA ILE 90 HA ILE 90 8.841 -20.056 -11.543 772 HB ILE 90 HB ILE 90 8.846 -17.405 -10.065 773 HG12 ILE 90 HG12 ILE 90 6.910 -18.326 -12.237 774 HG13 ILE 90 HG13 ILE 90 6.502 -17.828 -10.593 775 HG21 ILE 90 HG21 ILE 90 9.404 -18.120 -12.990 776 HG22 ILE 90 HG22 ILE 90 9.584 -16.518 -12.245 777 HG23 ILE 90 HG23 ILE 90 10.654 -17.806 -11.772 778 HD11 ILE 90 HD11 ILE 90 7.449 -16.031 -12.833 779 HD12 ILE 90 HD12 ILE 90 5.893 -16.035 -11.994 780 HD13 ILE 90 HD13 ILE 90 7.355 -15.522 -11.127 781 H LYS 91 H LYS 91 11.159 -19.776 -11.466 782 HA LYS 91 HA LYS 91 13.263 -20.135 -10.741 783 HB2 LYS 91 HB2 LYS 91 12.365 -19.112 -8.024 784 HB3 LYS 91 HB3 LYS 91 14.019 -19.221 -8.595 785 HG2 LYS 91 HG2 LYS 91 11.899 -17.446 -9.869 786 HG3 LYS 91 HG3 LYS 91 13.015 -16.920 -8.633 787 HD2 LYS 91 HD2 LYS 91 14.810 -16.809 -10.022 788 HD3 LYS 91 HD3 LYS 91 14.348 -18.224 -10.971 789 HE2 LYS 91 HE2 LYS 91 12.686 -16.981 -12.206 790 HE3 LYS 91 HE3 LYS 91 12.911 -15.552 -11.181 791 HZ1 LYS 91 HZ1 LYS 91 14.995 -16.705 -12.964 792 HZ2 LYS 91 HZ2 LYS 91 14.127 -15.361 -13.284 793 HZ3 LYS 91 HZ3 LYS 91 15.178 -15.370 -12.038 794 H MET 92 H MET 92 10.884 -22.127 -9.503 795 HA MET 92 HA MET 92 12.719 -23.816 -7.924 796 HB2 MET 92 HB2 MET 92 9.874 -24.377 -8.830 797 HB3 MET 92 HB3 MET 92 10.823 -25.303 -7.658 798 HG2 MET 92 HG2 MET 92 11.000 -23.118 -6.310 799 HG3 MET 92 HG3 MET 92 9.736 -22.489 -7.367 800 HE1 MET 92 HE1 MET 92 8.154 -25.605 -7.627 801 HE2 MET 92 HE2 MET 92 6.815 -25.134 -6.563 802 HE3 MET 92 HE3 MET 92 7.438 -23.984 -7.767 803 H PHE 93 H PHE 93 10.949 -24.170 -11.018 804 HA PHE 93 HA PHE 93 12.277 -26.692 -11.640 805 HB2 PHE 93 HB2 PHE 93 10.456 -25.050 -13.423 806 HB3 PHE 93 HB3 PHE 93 10.753 -26.781 -13.487 807 HD1 PHE 93 HD1 PHE 93 9.945 -28.222 -11.475 808 HD2 PHE 93 HD2 PHE 93 8.703 -24.148 -12.145 809 HE1 PHE 93 HE1 PHE 93 7.973 -28.586 -9.999 810 HE2 PHE 93 HE2 PHE 93 6.708 -24.526 -10.692 811 HZ PHE 93 HZ PHE 93 6.350 -26.739 -9.615 812 H GLU 94 H GLU 94 12.884 -23.399 -12.343 813 HA GLU 94 HA GLU 94 14.360 -23.885 -14.860 814 HB2 GLU 94 HB2 GLU 94 13.405 -21.355 -13.469 815 HB3 GLU 94 HB3 GLU 94 14.271 -21.393 -15.023 816 HG2 GLU 94 HG2 GLU 94 12.389 -22.872 -15.898 817 HG3 GLU 94 HG3 GLU 94 11.509 -22.497 -14.408 818 H ASP 95 H ASP 95 15.357 -24.420 -11.958 819 HA ASP 95 HA ASP 95 17.646 -22.673 -11.659 820 HB2 ASP 95 HB2 ASP 95 16.506 -23.618 -9.727 821 HB3 ASP 95 HB3 ASP 95 16.866 -25.258 -10.267 822 H ASP 96 H ASP 96 19.340 -22.737 -12.953 823 HA ASP 96 HA ASP 96 20.867 -25.239 -13.345 824 HB2 ASP 96 HB2 ASP 96 19.967 -23.386 -15.591 825 HB3 ASP 96 HB3 ASP 96 21.392 -24.406 -15.719 826 H VAL 97 H VAL 97 23.040 -24.924 -13.259 827 HA VAL 97 HA VAL 97 24.151 -22.142 -13.177 828 HB VAL 97 HB VAL 97 24.807 -24.305 -11.139 829 HG11 VAL 97 HG11 VAL 97 25.715 -21.399 -11.357 830 HG12 VAL 97 HG12 VAL 97 26.063 -22.492 -9.999 831 HG13 VAL 97 HG13 VAL 97 26.737 -22.836 -11.590 832 HG21 VAL 97 HG21 VAL 97 22.594 -23.378 -10.631 833 HG22 VAL 97 HG22 VAL 97 23.777 -22.770 -9.475 834 HG23 VAL 97 HG23 VAL 97 23.221 -21.723 -10.801 835 H SER 98 H SER 98 25.060 -25.617 -13.193 836 HA SER 98 HA SER 98 27.391 -24.997 -14.946 837 HB2 SER 98 HB2 SER 98 28.412 -27.006 -13.945 838 HB3 SER 98 HB3 SER 98 28.031 -25.755 -12.756 839 HG SER 98 HG SER 98 27.440 -27.924 -12.145 840 H SER 99 H SER 99 24.558 -25.646 -15.824 841 HA SER 99 HA SER 99 23.297 -27.056 -17.067 842 HB2 SER 99 HB2 SER 99 25.939 -27.009 -18.499 843 HB3 SER 99 HB3 SER 99 24.431 -27.614 -19.240 844 HG SER 99 HG SER 99 24.805 -25.390 -19.703 845 H ALA 100 H ALA 100 24.293 -28.433 -14.839 846 HA ALA 100 HA ALA 100 24.011 -31.237 -15.722 847 HB1 ALA 100 HB1 ALA 100 26.248 -30.190 -13.928 848 HB2 ALA 100 HB2 ALA 100 25.878 -31.908 -14.202 849 HB3 ALA 100 HB3 ALA 100 26.433 -30.892 -15.546 850 H SER 101 H SER 101 23.595 -32.670 -13.766 851 HA SER 101 HA SER 101 21.871 -31.342 -11.723 852 HB2 SER 101 HB2 SER 101 20.929 -33.438 -13.723 853 HB3 SER 101 HB3 SER 101 19.994 -32.823 -12.349 854 HG SER 101 HG SER 101 19.454 -31.754 -14.305 855 H ALA 102 H ALA 102 21.116 -32.803 -10.062 856 HA ALA 102 HA ALA 102 21.513 -34.254 -8.383 857 HB1 ALA 102 HB1 ALA 102 21.992 -36.195 -10.655 858 HB2 ALA 102 HB2 ALA 102 21.465 -36.598 -9.005 859 HB3 ALA 102 HB3 ALA 102 20.398 -35.658 -10.072 860 H GLN 103 H GLN 103 23.813 -32.742 -9.162 861 HA GLN 103 HA GLN 103 26.218 -34.295 -9.132 862 HB2 GLN 103 HB2 GLN 103 25.639 -31.356 -8.624 863 HB3 GLN 103 HB3 GLN 103 27.276 -32.016 -8.646 864 HG2 GLN 103 HG2 GLN 103 27.117 -32.670 -10.947 865 HG3 GLN 103 HG3 GLN 103 25.379 -32.382 -10.998 866 HE21 GLN 103 HE21 GLN 103 25.652 -28.891 -11.555 867 HE22 GLN 103 HE22 GLN 103 24.568 -30.182 -11.061 868 HA PRO 104 HA PRO 104 26.702 -34.887 -4.686 869 HB2 PRO 104 HB2 PRO 104 29.405 -35.202 -4.429 870 HB3 PRO 104 HB3 PRO 104 28.339 -36.421 -5.188 871 HG2 PRO 104 HG2 PRO 104 30.027 -34.314 -6.572 872 HG3 PRO 104 HG3 PRO 104 29.896 -36.059 -6.954 873 HD2 PRO 104 HD2 PRO 104 28.468 -34.159 -8.300 874 HD3 PRO 104 HD3 PRO 104 27.789 -35.778 -7.962 875 H ASN 105 H ASN 105 26.075 -33.076 -3.667 876 HA ASN 105 HA ASN 105 28.010 -30.862 -3.156 877 HB2 ASN 105 HB2 ASN 105 26.617 -30.303 -5.137 878 HB3 ASN 105 HB3 ASN 105 25.152 -30.554 -4.192 879 HD21 ASN 105 HD21 ASN 105 25.453 -27.433 -2.453 880 HD22 ASN 105 HD22 ASN 105 24.797 -29.068 -2.325 881 H LEU 106 H LEU 106 28.282 -31.624 -1.071 882 HA LEU 106 HA LEU 106 25.946 -31.489 0.805 883 HB2 LEU 106 HB2 LEU 106 28.260 -33.451 0.771 884 HB3 LEU 106 HB3 LEU 106 27.058 -33.322 2.053 885 HG LEU 106 HG LEU 106 26.456 -34.096 -0.839 886 HD11 LEU 106 HD11 LEU 106 26.578 -35.784 1.692 887 HD12 LEU 106 HD12 LEU 106 26.109 -36.347 0.072 888 HD13 LEU 106 HD13 LEU 106 27.765 -35.798 0.368 889 HD21 LEU 106 HD21 LEU 106 24.484 -33.060 0.209 890 HD22 LEU 106 HD22 LEU 106 24.251 -34.802 0.067 891 HD23 LEU 106 HD23 LEU 106 24.677 -34.095 1.642 892 HA PRO 107 HA PRO 107 29.183 -28.446 2.166 893 HB2 PRO 107 HB2 PRO 107 27.516 -26.380 2.823 894 HB3 PRO 107 HB3 PRO 107 28.066 -26.709 1.151 895 HG2 PRO 107 HG2 PRO 107 25.453 -27.547 2.451 896 HG3 PRO 107 HG3 PRO 107 25.695 -26.754 0.861 897 HD2 PRO 107 HD2 PRO 107 25.374 -29.442 1.088 898 HD3 PRO 107 HD3 PRO 107 26.502 -28.746 -0.113 Start of MODEL 6 1 H1 GLY -5 H1 GLY -5 -23.998 -14.167 66.369 2 H2 GLY -5 H2 GLY -5 -25.148 -13.099 66.842 3 H3 GLY -5 H3 GLY -5 -24.267 -13.904 67.964 4 HA2 GLY -5 HA2 GLY -5 -23.494 -11.642 67.810 5 HA3 GLY -5 HA3 GLY -5 -22.246 -12.783 67.280 6 H SER -4 H SER -4 -21.258 -12.213 65.444 7 HA SER -4 HA SER -4 -22.714 -10.681 63.319 8 HB2 SER -4 HB2 SER -4 -19.870 -10.237 64.298 9 HB3 SER -4 HB3 SER -4 -20.643 -9.417 62.927 10 HG SER -4 HG SER -4 -20.731 -8.177 64.871 11 H HIS -3 H HIS -3 -21.903 -10.923 61.174 12 HA HIS -3 HA HIS -3 -20.526 -13.541 60.662 13 HB2 HIS -3 HB2 HIS -3 -22.990 -13.367 60.155 14 HB3 HIS -3 HB3 HIS -3 -22.600 -12.169 58.927 15 HD2 HIS -3 HD2 HIS -3 -21.046 -13.103 56.793 16 HE1 HIS -3 HE1 HIS -3 -21.996 -17.216 57.426 17 HE2 HIS -3 HE2 HIS -3 -21.009 -15.541 55.783 18 H MET -2 H MET -2 -18.618 -13.433 59.760 19 HA MET -2 HA MET -2 -17.972 -11.358 57.726 20 HB2 MET -2 HB2 MET -2 -16.218 -12.028 60.129 21 HB3 MET -2 HB3 MET -2 -15.735 -11.052 58.736 22 HG2 MET -2 HG2 MET -2 -17.558 -9.426 59.278 23 HG3 MET -2 HG3 MET -2 -17.968 -10.397 60.693 24 HE1 MET -2 HE1 MET -2 -15.618 -7.753 59.128 25 HE2 MET -2 HE2 MET -2 -14.231 -7.709 60.237 26 HE3 MET -2 HE3 MET -2 -14.463 -9.108 59.169 27 H ALA -1 H ALA -1 -17.702 -12.555 55.988 28 HA ALA -1 HA ALA -1 -15.929 -14.949 55.975 29 HB1 ALA -1 HB1 ALA -1 -18.786 -14.850 54.956 30 HB2 ALA -1 HB2 ALA -1 -17.682 -16.242 54.853 31 HB3 ALA -1 HB3 ALA -1 -18.249 -15.683 56.441 32 H SER 0 H SER 0 -15.342 -12.472 55.045 33 HA SER 0 HA SER 0 -15.901 -12.349 52.120 34 HB2 SER 0 HB2 SER 0 -15.309 -10.073 54.031 35 HB3 SER 0 HB3 SER 0 -15.901 -9.952 52.362 36 HG SER 0 HG SER 0 -17.607 -9.748 53.865 37 H MET 1 H MET 1 -13.431 -13.566 53.435 38 HA MET 1 HA MET 1 -11.418 -12.314 51.683 39 HB2 MET 1 HB2 MET 1 -9.823 -11.810 53.479 40 HB3 MET 1 HB3 MET 1 -11.317 -10.901 53.688 41 HG2 MET 1 HG2 MET 1 -12.082 -12.559 55.382 42 HG3 MET 1 HG3 MET 1 -10.565 -13.440 55.184 43 HE1 MET 1 HE1 MET 1 -10.157 -13.418 57.760 44 HE2 MET 1 HE2 MET 1 -10.210 -11.955 58.767 45 HE3 MET 1 HE3 MET 1 -11.693 -12.552 57.990 46 H ASP 2 H ASP 2 -12.483 -15.063 53.244 47 HA ASP 2 HA ASP 2 -10.121 -16.660 52.305 48 HB2 ASP 2 HB2 ASP 2 -11.787 -16.910 54.830 49 HB3 ASP 2 HB3 ASP 2 -10.837 -18.256 54.212 50 H GLN 3 H GLN 3 -13.064 -15.925 51.366 51 HA GLN 3 HA GLN 3 -13.931 -18.667 50.547 52 HB2 GLN 3 HB2 GLN 3 -15.005 -17.766 52.636 53 HB3 GLN 3 HB3 GLN 3 -15.603 -16.416 51.698 54 HG2 GLN 3 HG2 GLN 3 -16.488 -18.817 50.363 55 HG3 GLN 3 HG3 GLN 3 -16.719 -19.072 52.086 56 HE21 GLN 3 HE21 GLN 3 -18.725 -15.889 50.338 57 HE22 GLN 3 HE22 GLN 3 -17.174 -16.428 49.677 58 H LEU 4 H LEU 4 -12.500 -16.538 49.027 59 HA LEU 4 HA LEU 4 -14.488 -15.983 46.856 60 HB2 LEU 4 HB2 LEU 4 -12.219 -14.225 47.867 61 HB3 LEU 4 HB3 LEU 4 -12.999 -14.031 46.304 62 HG LEU 4 HG LEU 4 -15.225 -13.769 47.519 63 HD11 LEU 4 HD11 LEU 4 -13.343 -13.327 49.883 64 HD12 LEU 4 HD12 LEU 4 -15.027 -12.760 49.811 65 HD13 LEU 4 HD13 LEU 4 -14.696 -14.482 49.798 66 HD21 LEU 4 HD21 LEU 4 -13.982 -11.925 46.455 67 HD22 LEU 4 HD22 LEU 4 -14.781 -11.381 47.935 68 HD23 LEU 4 HD23 LEU 4 -13.030 -11.696 47.940 69 H ASP 5 H ASP 5 -13.657 -18.312 46.539 70 HA ASP 5 HA ASP 5 -11.534 -18.236 44.429 71 HB2 ASP 5 HB2 ASP 5 -10.494 -18.950 46.559 72 HB3 ASP 5 HB3 ASP 5 -11.674 -20.253 46.701 73 H GLU 6 H GLU 6 -14.237 -20.100 45.861 74 HA GLU 6 HA GLU 6 -14.514 -21.858 43.572 75 HB2 GLU 6 HB2 GLU 6 -16.374 -22.815 44.816 76 HB3 GLU 6 HB3 GLU 6 -14.935 -22.647 45.812 77 HG2 GLU 6 HG2 GLU 6 -15.882 -20.590 46.858 78 HG3 GLU 6 HG3 GLU 6 -17.329 -20.750 45.868 79 H ILE 7 H ILE 7 -14.763 -19.023 42.962 80 HA ILE 7 HA ILE 7 -17.551 -18.317 42.558 81 HB ILE 7 HB ILE 7 -14.945 -16.977 41.835 82 HG12 ILE 7 HG12 ILE 7 -17.102 -16.333 43.912 83 HG13 ILE 7 HG13 ILE 7 -15.629 -17.225 44.279 84 HG21 ILE 7 HG21 ILE 7 -17.783 -15.883 41.509 85 HG22 ILE 7 HG22 ILE 7 -16.283 -14.955 41.297 86 HG23 ILE 7 HG23 ILE 7 -16.649 -16.256 40.190 87 HD11 ILE 7 HD11 ILE 7 -15.758 -14.346 43.360 88 HD12 ILE 7 HD12 ILE 7 -15.348 -14.960 44.964 89 HD13 ILE 7 HD13 ILE 7 -14.261 -15.289 43.596 90 H ILE 8 H ILE 8 -18.737 -18.292 40.713 91 HA ILE 8 HA ILE 8 -17.615 -19.504 38.215 92 HB ILE 8 HB ILE 8 -20.481 -19.490 39.225 93 HG12 ILE 8 HG12 ILE 8 -18.498 -21.795 38.899 94 HG13 ILE 8 HG13 ILE 8 -18.988 -21.083 40.436 95 HG21 ILE 8 HG21 ILE 8 -19.303 -20.725 36.687 96 HG22 ILE 8 HG22 ILE 8 -20.986 -20.879 37.235 97 HG23 ILE 8 HG23 ILE 8 -20.384 -19.313 36.747 98 HD11 ILE 8 HD11 ILE 8 -20.760 -22.679 38.558 99 HD12 ILE 8 HD12 ILE 8 -20.212 -23.104 40.183 100 HD13 ILE 8 HD13 ILE 8 -21.360 -21.768 39.968 101 H GLU 9 H GLU 9 -17.623 -18.310 36.406 102 HA GLU 9 HA GLU 9 -19.271 -15.830 36.218 103 HB2 GLU 9 HB2 GLU 9 -16.328 -16.031 35.454 104 HB3 GLU 9 HB3 GLU 9 -17.397 -14.656 35.162 105 HG2 GLU 9 HG2 GLU 9 -17.689 -14.410 37.648 106 HG3 GLU 9 HG3 GLU 9 -16.520 -15.710 37.881 107 H GLN 10 H GLN 10 -20.413 -15.790 34.364 108 HA GLN 10 HA GLN 10 -19.327 -16.840 31.861 109 HB2 GLN 10 HB2 GLN 10 -20.252 -18.885 32.943 110 HB3 GLN 10 HB3 GLN 10 -21.844 -18.131 33.012 111 HG2 GLN 10 HG2 GLN 10 -21.946 -18.057 30.554 112 HG3 GLN 10 HG3 GLN 10 -20.269 -18.604 30.438 113 HE21 GLN 10 HE21 GLN 10 -23.195 -21.366 31.355 114 HE22 GLN 10 HE22 GLN 10 -23.538 -19.661 31.603 115 H ILE 11 H ILE 11 -22.511 -15.932 33.285 116 HA ILE 11 HA ILE 11 -22.800 -13.720 31.312 117 HB ILE 11 HB ILE 11 -25.260 -14.441 31.127 118 HG12 ILE 11 HG12 ILE 11 -24.132 -17.225 31.685 119 HG13 ILE 11 HG13 ILE 11 -25.100 -16.327 32.848 120 HG21 ILE 11 HG21 ILE 11 -23.149 -16.088 29.681 121 HG22 ILE 11 HG22 ILE 11 -24.775 -15.683 29.097 122 HG23 ILE 11 HG23 ILE 11 -23.577 -14.409 29.300 123 HD11 ILE 11 HD11 ILE 11 -26.026 -17.291 30.116 124 HD12 ILE 11 HD12 ILE 11 -26.525 -17.885 31.705 125 HD13 ILE 11 HD13 ILE 11 -26.980 -16.247 31.200 126 H GLN 12 H GLN 12 -22.654 -12.065 32.644 127 HA GLN 12 HA GLN 12 -24.646 -11.793 34.851 128 HB2 GLN 12 HB2 GLN 12 -21.728 -10.999 35.165 129 HB3 GLN 12 HB3 GLN 12 -23.016 -10.782 36.332 130 HG2 GLN 12 HG2 GLN 12 -22.629 -12.791 37.223 131 HG3 GLN 12 HG3 GLN 12 -22.859 -13.612 35.693 132 HE21 GLN 12 HE21 GLN 12 -19.243 -13.322 34.908 133 HE22 GLN 12 HE22 GLN 12 -20.777 -13.116 34.089 134 H LYS 13 H LYS 13 -22.028 -9.587 34.012 135 HA LYS 13 HA LYS 13 -23.740 -7.795 32.403 136 HB2 LYS 13 HB2 LYS 13 -23.913 -7.348 34.988 137 HB3 LYS 13 HB3 LYS 13 -22.288 -6.686 34.827 138 HG2 LYS 13 HG2 LYS 13 -23.214 -5.062 33.095 139 HG3 LYS 13 HG3 LYS 13 -24.801 -5.797 33.322 140 HD2 LYS 13 HD2 LYS 13 -24.720 -3.756 34.584 141 HD3 LYS 13 HD3 LYS 13 -24.751 -5.106 35.728 142 HE2 LYS 13 HE2 LYS 13 -22.282 -4.908 36.015 143 HE3 LYS 13 HE3 LYS 13 -22.251 -3.586 34.842 144 HZ1 LYS 13 HZ1 LYS 13 -23.687 -3.526 37.446 145 HZ2 LYS 13 HZ2 LYS 13 -22.290 -2.749 37.120 146 HZ3 LYS 13 HZ3 LYS 13 -23.663 -2.301 36.363 147 H GLU 14 H GLU 14 -21.395 -9.463 31.818 148 HA GLU 14 HA GLU 14 -19.042 -7.780 31.775 149 HB2 GLU 14 HB2 GLU 14 -18.863 -10.161 32.218 150 HB3 GLU 14 HB3 GLU 14 -19.503 -10.537 30.608 151 HG2 GLU 14 HG2 GLU 14 -17.551 -9.368 29.580 152 HG3 GLU 14 HG3 GLU 14 -16.948 -8.966 31.187 153 H ALA 15 H ALA 15 -18.615 -6.405 30.332 154 HA ALA 15 HA ALA 15 -19.576 -6.584 27.485 155 HB1 ALA 15 HB1 ALA 15 -19.688 -4.175 29.330 156 HB2 ALA 15 HB2 ALA 15 -20.072 -4.172 27.593 157 HB3 ALA 15 HB3 ALA 15 -21.070 -5.113 28.725 158 H ILE 16 H ILE 16 -17.615 -4.331 29.359 159 HA ILE 16 HA ILE 16 -15.522 -4.342 27.245 160 HB ILE 16 HB ILE 16 -16.820 -2.274 28.988 161 HG12 ILE 16 HG12 ILE 16 -16.241 -2.009 26.021 162 HG13 ILE 16 HG13 ILE 16 -17.587 -2.996 26.574 163 HG21 ILE 16 HG21 ILE 16 -14.205 -1.815 27.482 164 HG22 ILE 16 HG22 ILE 16 -15.224 -0.521 28.145 165 HG23 ILE 16 HG23 ILE 16 -14.467 -1.679 29.234 166 HD11 ILE 16 HD11 ILE 16 -17.253 -0.043 27.212 167 HD12 ILE 16 HD12 ILE 16 -18.358 -0.764 26.028 168 HD13 ILE 16 HD13 ILE 16 -18.585 -1.097 27.755 169 H ASN 17 H ASN 17 -15.962 -5.613 30.058 170 HA ASN 17 HA ASN 17 -13.649 -4.845 31.500 171 HB2 ASN 17 HB2 ASN 17 -15.186 -7.438 31.941 172 HB3 ASN 17 HB3 ASN 17 -14.439 -6.404 33.156 173 HD21 ASN 17 HD21 ASN 17 -17.257 -4.134 33.172 174 HD22 ASN 17 HD22 ASN 17 -15.551 -4.275 33.589 175 H SER 18 H SER 18 -14.083 -7.055 28.953 176 HA SER 18 HA SER 18 -11.777 -8.793 29.525 177 HB2 SER 18 HB2 SER 18 -13.799 -9.613 28.365 178 HB3 SER 18 HB3 SER 18 -13.461 -8.522 27.007 179 HG SER 18 HG SER 18 -12.659 -10.675 26.688 180 H ASN 19 H ASN 19 -12.457 -6.098 27.227 181 HA ASN 19 HA ASN 19 -9.756 -6.300 26.130 182 HB2 ASN 19 HB2 ASN 19 -10.449 -4.666 24.523 183 HB3 ASN 19 HB3 ASN 19 -11.715 -5.871 24.685 184 HD21 ASN 19 HD21 ASN 19 -14.119 -3.411 25.480 185 HD22 ASN 19 HD22 ASN 19 -13.799 -5.077 25.020 186 H VAL 20 H VAL 20 -11.133 -4.514 28.679 187 HA VAL 20 HA VAL 20 -9.151 -2.359 28.591 188 HB VAL 20 HB VAL 20 -11.590 -2.141 29.250 189 HG11 VAL 20 HG11 VAL 20 -10.618 -2.934 32.016 190 HG12 VAL 20 HG12 VAL 20 -12.254 -2.470 31.515 191 HG13 VAL 20 HG13 VAL 20 -11.564 -4.006 30.959 192 HG21 VAL 20 HG21 VAL 20 -9.959 -0.319 29.481 193 HG22 VAL 20 HG22 VAL 20 -11.182 -0.299 30.762 194 HG23 VAL 20 HG23 VAL 20 -9.546 -0.889 31.115 195 H VAL 21 H VAL 21 -9.152 -5.494 29.908 196 HA VAL 21 HA VAL 21 -6.745 -4.878 31.576 197 HB VAL 21 HB VAL 21 -8.704 -7.115 32.202 198 HG11 VAL 21 HG11 VAL 21 -6.409 -5.855 33.789 199 HG12 VAL 21 HG12 VAL 21 -7.467 -7.172 34.343 200 HG13 VAL 21 HG13 VAL 21 -6.357 -7.446 33.000 201 HG21 VAL 21 HG21 VAL 21 -9.896 -5.069 32.666 202 HG22 VAL 21 HG22 VAL 21 -9.330 -5.732 34.193 203 HG23 VAL 21 HG23 VAL 21 -8.474 -4.353 33.464 204 H LEU 22 H LEU 22 -5.701 -5.102 29.487 205 HA LEU 22 HA LEU 22 -4.868 -7.907 29.000 206 HB2 LEU 22 HB2 LEU 22 -6.676 -7.251 27.364 207 HB3 LEU 22 HB3 LEU 22 -5.640 -5.938 26.811 208 HG LEU 22 HG LEU 22 -3.939 -7.649 26.079 209 HD11 LEU 22 HD11 LEU 22 -6.170 -9.626 26.731 210 HD12 LEU 22 HD12 LEU 22 -4.692 -9.999 25.821 211 HD13 LEU 22 HD13 LEU 22 -4.585 -9.554 27.527 212 HD21 LEU 22 HD21 LEU 22 -5.554 -6.687 24.499 213 HD22 LEU 22 HD22 LEU 22 -5.198 -8.375 24.100 214 HD23 LEU 22 HD23 LEU 22 -6.729 -7.958 24.905 215 H LYS 23 H LYS 23 -2.762 -8.169 28.455 216 HA LYS 23 HA LYS 23 -0.975 -5.813 28.031 217 HB2 LYS 23 HB2 LYS 23 -0.674 -7.927 30.198 218 HB3 LYS 23 HB3 LYS 23 0.666 -6.917 29.644 219 HG2 LYS 23 HG2 LYS 23 -0.638 -4.870 30.185 220 HG3 LYS 23 HG3 LYS 23 -1.895 -5.896 30.913 221 HD2 LYS 23 HD2 LYS 23 -0.314 -6.738 32.579 222 HD3 LYS 23 HD3 LYS 23 1.038 -5.963 31.748 223 HE2 LYS 23 HE2 LYS 23 0.537 -4.635 33.661 224 HE3 LYS 23 HE3 LYS 23 0.085 -3.726 32.218 225 HZ1 LYS 23 HZ1 LYS 23 -1.813 -5.215 33.962 226 HZ2 LYS 23 HZ2 LYS 23 -1.616 -3.596 33.953 227 HZ3 LYS 23 HZ3 LYS 23 -2.237 -4.340 32.643 228 H ASN 24 H ASN 24 -1.912 -7.597 26.044 229 HA ASN 24 HA ASN 24 0.756 -8.461 25.049 230 HB2 ASN 24 HB2 ASN 24 -0.437 -10.486 25.885 231 HB3 ASN 24 HB3 ASN 24 -1.755 -10.151 24.756 232 HD21 ASN 24 HD21 ASN 24 -0.015 -12.148 22.401 233 HD22 ASN 24 HD22 ASN 24 -1.515 -11.844 23.265 234 HA PRO 25 HA PRO 25 -1.488 -5.962 21.868 235 HB2 PRO 25 HB2 PRO 25 -0.107 -3.631 21.838 236 HB3 PRO 25 HB3 PRO 25 -1.266 -4.009 23.145 237 HG2 PRO 25 HG2 PRO 25 1.752 -4.416 23.190 238 HG3 PRO 25 HG3 PRO 25 0.739 -3.557 24.395 239 HD2 PRO 25 HD2 PRO 25 1.460 -6.192 24.678 240 HD3 PRO 25 HD3 PRO 25 -0.109 -5.552 25.253 241 H ARG 26 H ARG 26 -0.305 -8.006 21.090 242 HA ARG 26 HA ARG 26 1.989 -7.323 19.249 243 HB2 ARG 26 HB2 ARG 26 1.385 -9.862 20.806 244 HB3 ARG 26 HB3 ARG 26 2.632 -9.729 19.553 245 HG2 ARG 26 HG2 ARG 26 3.689 -7.858 20.880 246 HG3 ARG 26 HG3 ARG 26 2.530 -8.188 22.181 247 HD2 ARG 26 HD2 ARG 26 3.389 -10.549 22.289 248 HD3 ARG 26 HD3 ARG 26 4.543 -10.161 21.021 249 HE ARG 26 HE ARG 26 5.860 -8.963 22.513 250 HH11 ARG 26 HH11 ARG 26 6.580 -8.307 24.496 251 HH12 ARG 26 HH12 ARG 26 5.553 -8.444 25.892 252 HH21 ARG 26 HH21 ARG 26 2.897 -9.828 24.199 253 HH22 ARG 26 HH22 ARG 26 3.523 -9.269 25.735 254 H VAL 27 H VAL 27 -0.954 -9.325 19.480 255 HA VAL 27 HA VAL 27 -1.013 -9.453 16.487 256 HB VAL 27 HB VAL 27 -1.720 -11.822 18.245 257 HG11 VAL 27 HG11 VAL 27 -1.237 -11.534 15.234 258 HG12 VAL 27 HG12 VAL 27 -1.621 -13.042 16.092 259 HG13 VAL 27 HG13 VAL 27 -2.824 -11.758 15.999 260 HG21 VAL 27 HG21 VAL 27 0.696 -11.518 18.439 261 HG22 VAL 27 HG22 VAL 27 0.358 -12.869 17.362 262 HG23 VAL 27 HG23 VAL 27 0.842 -11.302 16.678 263 HA PRO 28 HA PRO 28 -5.102 -7.909 18.058 264 HB2 PRO 28 HB2 PRO 28 -5.301 -5.702 16.416 265 HB3 PRO 28 HB3 PRO 28 -4.543 -5.706 18.037 266 HG2 PRO 28 HG2 PRO 28 -3.176 -5.921 15.347 267 HG3 PRO 28 HG3 PRO 28 -2.717 -4.914 16.749 268 HD2 PRO 28 HD2 PRO 28 -1.534 -7.308 16.192 269 HD3 PRO 28 HD3 PRO 28 -1.798 -6.756 17.872 270 H THR 29 H THR 29 -7.030 -8.358 17.116 271 HA THR 29 HA THR 29 -6.875 -9.988 14.652 272 HB THR 29 HB THR 29 -7.315 -11.223 16.600 273 HG1 THR 29 HG1 THR 29 -9.205 -12.222 15.920 274 HG21 THR 29 HG21 THR 29 -9.842 -9.595 17.090 275 HG22 THR 29 HG22 THR 29 -9.335 -11.058 17.951 276 HG23 THR 29 HG23 THR 29 -8.376 -9.583 18.090 277 H GLN 30 H GLN 30 -6.931 -8.102 13.432 278 HA GLN 30 HA GLN 30 -9.558 -6.800 13.122 279 HB2 GLN 30 HB2 GLN 30 -8.374 -4.920 12.213 280 HB3 GLN 30 HB3 GLN 30 -7.476 -5.478 13.621 281 HG2 GLN 30 HG2 GLN 30 -6.300 -6.942 11.531 282 HG3 GLN 30 HG3 GLN 30 -6.699 -5.416 10.755 283 HE21 GLN 30 HE21 GLN 30 -3.654 -5.601 13.466 284 HE22 GLN 30 HE22 GLN 30 -4.709 -6.985 13.284 285 H LYS 31 H LYS 31 -8.795 -9.409 11.894 286 HA LYS 31 HA LYS 31 -8.618 -8.861 9.025 287 HB2 LYS 31 HB2 LYS 31 -7.231 -10.480 10.413 288 HB3 LYS 31 HB3 LYS 31 -8.624 -11.549 10.415 289 HG2 LYS 31 HG2 LYS 31 -8.305 -10.795 7.679 290 HG3 LYS 31 HG3 LYS 31 -6.659 -10.915 8.283 291 HD2 LYS 31 HD2 LYS 31 -7.241 -13.023 7.334 292 HD3 LYS 31 HD3 LYS 31 -7.193 -13.257 9.092 293 HE2 LYS 31 HE2 LYS 31 -9.658 -13.064 9.198 294 HE3 LYS 31 HE3 LYS 31 -9.731 -12.673 7.487 295 HZ1 LYS 31 HZ1 LYS 31 -8.790 -15.274 8.585 296 HZ2 LYS 31 HZ2 LYS 31 -10.235 -15.018 7.870 297 HZ3 LYS 31 HZ3 LYS 31 -8.864 -14.904 6.995 298 H THR 32 H THR 32 -10.891 -7.888 9.378 299 HA THR 32 HA THR 32 -12.948 -9.891 8.524 300 HB THR 32 HB THR 32 -13.041 -9.385 10.939 301 HG1 THR 32 HG1 THR 32 -15.241 -9.073 11.002 302 HG21 THR 32 HG21 THR 32 -13.880 -6.588 10.081 303 HG22 THR 32 HG22 THR 32 -13.930 -7.251 11.732 304 HG23 THR 32 HG23 THR 32 -12.374 -7.025 10.922 305 H GLY 33 H GLY 33 -11.348 -7.434 7.319 306 HA2 GLY 33 HA2 GLY 33 -12.921 -7.009 5.066 307 HA3 GLY 33 HA3 GLY 33 -13.441 -5.751 6.190 308 H GLU 34 H GLU 34 -10.106 -7.041 5.647 309 HA GLU 34 HA GLU 34 -9.085 -4.313 5.716 310 HB2 GLU 34 HB2 GLU 34 -7.660 -6.960 5.288 311 HB3 GLU 34 HB3 GLU 34 -6.870 -5.387 5.467 312 HG2 GLU 34 HG2 GLU 34 -7.964 -5.135 7.716 313 HG3 GLU 34 HG3 GLU 34 -8.603 -6.774 7.555 314 H LEU 35 H LEU 35 -8.920 -6.845 3.185 315 HA LEU 35 HA LEU 35 -8.725 -4.788 1.075 316 HB2 LEU 35 HB2 LEU 35 -6.983 -7.130 1.741 317 HB3 LEU 35 HB3 LEU 35 -7.544 -7.090 0.078 318 HG LEU 35 HG LEU 35 -6.762 -4.762 -0.123 319 HD11 LEU 35 HD11 LEU 35 -5.409 -5.286 2.547 320 HD12 LEU 35 HD12 LEU 35 -4.939 -3.990 1.426 321 HD13 LEU 35 HD13 LEU 35 -6.545 -3.978 2.141 322 HD21 LEU 35 HD21 LEU 35 -5.526 -6.685 -0.995 323 HD22 LEU 35 HD22 LEU 35 -4.432 -5.395 -0.476 324 HD23 LEU 35 HD23 LEU 35 -4.668 -6.836 0.551 325 H SER 36 H SER 36 -10.623 -4.765 0.150 326 HA SER 36 HA SER 36 -12.124 -7.257 -0.480 327 HB2 SER 36 HB2 SER 36 -13.942 -5.854 -1.162 328 HB3 SER 36 HB3 SER 36 -13.415 -5.453 0.477 329 HG SER 36 HG SER 36 -13.828 -3.600 -0.800 330 H GLU 37 H GLU 37 -11.771 -4.472 -2.494 331 HA GLU 37 HA GLU 37 -10.496 -5.971 -4.708 332 HB2 GLU 37 HB2 GLU 37 -12.428 -5.955 -6.123 333 HB3 GLU 37 HB3 GLU 37 -12.894 -6.683 -4.575 334 HG2 GLU 37 HG2 GLU 37 -13.941 -4.520 -3.893 335 HG3 GLU 37 HG3 GLU 37 -13.546 -3.847 -5.477 336 H GLU 38 H GLU 38 -11.889 -2.937 -3.517 337 HA GLU 38 HA GLU 38 -10.527 -1.377 -5.600 338 HB2 GLU 38 HB2 GLU 38 -12.690 -0.712 -4.590 339 HB3 GLU 38 HB3 GLU 38 -11.888 -0.490 -3.030 340 HG2 GLU 38 HG2 GLU 38 -10.492 1.299 -3.964 341 HG3 GLU 38 HG3 GLU 38 -11.117 0.983 -5.587 342 H GLN 39 H GLN 39 -9.796 -2.503 -2.295 343 HA GLN 39 HA GLN 39 -7.705 -0.588 -1.785 344 HB2 GLN 39 HB2 GLN 39 -8.332 -3.305 -0.595 345 HB3 GLN 39 HB3 GLN 39 -7.002 -2.299 -0.036 346 HG2 GLN 39 HG2 GLN 39 -8.590 -1.650 1.472 347 HG3 GLN 39 HG3 GLN 39 -8.909 -0.444 0.231 348 HE21 GLN 39 HE21 GLN 39 -12.129 -1.871 -0.526 349 HE22 GLN 39 HE22 GLN 39 -10.988 -0.565 -0.877 350 H LYS 40 H LYS 40 -7.560 -3.907 -3.094 351 HA LYS 40 HA LYS 40 -4.681 -3.829 -3.519 352 HB2 LYS 40 HB2 LYS 40 -4.996 -5.899 -4.765 353 HB3 LYS 40 HB3 LYS 40 -5.820 -5.900 -3.211 354 HG2 LYS 40 HG2 LYS 40 -7.937 -5.148 -4.613 355 HG3 LYS 40 HG3 LYS 40 -6.986 -5.678 -5.997 356 HD2 LYS 40 HD2 LYS 40 -8.566 -7.402 -5.201 357 HD3 LYS 40 HD3 LYS 40 -6.896 -7.966 -5.061 358 HE2 LYS 40 HE2 LYS 40 -6.897 -7.649 -2.656 359 HE3 LYS 40 HE3 LYS 40 -8.422 -6.763 -2.691 360 HZ1 LYS 40 HZ1 LYS 40 -8.215 -9.606 -3.523 361 HZ2 LYS 40 HZ2 LYS 40 -8.622 -9.135 -2.009 362 HZ3 LYS 40 HZ3 LYS 40 -9.585 -8.728 -3.248 363 H LYS 41 H LYS 41 -7.392 -2.697 -5.478 364 HA LYS 41 HA LYS 41 -5.757 -1.984 -7.788 365 HB2 LYS 41 HB2 LYS 41 -8.455 -0.926 -6.862 366 HB3 LYS 41 HB3 LYS 41 -7.670 -0.474 -8.372 367 HG2 LYS 41 HG2 LYS 41 -7.680 -2.776 -9.154 368 HG3 LYS 41 HG3 LYS 41 -8.370 -3.325 -7.621 369 HD2 LYS 41 HD2 LYS 41 -10.390 -1.900 -8.046 370 HD3 LYS 41 HD3 LYS 41 -9.697 -1.427 -9.613 371 HE2 LYS 41 HE2 LYS 41 -9.661 -3.830 -10.293 372 HE3 LYS 41 HE3 LYS 41 -10.374 -4.272 -8.735 373 HZ1 LYS 41 HZ1 LYS 41 -11.673 -2.531 -10.767 374 HZ2 LYS 41 HZ2 LYS 41 -12.067 -4.085 -10.473 375 HZ3 LYS 41 HZ3 LYS 41 -12.334 -2.950 -9.332 376 H ILE 42 H ILE 42 -5.624 -0.745 -4.674 377 HA ILE 42 HA ILE 42 -4.211 1.705 -5.667 378 HB ILE 42 HB ILE 42 -5.199 0.908 -2.928 379 HG12 ILE 42 HG12 ILE 42 -5.904 3.551 -4.110 380 HG13 ILE 42 HG13 ILE 42 -6.523 2.193 -5.025 381 HG21 ILE 42 HG21 ILE 42 -3.526 3.356 -3.609 382 HG22 ILE 42 HG22 ILE 42 -4.338 3.038 -2.061 383 HG23 ILE 42 HG23 ILE 42 -3.028 1.991 -2.584 384 HD11 ILE 42 HD11 ILE 42 -7.004 2.600 -2.054 385 HD12 ILE 42 HD12 ILE 42 -8.167 2.883 -3.377 386 HD13 ILE 42 HD13 ILE 42 -7.588 1.247 -3.042 387 H VAL 43 H VAL 43 -3.678 -1.103 -3.417 388 HA VAL 43 HA VAL 43 -0.878 -0.465 -3.227 389 HB VAL 43 HB VAL 43 -2.248 -3.058 -2.448 390 HG11 VAL 43 HG11 VAL 43 0.411 -1.819 -1.577 391 HG12 VAL 43 HG12 VAL 43 -0.318 -3.280 -0.884 392 HG13 VAL 43 HG13 VAL 43 0.223 -3.292 -2.552 393 HG21 VAL 43 HG21 VAL 43 -3.263 -1.096 -1.318 394 HG22 VAL 43 HG22 VAL 43 -2.333 -2.061 -0.186 395 HG23 VAL 43 HG23 VAL 43 -1.645 -0.553 -0.821 396 H ALA 44 H ALA 44 -2.441 -3.266 -4.932 397 HA ALA 44 HA ALA 44 0.103 -4.201 -5.949 398 HB1 ALA 44 HB1 ALA 44 -2.717 -4.857 -6.892 399 HB2 ALA 44 HB2 ALA 44 -1.236 -5.770 -7.229 400 HB3 ALA 44 HB3 ALA 44 -1.850 -5.677 -5.568 401 H ASP 45 H ASP 45 -2.413 -2.023 -7.171 402 HA ASP 45 HA ASP 45 -1.308 -1.514 -9.761 403 HB2 ASP 45 HB2 ASP 45 -3.530 -0.768 -8.980 404 HB3 ASP 45 HB3 ASP 45 -2.755 0.394 -7.895 405 H TYR 46 H TYR 46 -0.523 0.134 -6.605 406 HA TYR 46 HA TYR 46 1.409 1.904 -7.749 407 HB2 TYR 46 HB2 TYR 46 0.164 1.875 -5.448 408 HB3 TYR 46 HB3 TYR 46 1.529 0.936 -4.882 409 HD1 TYR 46 HD1 TYR 46 3.455 2.824 -6.815 410 HD2 TYR 46 HD2 TYR 46 0.559 3.463 -3.717 411 HE1 TYR 46 HE1 TYR 46 4.522 4.966 -6.321 412 HE2 TYR 46 HE2 TYR 46 1.648 5.632 -3.144 413 HH TYR 46 HH TYR 46 4.475 6.874 -4.984 414 H ILE 47 H ILE 47 1.744 -1.358 -6.355 415 HA ILE 47 HA ILE 47 4.590 -1.625 -6.602 416 HB ILE 47 HB ILE 47 2.212 -3.407 -6.288 417 HG12 ILE 47 HG12 ILE 47 3.239 -4.135 -4.299 418 HG13 ILE 47 HG13 ILE 47 4.842 -3.624 -4.807 419 HG21 ILE 47 HG21 ILE 47 4.914 -4.539 -7.034 420 HG22 ILE 47 HG22 ILE 47 3.560 -5.460 -6.353 421 HG23 ILE 47 HG23 ILE 47 3.393 -4.716 -7.951 422 HD11 ILE 47 HD11 ILE 47 2.605 -1.715 -4.028 423 HD12 ILE 47 HD12 ILE 47 3.985 -2.207 -3.025 424 HD13 ILE 47 HD13 ILE 47 4.257 -1.277 -4.506 425 H SER 48 H SER 48 2.124 -1.645 -9.099 426 HA SER 48 HA SER 48 3.949 -2.637 -11.163 427 HB2 SER 48 HB2 SER 48 1.361 -2.822 -11.055 428 HB3 SER 48 HB3 SER 48 1.367 -1.161 -11.680 429 HG SER 48 HG SER 48 1.294 -2.750 -13.350 430 H GLU 49 H GLU 49 3.536 0.485 -9.637 431 HA GLU 49 HA GLU 49 4.409 2.002 -12.041 432 HB2 GLU 49 HB2 GLU 49 3.631 2.896 -9.238 433 HB3 GLU 49 HB3 GLU 49 4.068 3.970 -10.560 434 HG2 GLU 49 HG2 GLU 49 1.722 2.052 -10.627 435 HG3 GLU 49 HG3 GLU 49 1.616 3.716 -10.082 436 H VAL 50 H VAL 50 5.413 1.501 -8.655 437 HA VAL 50 HA VAL 50 8.135 2.534 -9.358 438 HB VAL 50 HB VAL 50 8.220 3.715 -7.306 439 HG11 VAL 50 HG11 VAL 50 5.459 4.241 -8.390 440 HG12 VAL 50 HG12 VAL 50 6.549 5.354 -7.542 441 HG13 VAL 50 HG13 VAL 50 6.971 4.776 -9.159 442 HG21 VAL 50 HG21 VAL 50 7.193 2.161 -5.763 443 HG22 VAL 50 HG22 VAL 50 6.384 3.728 -5.684 444 HG23 VAL 50 HG23 VAL 50 5.617 2.371 -6.542 445 H GLY 51 H GLY 51 6.591 -0.197 -7.979 446 HA2 GLY 51 HA2 GLY 51 8.040 -2.153 -8.365 447 HA3 GLY 51 HA3 GLY 51 9.303 -1.360 -7.428 448 H LEU 52 H LEU 52 8.678 -0.791 -5.175 449 HA LEU 52 HA LEU 52 6.537 -2.088 -3.773 450 HB2 LEU 52 HB2 LEU 52 7.840 -4.143 -4.162 451 HB3 LEU 52 HB3 LEU 52 9.301 -3.377 -3.550 452 HG LEU 52 HG LEU 52 8.360 -3.313 -1.278 453 HD11 LEU 52 HD11 LEU 52 5.924 -4.683 -2.493 454 HD12 LEU 52 HD12 LEU 52 6.243 -4.443 -0.752 455 HD13 LEU 52 HD13 LEU 52 5.954 -3.056 -1.786 456 HD21 LEU 52 HD21 LEU 52 9.568 -5.326 -2.053 457 HD22 LEU 52 HD22 LEU 52 8.332 -5.709 -0.843 458 HD23 LEU 52 HD23 LEU 52 8.029 -6.052 -2.566 459 H ASN 53 H ASN 53 9.822 -0.835 -3.525 460 HA ASN 53 HA ASN 53 9.310 0.153 -0.763 461 HB2 ASN 53 HB2 ASN 53 11.885 -0.508 -2.240 462 HB3 ASN 53 HB3 ASN 53 11.809 0.116 -0.598 463 HD21 ASN 53 HD21 ASN 53 11.509 -3.805 -1.010 464 HD22 ASN 53 HD22 ASN 53 12.125 -2.744 -2.269 465 H ASN 54 H ASN 54 9.414 1.522 -3.812 466 HA ASN 54 HA ASN 54 10.652 4.069 -2.942 467 HB2 ASN 54 HB2 ASN 54 9.572 3.212 -5.643 468 HB3 ASN 54 HB3 ASN 54 10.521 4.661 -5.314 469 HD21 ASN 54 HD21 ASN 54 12.422 1.213 -6.058 470 HD22 ASN 54 HD22 ASN 54 10.726 1.509 -6.435 471 H LEU 55 H LEU 55 7.465 2.746 -3.313 472 HA LEU 55 HA LEU 55 5.963 5.222 -3.277 473 HB2 LEU 55 HB2 LEU 55 4.092 3.794 -2.647 474 HB3 LEU 55 HB3 LEU 55 4.989 3.121 -3.986 475 HG LEU 55 HG LEU 55 6.200 1.785 -1.920 476 HD11 LEU 55 HD11 LEU 55 3.281 2.139 -1.112 477 HD12 LEU 55 HD12 LEU 55 4.433 0.982 -0.420 478 HD13 LEU 55 HD13 LEU 55 4.688 2.717 -0.192 479 HD21 LEU 55 HD21 LEU 55 5.263 0.777 -3.960 480 HD22 LEU 55 HD22 LEU 55 4.747 -0.089 -2.511 481 HD23 LEU 55 HD23 LEU 55 3.615 1.007 -3.332 482 H ASN 56 H ASN 56 4.607 5.907 -1.380 483 HA ASN 56 HA ASN 56 6.012 5.479 1.207 484 HB2 ASN 56 HB2 ASN 56 5.698 7.679 1.875 485 HB3 ASN 56 HB3 ASN 56 6.322 7.776 0.241 486 HD21 ASN 56 HD21 ASN 56 3.790 10.280 0.045 487 HD22 ASN 56 HD22 ASN 56 5.501 10.008 0.351 488 H ALA 57 H ALA 57 4.619 5.899 3.073 489 HA ALA 57 HA ALA 57 2.306 4.106 2.935 490 HB1 ALA 57 HB1 ALA 57 3.788 5.560 5.161 491 HB2 ALA 57 HB2 ALA 57 2.497 4.372 5.419 492 HB3 ALA 57 HB3 ALA 57 4.016 3.870 4.645 493 H THR 58 H THR 58 2.850 7.561 3.051 494 HA THR 58 HA THR 58 0.430 8.467 4.225 495 HB THR 58 HB THR 58 2.097 9.855 2.096 496 HG1 THR 58 HG1 THR 58 3.247 10.674 3.865 497 HG21 THR 58 HG21 THR 58 0.319 10.913 4.335 498 HG22 THR 58 HG22 THR 58 1.397 11.911 3.327 499 HG23 THR 58 HG23 THR 58 0.042 11.058 2.584 500 H GLU 59 H GLU 59 1.272 7.993 0.749 501 HA GLU 59 HA GLU 59 -1.330 8.722 -0.249 502 HB2 GLU 59 HB2 GLU 59 0.852 6.964 -1.435 503 HB3 GLU 59 HB3 GLU 59 -0.564 7.521 -2.327 504 HG2 GLU 59 HG2 GLU 59 1.549 9.350 -1.099 505 HG3 GLU 59 HG3 GLU 59 1.500 8.842 -2.774 506 H LEU 60 H LEU 60 0.040 5.491 0.484 507 HA LEU 60 HA LEU 60 -2.283 3.945 -0.038 508 HB2 LEU 60 HB2 LEU 60 0.186 3.638 1.653 509 HB3 LEU 60 HB3 LEU 60 -1.184 2.621 2.067 510 HG LEU 60 HG LEU 60 -1.302 1.736 -0.219 511 HD11 LEU 60 HD11 LEU 60 1.202 3.392 -0.720 512 HD12 LEU 60 HD12 LEU 60 0.591 2.102 -1.781 513 HD13 LEU 60 HD13 LEU 60 -0.370 3.568 -1.531 514 HD21 LEU 60 HD21 LEU 60 0.055 0.595 1.508 515 HD22 LEU 60 HD22 LEU 60 0.750 0.380 -0.108 516 HD23 LEU 60 HD23 LEU 60 1.472 1.550 1.015 517 H SER 61 H SER 61 -1.367 5.402 3.148 518 HA SER 61 HA SER 61 -3.766 4.595 4.455 519 HB2 SER 61 HB2 SER 61 -3.139 6.303 6.174 520 HB3 SER 61 HB3 SER 61 -1.912 5.079 5.815 521 HG SER 61 HG SER 61 -0.785 6.568 4.636 522 H LYS 62 H LYS 62 -3.253 7.240 2.306 523 HA LYS 62 HA LYS 62 -5.666 8.758 3.111 524 HB2 LYS 62 HB2 LYS 62 -3.684 8.976 0.819 525 HB3 LYS 62 HB3 LYS 62 -5.156 9.947 0.874 526 HG2 LYS 62 HG2 LYS 62 -4.500 11.113 2.825 527 HG3 LYS 62 HG3 LYS 62 -3.249 9.942 3.230 528 HD2 LYS 62 HD2 LYS 62 -2.212 11.960 2.376 529 HD3 LYS 62 HD3 LYS 62 -1.924 10.624 1.253 530 HE2 LYS 62 HE2 LYS 62 -3.824 11.463 -0.164 531 HE3 LYS 62 HE3 LYS 62 -4.000 12.840 0.934 532 HZ1 LYS 62 HZ1 LYS 62 -1.550 12.176 -0.628 533 HZ2 LYS 62 HZ2 LYS 62 -2.602 13.376 -0.997 534 HZ3 LYS 62 HZ3 LYS 62 -1.706 13.473 0.366 535 H ARG 63 H ARG 63 -4.771 6.600 0.414 536 HA ARG 63 HA ARG 63 -7.466 6.660 -0.756 537 HB2 ARG 63 HB2 ARG 63 -4.916 5.100 -1.310 538 HB3 ARG 63 HB3 ARG 63 -6.405 4.828 -2.212 539 HG2 ARG 63 HG2 ARG 63 -4.973 7.511 -2.096 540 HG3 ARG 63 HG3 ARG 63 -4.776 6.299 -3.366 541 HD2 ARG 63 HD2 ARG 63 -7.307 6.420 -3.741 542 HD3 ARG 63 HD3 ARG 63 -7.322 7.807 -2.657 543 HE ARG 63 HE ARG 63 -6.282 9.131 -4.266 544 HH11 ARG 63 HH11 ARG 63 -5.761 9.691 -6.348 545 HH12 ARG 63 HH12 ARG 63 -5.600 8.462 -7.567 546 HH21 ARG 63 HH21 ARG 63 -6.333 5.841 -5.488 547 HH22 ARG 63 HH22 ARG 63 -5.911 6.344 -7.101 548 H LEU 64 H LEU 64 -5.698 4.353 1.262 549 HA LEU 64 HA LEU 64 -7.860 2.358 1.175 550 HB2 LEU 64 HB2 LEU 64 -5.326 2.489 2.836 551 HB3 LEU 64 HB3 LEU 64 -6.367 1.083 2.660 552 HG LEU 64 HG LEU 64 -4.851 2.334 0.318 553 HD11 LEU 64 HD11 LEU 64 -4.109 -0.056 2.057 554 HD12 LEU 64 HD12 LEU 64 -3.255 0.512 0.604 555 HD13 LEU 64 HD13 LEU 64 -3.291 1.522 2.049 556 HD21 LEU 64 HD21 LEU 64 -6.796 0.956 -0.303 557 HD22 LEU 64 HD22 LEU 64 -5.274 0.144 -0.711 558 HD23 LEU 64 HD23 LEU 64 -6.181 -0.359 0.730 559 H ASN 65 H ASN 65 -6.968 5.014 3.255 560 HA ASN 65 HA ASN 65 -7.762 5.850 5.178 561 HB2 ASN 65 HB2 ASN 65 -9.927 5.672 3.899 562 HB3 ASN 65 HB3 ASN 65 -10.283 4.204 4.809 563 HD21 ASN 65 HD21 ASN 65 -10.841 6.012 7.897 564 HD22 ASN 65 HD22 ASN 65 -10.156 4.500 7.288 565 H ILE 66 H ILE 66 -5.902 4.490 5.767 566 HA ILE 66 HA ILE 66 -6.525 2.823 8.157 567 HB ILE 66 HB ILE 66 -4.265 1.673 7.739 568 HG12 ILE 66 HG12 ILE 66 -4.732 2.696 4.929 569 HG13 ILE 66 HG13 ILE 66 -3.391 3.097 6.012 570 HG21 ILE 66 HG21 ILE 66 -6.528 0.917 5.887 571 HG22 ILE 66 HG22 ILE 66 -5.242 -0.131 6.541 572 HG23 ILE 66 HG23 ILE 66 -6.426 0.568 7.638 573 HD11 ILE 66 HD11 ILE 66 -3.937 0.406 4.710 574 HD12 ILE 66 HD12 ILE 66 -2.676 1.571 4.301 575 HD13 ILE 66 HD13 ILE 66 -2.626 0.738 5.877 576 H THR 67 H THR 67 -4.654 2.767 9.644 577 HA THR 67 HA THR 67 -3.487 5.355 10.285 578 HB THR 67 HB THR 67 -3.175 2.503 11.272 579 HG1 THR 67 HG1 THR 67 -4.173 3.422 13.092 580 HG21 THR 67 HG21 THR 67 -1.716 4.960 12.286 581 HG22 THR 67 HG22 THR 67 -1.927 3.450 13.215 582 HG23 THR 67 HG23 THR 67 -1.029 3.415 11.702 583 H VAL 68 H VAL 68 -1.448 6.099 9.720 584 HA VAL 68 HA VAL 68 -0.188 5.175 7.381 585 HB VAL 68 HB VAL 68 1.248 6.718 9.574 586 HG11 VAL 68 HG11 VAL 68 1.521 6.731 6.533 587 HG12 VAL 68 HG12 VAL 68 2.426 7.766 7.657 588 HG13 VAL 68 HG13 VAL 68 2.679 6.020 7.679 589 HG21 VAL 68 HG21 VAL 68 -0.867 7.894 9.206 590 HG22 VAL 68 HG22 VAL 68 0.449 8.790 8.453 591 HG23 VAL 68 HG23 VAL 68 -0.636 7.815 7.446 592 H ASP 69 H ASP 69 0.571 4.363 10.745 593 HA ASP 69 HA ASP 69 2.937 2.862 10.091 594 HB2 ASP 69 HB2 ASP 69 2.408 3.964 12.303 595 HB3 ASP 69 HB3 ASP 69 1.252 2.665 12.608 596 H LYS 70 H LYS 70 -0.455 1.969 10.066 597 HA LYS 70 HA LYS 70 0.079 -0.917 9.933 598 HB2 LYS 70 HB2 LYS 70 -2.390 0.722 9.206 599 HB3 LYS 70 HB3 LYS 70 -2.275 -1.035 9.079 600 HG2 LYS 70 HG2 LYS 70 -1.807 -1.206 11.502 601 HG3 LYS 70 HG3 LYS 70 -1.948 0.553 11.663 602 HD2 LYS 70 HD2 LYS 70 -4.296 0.410 10.787 603 HD3 LYS 70 HD3 LYS 70 -4.163 -1.350 10.746 604 HE2 LYS 70 HE2 LYS 70 -3.822 0.363 13.256 605 HE3 LYS 70 HE3 LYS 70 -5.343 -0.389 12.765 606 HZ1 LYS 70 HZ1 LYS 70 -2.858 -1.882 13.409 607 HZ2 LYS 70 HZ2 LYS 70 -4.185 -1.782 14.355 608 HZ3 LYS 70 HZ3 LYS 70 -4.270 -2.562 12.918 609 H ALA 71 H ALA 71 -0.162 1.776 7.647 610 HA ALA 71 HA ALA 71 0.011 0.094 5.264 611 HB1 ALA 71 HB1 ALA 71 0.768 3.028 5.618 612 HB2 ALA 71 HB2 ALA 71 0.463 2.184 4.091 613 HB3 ALA 71 HB3 ALA 71 -0.851 2.459 5.254 614 H LYS 72 H LYS 72 2.412 1.931 7.160 615 HA LYS 72 HA LYS 72 4.779 1.304 5.747 616 HB2 LYS 72 HB2 LYS 72 4.257 1.781 8.704 617 HB3 LYS 72 HB3 LYS 72 5.883 1.566 8.048 618 HG2 LYS 72 HG2 LYS 72 5.723 3.532 6.700 619 HG3 LYS 72 HG3 LYS 72 4.001 3.699 7.039 620 HD2 LYS 72 HD2 LYS 72 5.457 5.327 8.241 621 HD3 LYS 72 HD3 LYS 72 4.339 4.415 9.255 622 HE2 LYS 72 HE2 LYS 72 6.123 2.914 9.979 623 HE3 LYS 72 HE3 LYS 72 7.277 3.704 8.885 624 HZ1 LYS 72 HZ1 LYS 72 5.938 4.983 11.210 625 HZ2 LYS 72 HZ2 LYS 72 7.504 4.540 11.145 626 HZ3 LYS 72 HZ3 LYS 72 6.969 5.753 10.195 627 H THR 73 H THR 73 3.207 -0.671 8.295 628 HA THR 73 HA THR 73 5.288 -2.743 7.937 629 HB THR 73 HB THR 73 4.344 -2.085 10.168 630 HG1 THR 73 HG1 THR 73 4.612 -4.185 10.864 631 HG21 THR 73 HG21 THR 73 2.112 -4.035 9.440 632 HG22 THR 73 HG22 THR 73 2.392 -3.235 11.000 633 HG23 THR 73 HG23 THR 73 1.901 -2.277 9.597 634 H TYR 74 H TYR 74 1.870 -2.358 6.959 635 HA TYR 74 HA TYR 74 1.471 -5.019 6.047 636 HB2 TYR 74 HB2 TYR 74 -0.381 -3.546 6.388 637 HB3 TYR 74 HB3 TYR 74 0.269 -2.363 5.244 638 HD1 TYR 74 HD1 TYR 74 -0.270 -2.413 2.982 639 HD2 TYR 74 HD2 TYR 74 -1.075 -5.868 5.447 640 HE1 TYR 74 HE1 TYR 74 -1.288 -3.551 1.055 641 HE2 TYR 74 HE2 TYR 74 -2.105 -7.017 3.485 642 HH TYR 74 HH TYR 74 -2.144 -5.516 0.231 643 H ILE 75 H ILE 75 2.931 -2.217 4.366 644 HA ILE 75 HA ILE 75 3.248 -3.191 1.767 645 HB ILE 75 HB ILE 75 5.009 -1.498 3.559 646 HG12 ILE 75 HG12 ILE 75 3.528 -0.688 1.022 647 HG13 ILE 75 HG13 ILE 75 2.710 -0.741 2.566 648 HG21 ILE 75 HG21 ILE 75 5.539 -2.082 0.609 649 HG22 ILE 75 HG22 ILE 75 6.333 -0.814 1.561 650 HG23 ILE 75 HG23 ILE 75 6.604 -2.493 1.976 651 HD11 ILE 75 HD11 ILE 75 5.114 1.017 1.903 652 HD12 ILE 75 HD12 ILE 75 3.448 1.533 2.185 653 HD13 ILE 75 HD13 ILE 75 4.395 0.860 3.518 654 H LYS 76 H LYS 76 5.357 -3.995 4.577 655 HA LYS 76 HA LYS 76 6.771 -6.006 2.900 656 HB2 LYS 76 HB2 LYS 76 8.319 -6.217 4.785 657 HB3 LYS 76 HB3 LYS 76 8.152 -4.534 4.287 658 HG2 LYS 76 HG2 LYS 76 6.682 -4.059 6.192 659 HG3 LYS 76 HG3 LYS 76 6.689 -5.771 6.666 660 HD2 LYS 76 HD2 LYS 76 9.119 -5.652 7.091 661 HD3 LYS 76 HD3 LYS 76 9.121 -3.936 6.623 662 HE2 LYS 76 HE2 LYS 76 7.531 -3.419 8.446 663 HE3 LYS 76 HE3 LYS 76 7.447 -5.128 8.887 664 HZ1 LYS 76 HZ1 LYS 76 9.902 -3.454 9.037 665 HZ2 LYS 76 HZ2 LYS 76 8.997 -3.921 10.314 666 HZ3 LYS 76 HZ3 LYS 76 9.819 -5.034 9.450 667 H ASN 77 H ASN 77 4.329 -6.075 5.450 668 HA ASN 77 HA ASN 77 4.677 -8.935 5.895 669 HB2 ASN 77 HB2 ASN 77 2.545 -6.922 6.647 670 HB3 ASN 77 HB3 ASN 77 2.258 -8.646 6.845 671 HD21 ASN 77 HD21 ASN 77 4.877 -6.809 9.370 672 HD22 ASN 77 HD22 ASN 77 4.342 -5.965 7.929 673 H SER 78 H SER 78 2.829 -7.100 3.515 674 HA SER 78 HA SER 78 1.391 -9.461 2.556 675 HB2 SER 78 HB2 SER 78 0.469 -7.165 2.557 676 HB3 SER 78 HB3 SER 78 1.630 -6.707 1.302 677 HG SER 78 HG SER 78 -0.556 -7.447 0.623 678 H ASN 79 H ASN 79 4.072 -7.478 1.295 679 HA ASN 79 HA ASN 79 4.359 -9.293 -1.022 680 HB2 ASN 79 HB2 ASN 79 5.826 -6.712 -0.444 681 HB3 ASN 79 HB3 ASN 79 5.795 -7.591 -1.970 682 HD21 ASN 79 HD21 ASN 79 2.740 -5.112 -0.972 683 HD22 ASN 79 HD22 ASN 79 4.099 -5.432 0.120 684 H ARG 80 H ARG 80 6.230 -8.297 1.760 685 HA ARG 80 HA ARG 80 8.223 -8.774 2.559 686 HB2 ARG 80 HB2 ARG 80 6.520 -10.647 3.145 687 HB3 ARG 80 HB3 ARG 80 7.427 -11.668 2.049 688 HG2 ARG 80 HG2 ARG 80 8.163 -12.109 4.273 689 HG3 ARG 80 HG3 ARG 80 9.490 -11.252 3.490 690 HD2 ARG 80 HD2 ARG 80 8.865 -9.178 4.642 691 HD3 ARG 80 HD3 ARG 80 7.406 -9.924 5.287 692 HE ARG 80 HE ARG 80 10.169 -10.273 6.234 693 HH11 ARG 80 HH11 ARG 80 10.511 -11.301 8.171 694 HH12 ARG 80 HH12 ARG 80 9.228 -12.205 8.917 695 HH21 ARG 80 HH21 ARG 80 6.915 -11.567 6.471 696 HH22 ARG 80 HH22 ARG 80 7.246 -12.353 7.989 697 H MET 81 H MET 81 8.752 -7.957 0.229 698 HA MET 81 HA MET 81 10.180 -7.706 -1.480 699 HB2 MET 81 HB2 MET 81 11.973 -9.710 -0.084 700 HB3 MET 81 HB3 MET 81 12.445 -8.563 -1.335 701 HG2 MET 81 HG2 MET 81 11.453 -7.871 1.455 702 HG3 MET 81 HG3 MET 81 13.110 -7.783 0.873 703 HE1 MET 81 HE1 MET 81 13.322 -5.356 1.852 704 HE2 MET 81 HE2 MET 81 12.196 -4.031 1.485 705 HE3 MET 81 HE3 MET 81 11.639 -5.434 2.421 706 H GLY 82 H GLY 82 9.325 -11.060 -0.966 707 HA2 GLY 82 HA2 GLY 82 8.599 -11.467 -3.714 708 HA3 GLY 82 HA3 GLY 82 10.151 -12.255 -3.374 709 H ARG 83 H ARG 83 7.417 -11.867 -1.159 710 HA ARG 83 HA ARG 83 6.487 -13.253 0.345 711 HB2 ARG 83 HB2 ARG 83 6.112 -15.133 -2.004 712 HB3 ARG 83 HB3 ARG 83 5.290 -15.187 -0.452 713 HG2 ARG 83 HG2 ARG 83 3.680 -14.031 -1.533 714 HG3 ARG 83 HG3 ARG 83 4.663 -12.632 -1.103 715 HD2 ARG 83 HD2 ARG 83 5.775 -12.778 -3.353 716 HD3 ARG 83 HD3 ARG 83 4.743 -14.144 -3.764 717 HE ARG 83 HE ARG 83 4.051 -11.315 -3.766 718 HH11 ARG 83 HH11 ARG 83 2.060 -10.645 -4.466 719 HH12 ARG 83 HH12 ARG 83 0.754 -11.784 -4.597 720 HH21 ARG 83 HH21 ARG 83 2.566 -14.489 -3.535 721 HH22 ARG 83 HH22 ARG 83 1.021 -13.897 -4.079 722 H THR 84 H THR 84 8.511 -13.377 1.423 723 HA THR 84 HA THR 84 9.924 -14.450 2.795 724 HB THR 84 HB THR 84 9.130 -16.546 3.837 725 HG1 THR 84 HG1 THR 84 7.065 -17.257 3.332 726 HG21 THR 84 HG21 THR 84 7.131 -14.279 3.542 727 HG22 THR 84 HG22 THR 84 7.156 -15.477 4.860 728 HG23 THR 84 HG23 THR 84 8.513 -14.352 4.666 729 H ASN 85 H ASN 85 10.686 -14.597 0.224 730 HA ASN 85 HA ASN 85 11.518 -17.192 -0.661 731 HB2 ASN 85 HB2 ASN 85 10.909 -15.341 -2.140 732 HB3 ASN 85 HB3 ASN 85 12.224 -14.348 -1.513 733 HD21 ASN 85 HD21 ASN 85 13.087 -17.400 -4.146 734 HD22 ASN 85 HD22 ASN 85 11.587 -17.453 -3.230 735 H ASN 86 H ASN 86 12.739 -15.066 1.562 736 HA ASN 86 HA ASN 86 15.591 -15.357 1.577 737 HB2 ASN 86 HB2 ASN 86 14.735 -13.528 2.733 738 HB3 ASN 86 HB3 ASN 86 13.349 -14.410 3.359 739 HD21 ASN 86 HD21 ASN 86 14.826 -15.393 6.343 740 HD22 ASN 86 HD22 ASN 86 13.459 -15.545 5.236 741 H PHE 87 H PHE 87 13.067 -17.566 2.464 742 HA PHE 87 HA PHE 87 14.485 -19.060 4.447 743 HB2 PHE 87 HB2 PHE 87 12.542 -20.241 4.679 744 HB3 PHE 87 HB3 PHE 87 11.959 -18.692 4.084 745 HD1 PHE 87 HD1 PHE 87 12.400 -18.965 1.110 746 HD2 PHE 87 HD2 PHE 87 10.921 -21.794 4.015 747 HE1 PHE 87 HE1 PHE 87 11.065 -20.016 -0.636 748 HE2 PHE 87 HE2 PHE 87 9.603 -22.910 2.221 749 HZ PHE 87 HZ PHE 87 9.662 -22.031 -0.107 750 H LYS 88 H LYS 88 15.910 -18.930 1.765 751 HA LYS 88 HA LYS 88 15.522 -21.554 0.504 752 HB2 LYS 88 HB2 LYS 88 16.956 -20.756 -1.225 753 HB3 LYS 88 HB3 LYS 88 15.740 -19.538 -0.870 754 HG2 LYS 88 HG2 LYS 88 18.367 -19.213 0.548 755 HG3 LYS 88 HG3 LYS 88 18.420 -19.078 -1.211 756 HD2 LYS 88 HD2 LYS 88 16.725 -17.288 -1.158 757 HD3 LYS 88 HD3 LYS 88 16.580 -17.476 0.590 758 HE2 LYS 88 HE2 LYS 88 17.938 -15.567 0.239 759 HE3 LYS 88 HE3 LYS 88 18.982 -16.848 0.855 760 HZ1 LYS 88 HZ1 LYS 88 18.740 -16.069 -2.010 761 HZ2 LYS 88 HZ2 LYS 88 19.985 -15.673 -1.036 762 HZ3 LYS 88 HZ3 LYS 88 19.739 -17.232 -1.442 763 H THR 89 H THR 89 17.301 -20.675 3.048 764 HA THR 89 HA THR 89 19.502 -22.669 2.675 765 HB THR 89 HB THR 89 19.707 -19.714 3.396 766 HG1 THR 89 HG1 THR 89 21.106 -19.722 1.608 767 HG21 THR 89 HG21 THR 89 21.845 -21.862 3.483 768 HG22 THR 89 HG22 THR 89 22.144 -20.101 3.549 769 HG23 THR 89 HG23 THR 89 21.234 -20.883 4.846 770 H ILE 90 H ILE 90 17.918 -20.371 4.943 771 HA ILE 90 HA ILE 90 18.690 -21.808 7.333 772 HB ILE 90 HB ILE 90 17.169 -20.278 8.457 773 HG12 ILE 90 HG12 ILE 90 16.596 -19.058 5.721 774 HG13 ILE 90 HG13 ILE 90 15.459 -20.046 6.648 775 HG21 ILE 90 HG21 ILE 90 19.030 -18.843 6.526 776 HG22 ILE 90 HG22 ILE 90 18.540 -18.317 8.150 777 HG23 ILE 90 HG23 ILE 90 19.554 -19.745 7.964 778 HD11 ILE 90 HD11 ILE 90 16.580 -17.338 7.441 779 HD12 ILE 90 HD12 ILE 90 14.904 -17.752 7.030 780 HD13 ILE 90 HD13 ILE 90 15.632 -18.380 8.527 781 H LYS 91 H LYS 91 17.198 -22.702 8.879 782 HA LYS 91 HA LYS 91 15.707 -24.221 9.623 783 HB2 LYS 91 HB2 LYS 91 13.989 -22.762 7.602 784 HB3 LYS 91 HB3 LYS 91 13.365 -24.146 8.466 785 HG2 LYS 91 HG2 LYS 91 12.684 -22.139 9.542 786 HG3 LYS 91 HG3 LYS 91 13.716 -23.093 10.615 787 HD2 LYS 91 HD2 LYS 91 15.619 -21.554 10.104 788 HD3 LYS 91 HD3 LYS 91 14.541 -20.575 9.097 789 HE2 LYS 91 HE2 LYS 91 14.228 -21.152 12.083 790 HE3 LYS 91 HE3 LYS 91 14.955 -19.693 11.408 791 HZ1 LYS 91 HZ1 LYS 91 12.124 -20.515 11.022 792 HZ2 LYS 91 HZ2 LYS 91 12.646 -19.306 11.980 793 HZ3 LYS 91 HZ3 LYS 91 12.806 -19.180 10.362 794 H MET 92 H MET 92 16.876 -24.751 6.480 795 HA MET 92 HA MET 92 15.529 -27.343 6.140 796 HB2 MET 92 HB2 MET 92 17.784 -26.087 4.541 797 HB3 MET 92 HB3 MET 92 16.849 -27.524 4.105 798 HG2 MET 92 HG2 MET 92 14.765 -26.010 4.233 799 HG3 MET 92 HG3 MET 92 15.896 -24.655 4.237 800 HE1 MET 92 HE1 MET 92 18.186 -26.174 2.142 801 HE2 MET 92 HE2 MET 92 17.720 -25.189 0.743 802 HE3 MET 92 HE3 MET 92 17.829 -24.446 2.357 803 H PHE 93 H PHE 93 18.785 -26.257 7.135 804 HA PHE 93 HA PHE 93 19.791 -29.016 7.238 805 HB2 PHE 93 HB2 PHE 93 21.907 -28.030 7.795 806 HB3 PHE 93 HB3 PHE 93 21.209 -27.210 6.413 807 HD1 PHE 93 HD1 PHE 93 20.645 -24.846 6.507 808 HD2 PHE 93 HD2 PHE 93 22.024 -26.905 10.035 809 HE1 PHE 93 HE1 PHE 93 20.948 -22.668 7.661 810 HE2 PHE 93 HE2 PHE 93 22.326 -24.727 11.187 811 HZ PHE 93 HZ PHE 93 21.782 -22.604 10.007 812 H GLU 94 H GLU 94 18.247 -26.877 9.457 813 HA GLU 94 HA GLU 94 19.290 -28.080 11.911 814 HB2 GLU 94 HB2 GLU 94 16.897 -26.260 11.436 815 HB3 GLU 94 HB3 GLU 94 17.546 -26.733 13.014 816 HG2 GLU 94 HG2 GLU 94 19.722 -25.663 12.433 817 HG3 GLU 94 HG3 GLU 94 19.047 -25.142 10.886 818 H ASP 95 H ASP 95 18.217 -29.498 13.318 819 HA ASP 95 HA ASP 95 15.751 -30.868 12.395 820 HB2 ASP 95 HB2 ASP 95 17.680 -32.037 11.349 821 HB3 ASP 95 HB3 ASP 95 18.397 -32.271 12.942 822 H ASP 96 H ASP 96 14.460 -31.510 14.034 823 HA ASP 96 HA ASP 96 15.325 -31.010 16.836 824 HB2 ASP 96 HB2 ASP 96 12.588 -31.487 15.610 825 HB3 ASP 96 HB3 ASP 96 12.901 -31.289 17.335 826 H VAL 97 H VAL 97 15.535 -32.561 18.341 827 HA VAL 97 HA VAL 97 14.899 -35.409 17.624 828 HB VAL 97 HB VAL 97 17.237 -34.409 19.288 829 HG11 VAL 97 HG11 VAL 97 16.489 -37.218 18.359 830 HG12 VAL 97 HG12 VAL 97 18.002 -36.769 19.175 831 HG13 VAL 97 HG13 VAL 97 16.470 -36.630 20.038 832 HG21 VAL 97 HG21 VAL 97 17.633 -33.938 16.907 833 HG22 VAL 97 HG22 VAL 97 18.643 -35.285 17.434 834 HG23 VAL 97 HG23 VAL 97 17.175 -35.600 16.482 835 H SER 98 H SER 98 15.398 -33.218 20.423 836 HA SER 98 HA SER 98 13.295 -34.699 21.924 837 HB2 SER 98 HB2 SER 98 14.383 -33.735 23.938 838 HB3 SER 98 HB3 SER 98 15.438 -34.795 22.990 839 HG SER 98 HG SER 98 16.491 -32.841 23.615 840 H SER 99 H SER 99 13.475 -32.002 20.078 841 HA SER 99 HA SER 99 11.728 -30.340 21.789 842 HB2 SER 99 HB2 SER 99 13.660 -29.479 19.620 843 HB3 SER 99 HB3 SER 99 12.658 -28.400 20.609 844 HG SER 99 HG SER 99 14.797 -28.608 21.428 845 H ALA 100 H ALA 100 11.187 -32.389 19.345 846 HA ALA 100 HA ALA 100 9.742 -30.700 17.467 847 HB1 ALA 100 HB1 ALA 100 9.800 -33.726 17.807 848 HB2 ALA 100 HB2 ALA 100 9.111 -32.842 16.432 849 HB3 ALA 100 HB3 ALA 100 10.854 -32.770 16.743 850 H SER 101 H SER 101 7.689 -30.064 17.528 851 HA SER 101 HA SER 101 5.622 -31.509 19.113 852 HB2 SER 101 HB2 SER 101 6.146 -28.511 19.253 853 HB3 SER 101 HB3 SER 101 4.711 -29.333 19.896 854 HG SER 101 HG SER 101 6.322 -28.982 21.503 855 H ALA 102 H ALA 102 3.813 -31.777 17.967 856 HA ALA 102 HA ALA 102 2.369 -31.856 16.266 857 HB1 ALA 102 HB1 ALA 102 2.816 -28.865 16.052 858 HB2 ALA 102 HB2 ALA 102 1.389 -29.774 15.515 859 HB3 ALA 102 HB3 ALA 102 1.767 -29.669 17.245 860 H GLN 103 H GLN 103 5.367 -31.970 15.531 861 HA GLN 103 HA GLN 103 5.349 -31.255 12.684 862 HB2 GLN 103 HB2 GLN 103 7.457 -32.558 14.444 863 HB3 GLN 103 HB3 GLN 103 7.672 -32.197 12.727 864 HG2 GLN 103 HG2 GLN 103 7.353 -29.791 13.150 865 HG3 GLN 103 HG3 GLN 103 7.076 -30.110 14.861 866 HE21 GLN 103 HE21 GLN 103 10.553 -29.146 14.989 867 HE22 GLN 103 HE22 GLN 103 8.911 -28.481 15.034 868 HA PRO 104 HA PRO 104 4.387 -35.495 11.403 869 HB2 PRO 104 HB2 PRO 104 4.831 -35.366 8.736 870 HB3 PRO 104 HB3 PRO 104 3.557 -34.388 9.515 871 HG2 PRO 104 HG2 PRO 104 6.383 -33.506 8.819 872 HG3 PRO 104 HG3 PRO 104 4.840 -32.697 8.394 873 HD2 PRO 104 HD2 PRO 104 6.330 -31.998 10.593 874 HD3 PRO 104 HD3 PRO 104 4.543 -31.904 10.579 875 H ASN 105 H ASN 105 6.549 -35.509 12.891 876 HA ASN 105 HA ASN 105 8.733 -36.925 11.412 877 HB2 ASN 105 HB2 ASN 105 9.252 -34.514 11.891 878 HB3 ASN 105 HB3 ASN 105 9.084 -34.845 13.615 879 HD21 ASN 105 HD21 ASN 105 12.369 -36.256 11.569 880 HD22 ASN 105 HD22 ASN 105 10.919 -35.830 10.675 881 H LEU 106 H LEU 106 7.376 -38.759 12.095 882 HA LEU 106 HA LEU 106 7.972 -39.686 14.887 883 HB2 LEU 106 HB2 LEU 106 5.608 -40.258 13.076 884 HB3 LEU 106 HB3 LEU 106 6.067 -41.280 14.430 885 HG LEU 106 HG LEU 106 5.841 -39.292 15.971 886 HD11 LEU 106 HD11 LEU 106 4.495 -38.061 13.523 887 HD12 LEU 106 HD12 LEU 106 4.255 -37.495 15.191 888 HD13 LEU 106 HD13 LEU 106 5.847 -37.385 14.462 889 HD21 LEU 106 HD21 LEU 106 4.147 -41.072 15.772 890 HD22 LEU 106 HD22 LEU 106 3.391 -39.504 16.070 891 HD23 LEU 106 HD23 LEU 106 3.371 -40.197 14.431 892 HA PRO 107 HA PRO 107 10.520 -42.295 12.047 893 HB2 PRO 107 HB2 PRO 107 12.667 -42.689 13.690 894 HB3 PRO 107 HB3 PRO 107 12.424 -41.197 12.730 895 HG2 PRO 107 HG2 PRO 107 11.728 -41.670 15.647 896 HG3 PRO 107 HG3 PRO 107 12.613 -40.286 14.930 897 HD2 PRO 107 HD2 PRO 107 9.954 -40.167 15.484 898 HD3 PRO 107 HD3 PRO 107 10.638 -39.362 14.038 Start of MODEL 7 1 H1 GLY -5 H1 GLY -5 -51.394 -23.504 5.424 2 H2 GLY -5 H2 GLY -5 -51.592 -25.045 4.900 3 H3 GLY -5 H3 GLY -5 -50.233 -24.214 4.517 4 HA2 GLY -5 HA2 GLY -5 -51.020 -25.049 7.232 5 HA3 GLY -5 HA3 GLY -5 -49.759 -25.817 6.250 6 H SER -4 H SER -4 -48.977 -25.040 8.645 7 HA SER -4 HA SER -4 -47.609 -23.782 9.929 8 HB2 SER -4 HB2 SER -4 -46.157 -24.146 7.869 9 HB3 SER -4 HB3 SER -4 -46.516 -22.462 7.436 10 HG SER -4 HG SER -4 -44.572 -22.778 8.715 11 H HIS -3 H HIS -3 -46.663 -21.248 9.976 12 HA HIS -3 HA HIS -3 -48.944 -19.360 9.631 13 HB2 HIS -3 HB2 HIS -3 -48.969 -20.252 11.980 14 HB3 HIS -3 HB3 HIS -3 -47.358 -19.583 12.216 15 HD2 HIS -3 HD2 HIS -3 -47.169 -16.879 12.470 16 HE1 HIS -3 HE1 HIS -3 -51.357 -16.124 12.768 17 HE2 HIS -3 HE2 HIS -3 -49.034 -15.140 13.140 18 H MET -2 H MET -2 -48.292 -17.554 8.668 19 HA MET -2 HA MET -2 -45.415 -16.721 8.733 20 HB2 MET -2 HB2 MET -2 -47.187 -17.035 6.275 21 HB3 MET -2 HB3 MET -2 -45.604 -16.247 6.302 22 HG2 MET -2 HG2 MET -2 -44.569 -18.368 7.073 23 HG3 MET -2 HG3 MET -2 -46.148 -19.159 6.984 24 HE1 MET -2 HE1 MET -2 -45.189 -21.084 5.496 25 HE2 MET -2 HE2 MET -2 -44.243 -20.817 4.015 26 HE3 MET -2 HE3 MET -2 -43.577 -20.335 5.592 27 H ALA -1 H ALA -1 -45.806 -15.029 10.119 28 HA ALA -1 HA ALA -1 -46.964 -12.634 8.918 29 HB1 ALA -1 HB1 ALA -1 -48.087 -13.741 11.517 30 HB2 ALA -1 HB2 ALA -1 -48.463 -12.161 10.789 31 HB3 ALA -1 HB3 ALA -1 -48.946 -13.651 9.965 32 H SER 0 H SER 0 -44.976 -11.777 8.961 33 HA SER 0 HA SER 0 -43.644 -11.250 11.601 34 HB2 SER 0 HB2 SER 0 -42.358 -11.521 8.864 35 HB3 SER 0 HB3 SER 0 -41.522 -11.293 10.411 36 HG SER 0 HG SER 0 -41.566 -13.497 9.767 37 H MET 1 H MET 1 -45.360 -9.601 9.318 38 HA MET 1 HA MET 1 -44.190 -6.997 10.072 39 HB2 MET 1 HB2 MET 1 -43.953 -6.233 7.744 40 HB3 MET 1 HB3 MET 1 -42.885 -7.578 8.124 41 HG2 MET 1 HG2 MET 1 -44.435 -9.145 6.993 42 HG3 MET 1 HG3 MET 1 -45.506 -7.796 6.593 43 HE1 MET 1 HE1 MET 1 -45.393 -8.782 4.079 44 HE2 MET 1 HE2 MET 1 -43.878 -8.959 3.166 45 HE3 MET 1 HE3 MET 1 -44.198 -10.009 4.563 46 H ASP 2 H ASP 2 -46.909 -8.734 9.749 47 HA ASP 2 HA ASP 2 -48.629 -6.280 9.686 48 HB2 ASP 2 HB2 ASP 2 -49.278 -9.090 8.713 49 HB3 ASP 2 HB3 ASP 2 -50.464 -7.804 8.899 50 H GLN 3 H GLN 3 -47.168 -8.126 11.782 51 HA GLN 3 HA GLN 3 -49.366 -8.461 13.743 52 HB2 GLN 3 HB2 GLN 3 -49.247 -10.468 12.247 53 HB3 GLN 3 HB3 GLN 3 -47.574 -10.693 12.724 54 HG2 GLN 3 HG2 GLN 3 -48.990 -10.616 15.183 55 HG3 GLN 3 HG3 GLN 3 -50.089 -11.444 14.086 56 HE21 GLN 3 HE21 GLN 3 -46.365 -13.131 14.766 57 HE22 GLN 3 HE22 GLN 3 -46.587 -11.387 14.906 58 H LEU 4 H LEU 4 -47.543 -6.525 13.936 59 HA LEU 4 HA LEU 4 -46.182 -7.247 16.431 60 HB2 LEU 4 HB2 LEU 4 -44.140 -6.150 15.961 61 HB3 LEU 4 HB3 LEU 4 -44.370 -7.405 14.763 62 HG LEU 4 HG LEU 4 -44.910 -4.439 14.226 63 HD11 LEU 4 HD11 LEU 4 -42.418 -6.080 13.640 64 HD12 LEU 4 HD12 LEU 4 -42.718 -4.403 13.129 65 HD13 LEU 4 HD13 LEU 4 -42.560 -4.782 14.848 66 HD21 LEU 4 HD21 LEU 4 -45.999 -5.842 12.549 67 HD22 LEU 4 HD22 LEU 4 -44.555 -5.135 11.837 68 HD23 LEU 4 HD23 LEU 4 -44.525 -6.831 12.374 69 H ASP 5 H ASP 5 -45.947 -5.536 17.890 70 HA ASP 5 HA ASP 5 -46.840 -2.826 17.211 71 HB2 ASP 5 HB2 ASP 5 -48.995 -3.981 17.622 72 HB3 ASP 5 HB3 ASP 5 -48.419 -4.509 19.203 73 H GLU 6 H GLU 6 -46.285 -4.963 20.093 74 HA GLU 6 HA GLU 6 -44.276 -3.042 21.142 75 HB2 GLU 6 HB2 GLU 6 -46.576 -2.799 22.135 76 HB3 GLU 6 HB3 GLU 6 -46.519 -4.492 22.616 77 HG2 GLU 6 HG2 GLU 6 -45.969 -3.270 24.529 78 HG3 GLU 6 HG3 GLU 6 -44.440 -3.929 23.958 79 H ILE 7 H ILE 7 -42.847 -4.560 19.989 80 HA ILE 7 HA ILE 7 -42.405 -7.192 21.359 81 HB ILE 7 HB ILE 7 -41.776 -6.391 18.502 82 HG12 ILE 7 HG12 ILE 7 -44.176 -6.579 18.696 83 HG13 ILE 7 HG13 ILE 7 -43.511 -7.892 17.748 84 HG21 ILE 7 HG21 ILE 7 -41.484 -9.060 19.931 85 HG22 ILE 7 HG22 ILE 7 -41.321 -8.821 18.178 86 HG23 ILE 7 HG23 ILE 7 -40.183 -8.045 19.280 87 HD11 ILE 7 HD11 ILE 7 -44.397 -8.117 20.652 88 HD12 ILE 7 HD12 ILE 7 -45.304 -8.666 19.232 89 HD13 ILE 7 HD13 ILE 7 -43.767 -9.443 19.649 90 H ILE 8 H ILE 8 -40.629 -7.282 22.565 91 HA ILE 8 HA ILE 8 -38.172 -5.793 21.804 92 HB ILE 8 HB ILE 8 -39.328 -5.668 24.617 93 HG12 ILE 8 HG12 ILE 8 -39.229 -3.464 22.510 94 HG13 ILE 8 HG13 ILE 8 -40.685 -4.250 23.128 95 HG21 ILE 8 HG21 ILE 8 -36.927 -4.247 23.358 96 HG22 ILE 8 HG22 ILE 8 -37.442 -4.151 25.056 97 HG23 ILE 8 HG23 ILE 8 -36.814 -5.660 24.429 98 HD11 ILE 8 HD11 ILE 8 -38.848 -2.417 24.692 99 HD12 ILE 8 HD12 ILE 8 -40.521 -2.139 24.200 100 HD13 ILE 8 HD13 ILE 8 -40.162 -3.379 25.416 101 H GLU 9 H GLU 9 -36.953 -7.527 21.367 102 HA GLU 9 HA GLU 9 -36.274 -9.406 23.595 103 HB2 GLU 9 HB2 GLU 9 -37.071 -10.079 20.759 104 HB3 GLU 9 HB3 GLU 9 -35.751 -10.966 21.492 105 HG2 GLU 9 HG2 GLU 9 -37.669 -12.259 21.858 106 HG3 GLU 9 HG3 GLU 9 -37.158 -11.607 23.407 107 H GLN 10 H GLN 10 -34.346 -8.661 24.215 108 HA GLN 10 HA GLN 10 -32.084 -8.572 22.349 109 HB2 GLN 10 HB2 GLN 10 -33.275 -6.310 22.252 110 HB3 GLN 10 HB3 GLN 10 -32.856 -6.089 23.953 111 HG2 GLN 10 HG2 GLN 10 -30.454 -6.188 23.365 112 HG3 GLN 10 HG3 GLN 10 -30.860 -6.537 21.683 113 HE21 GLN 10 HE21 GLN 10 -30.099 -2.969 21.621 114 HE22 GLN 10 HE22 GLN 10 -29.272 -4.520 21.659 115 H ILE 11 H ILE 11 -30.053 -8.666 23.452 116 HA ILE 11 HA ILE 11 -28.712 -9.675 24.969 117 HB ILE 11 HB ILE 11 -28.257 -8.218 26.892 118 HG12 ILE 11 HG12 ILE 11 -30.419 -6.371 25.785 119 HG13 ILE 11 HG13 ILE 11 -30.598 -7.327 27.255 120 HG21 ILE 11 HG21 ILE 11 -28.466 -6.863 24.182 121 HG22 ILE 11 HG22 ILE 11 -27.323 -6.466 25.481 122 HG23 ILE 11 HG23 ILE 11 -27.223 -8.027 24.666 123 HD11 ILE 11 HD11 ILE 11 -28.584 -5.094 26.804 124 HD12 ILE 11 HD12 ILE 11 -30.003 -5.077 27.859 125 HD13 ILE 11 HD13 ILE 11 -28.636 -6.140 28.247 126 H GLN 12 H GLN 12 -30.178 -11.503 24.991 127 HA GLN 12 HA GLN 12 -31.637 -11.982 27.521 128 HB2 GLN 12 HB2 GLN 12 -31.598 -13.719 25.033 129 HB3 GLN 12 HB3 GLN 12 -32.679 -13.840 26.406 130 HG2 GLN 12 HG2 GLN 12 -34.114 -12.383 25.493 131 HG3 GLN 12 HG3 GLN 12 -32.886 -11.152 25.300 132 HE21 GLN 12 HE21 GLN 12 -32.102 -12.390 21.869 133 HE22 GLN 12 HE22 GLN 12 -31.172 -11.991 23.290 134 H LYS 13 H LYS 13 -30.075 -14.518 25.661 135 HA LYS 13 HA LYS 13 -27.944 -15.042 27.625 136 HB2 LYS 13 HB2 LYS 13 -30.169 -16.055 28.422 137 HB3 LYS 13 HB3 LYS 13 -30.054 -17.169 27.062 138 HG2 LYS 13 HG2 LYS 13 -28.046 -18.181 28.004 139 HG3 LYS 13 HG3 LYS 13 -27.852 -16.853 29.154 140 HD2 LYS 13 HD2 LYS 13 -28.700 -18.850 30.269 141 HD3 LYS 13 HD3 LYS 13 -29.875 -17.531 30.352 142 HE2 LYS 13 HE2 LYS 13 -31.130 -18.551 28.445 143 HE3 LYS 13 HE3 LYS 13 -29.958 -19.875 28.394 144 HZ1 LYS 13 HZ1 LYS 13 -31.715 -19.234 30.707 145 HZ2 LYS 13 HZ2 LYS 13 -31.936 -20.477 29.675 146 HZ3 LYS 13 HZ3 LYS 13 -30.638 -20.463 30.664 147 H GLU 14 H GLU 14 -27.954 -14.241 24.839 148 HA GLU 14 HA GLU 14 -27.274 -16.628 23.280 149 HB2 GLU 14 HB2 GLU 14 -28.708 -15.168 22.175 150 HB3 GLU 14 HB3 GLU 14 -27.653 -13.762 22.459 151 HG2 GLU 14 HG2 GLU 14 -25.918 -14.817 21.003 152 HG3 GLU 14 HG3 GLU 14 -26.982 -16.201 20.752 153 H ALA 15 H ALA 15 -25.361 -17.338 23.209 154 HA ALA 15 HA ALA 15 -22.934 -15.596 23.242 155 HB1 ALA 15 HB1 ALA 15 -23.397 -18.066 24.959 156 HB2 ALA 15 HB2 ALA 15 -21.850 -17.205 24.784 157 HB3 ALA 15 HB3 ALA 15 -23.245 -16.390 25.526 158 H ILE 16 H ILE 16 -23.487 -19.104 23.189 159 HA ILE 16 HA ILE 16 -21.946 -19.314 20.655 160 HB ILE 16 HB ILE 16 -21.710 -20.709 23.325 161 HG12 ILE 16 HG12 ILE 16 -19.635 -19.331 21.562 162 HG13 ILE 16 HG13 ILE 16 -20.450 -18.602 22.942 163 HG21 ILE 16 HG21 ILE 16 -20.367 -21.720 20.784 164 HG22 ILE 16 HG22 ILE 16 -20.026 -22.292 22.432 165 HG23 ILE 16 HG23 ILE 16 -21.604 -22.573 21.744 166 HD11 ILE 16 HD11 ILE 16 -18.432 -20.858 23.041 167 HD12 ILE 16 HD12 ILE 16 -18.294 -19.220 23.683 168 HD13 ILE 16 HD13 ILE 16 -19.433 -20.356 24.430 169 H ASN 17 H ASN 17 -24.927 -19.731 21.627 170 HA ASN 17 HA ASN 17 -25.445 -22.364 20.584 171 HB2 ASN 17 HB2 ASN 17 -27.802 -21.838 20.849 172 HB3 ASN 17 HB3 ASN 17 -26.930 -21.206 22.237 173 HD21 ASN 17 HD21 ASN 17 -28.248 -18.003 21.714 174 HD22 ASN 17 HD22 ASN 17 -27.496 -19.151 22.821 175 H SER 18 H SER 18 -24.929 -19.351 19.047 176 HA SER 18 HA SER 18 -26.484 -19.850 16.649 177 HB2 SER 18 HB2 SER 18 -25.398 -17.733 15.881 178 HB3 SER 18 HB3 SER 18 -26.183 -17.599 17.467 179 HG SER 18 HG SER 18 -24.065 -16.670 17.442 180 H ASN 19 H ASN 19 -23.068 -20.287 17.457 181 HA ASN 19 HA ASN 19 -22.462 -20.978 14.630 182 HB2 ASN 19 HB2 ASN 19 -20.149 -20.616 15.184 183 HB3 ASN 19 HB3 ASN 19 -21.094 -19.239 15.732 184 HD21 ASN 19 HD21 ASN 19 -20.219 -19.724 19.136 185 HD22 ASN 19 HD22 ASN 19 -21.195 -18.801 17.998 186 H VAL 20 H VAL 20 -23.109 -22.610 17.514 187 HA VAL 20 HA VAL 20 -21.629 -25.068 16.768 188 HB VAL 20 HB VAL 20 -23.504 -24.438 19.070 189 HG11 VAL 20 HG11 VAL 20 -21.980 -27.019 18.499 190 HG12 VAL 20 HG12 VAL 20 -22.756 -26.609 20.044 191 HG13 VAL 20 HG13 VAL 20 -23.746 -26.834 18.604 192 HG21 VAL 20 HG21 VAL 20 -21.237 -23.406 19.175 193 HG22 VAL 20 HG22 VAL 20 -21.436 -24.657 20.408 194 HG23 VAL 20 HG23 VAL 20 -20.500 -25.001 18.937 195 H VAL 21 H VAL 21 -24.963 -23.845 16.657 196 HA VAL 21 HA VAL 21 -25.873 -26.367 15.343 197 HB VAL 21 HB VAL 21 -27.599 -24.221 16.622 198 HG11 VAL 21 HG11 VAL 21 -28.176 -27.094 15.738 199 HG12 VAL 21 HG12 VAL 21 -29.322 -26.000 16.540 200 HG13 VAL 21 HG13 VAL 21 -28.752 -25.626 14.913 201 HG21 VAL 21 HG21 VAL 21 -26.264 -25.269 18.390 202 HG22 VAL 21 HG22 VAL 21 -27.912 -25.887 18.455 203 HG23 VAL 21 HG23 VAL 21 -26.624 -26.888 17.746 204 H LEU 22 H LEU 22 -24.847 -25.800 13.391 205 HA LEU 22 HA LEU 22 -26.266 -23.747 11.753 206 HB2 LEU 22 HB2 LEU 22 -23.761 -23.402 12.461 207 HB3 LEU 22 HB3 LEU 22 -23.418 -24.674 11.297 208 HG LEU 22 HG LEU 22 -24.608 -23.210 9.542 209 HD11 LEU 22 HD11 LEU 22 -24.315 -21.117 11.746 210 HD12 LEU 22 HD12 LEU 22 -24.746 -20.790 10.054 211 HD13 LEU 22 HD13 LEU 22 -25.851 -21.707 11.083 212 HD21 LEU 22 HD21 LEU 22 -22.163 -23.373 9.678 213 HD22 LEU 22 HD22 LEU 22 -22.665 -21.730 9.250 214 HD23 LEU 22 HD23 LEU 22 -22.130 -22.089 10.909 215 H LYS 23 H LYS 23 -26.641 -24.214 9.547 216 HA LYS 23 HA LYS 23 -26.560 -27.094 8.731 217 HB2 LYS 23 HB2 LYS 23 -28.924 -25.178 8.655 218 HB3 LYS 23 HB3 LYS 23 -28.913 -26.732 7.826 219 HG2 LYS 23 HG2 LYS 23 -28.547 -26.430 10.826 220 HG3 LYS 23 HG3 LYS 23 -30.085 -26.745 10.026 221 HD2 LYS 23 HD2 LYS 23 -29.237 -28.846 9.085 222 HD3 LYS 23 HD3 LYS 23 -27.657 -28.598 9.828 223 HE2 LYS 23 HE2 LYS 23 -30.264 -28.839 11.387 224 HE3 LYS 23 HE3 LYS 23 -29.188 -30.193 11.032 225 HZ1 LYS 23 HZ1 LYS 23 -28.444 -27.804 12.626 226 HZ2 LYS 23 HZ2 LYS 23 -28.689 -29.310 13.207 227 HZ3 LYS 23 HZ3 LYS 23 -27.413 -29.011 12.232 228 H ASN 24 H ASN 24 -24.853 -24.850 7.914 229 HA ASN 24 HA ASN 24 -25.090 -25.386 4.992 230 HB2 ASN 24 HB2 ASN 24 -25.993 -23.112 5.437 231 HB3 ASN 24 HB3 ASN 24 -24.457 -22.660 6.180 232 HD21 ASN 24 HD21 ASN 24 -23.450 -21.519 2.989 233 HD22 ASN 24 HD22 ASN 24 -23.701 -21.145 4.687 234 HA PRO 25 HA PRO 25 -20.752 -26.111 6.503 235 HB2 PRO 25 HB2 PRO 25 -20.532 -28.809 6.595 236 HB3 PRO 25 HB3 PRO 25 -21.393 -27.906 7.875 237 HG2 PRO 25 HG2 PRO 25 -22.622 -29.284 5.452 238 HG3 PRO 25 HG3 PRO 25 -23.081 -29.468 7.174 239 HD2 PRO 25 HD2 PRO 25 -24.361 -27.722 5.482 240 HD3 PRO 25 HD3 PRO 25 -24.126 -27.391 7.225 241 H ARG 26 H ARG 26 -20.902 -25.036 4.319 242 HA ARG 26 HA ARG 26 -19.944 -26.841 2.101 243 HB2 ARG 26 HB2 ARG 26 -21.773 -24.420 1.963 244 HB3 ARG 26 HB3 ARG 26 -21.024 -25.198 0.554 245 HG2 ARG 26 HG2 ARG 26 -22.117 -27.368 1.246 246 HG3 ARG 26 HG3 ARG 26 -22.989 -26.476 2.506 247 HD2 ARG 26 HD2 ARG 26 -23.994 -25.014 0.776 248 HD3 ARG 26 HD3 ARG 26 -23.138 -25.891 -0.489 249 HE ARG 26 HE ARG 26 -25.530 -26.731 0.977 250 HH11 ARG 26 HH11 ARG 26 -26.602 -28.579 0.382 251 HH12 ARG 26 HH12 ARG 26 -25.835 -29.731 -0.670 252 HH21 ARG 26 HH21 ARG 26 -22.915 -27.972 -1.012 253 HH22 ARG 26 HH22 ARG 26 -23.807 -29.406 -1.438 254 H VAL 27 H VAL 27 -19.851 -23.314 2.839 255 HA VAL 27 HA VAL 27 -16.980 -23.259 2.567 256 HB VAL 27 HB VAL 27 -17.607 -23.326 0.263 257 HG11 VAL 27 HG11 VAL 27 -19.098 -20.699 0.541 258 HG12 VAL 27 HG12 VAL 27 -18.803 -21.631 -0.934 259 HG13 VAL 27 HG13 VAL 27 -19.861 -22.293 0.320 260 HG21 VAL 27 HG21 VAL 27 -15.626 -22.012 0.980 261 HG22 VAL 27 HG22 VAL 27 -16.344 -21.395 -0.518 262 HG23 VAL 27 HG23 VAL 27 -16.624 -20.542 1.014 263 HA PRO 28 HA PRO 28 -18.052 -19.530 4.981 264 HB2 PRO 28 HB2 PRO 28 -15.654 -19.170 6.216 265 HB3 PRO 28 HB3 PRO 28 -16.808 -20.450 6.706 266 HG2 PRO 28 HG2 PRO 28 -14.338 -20.710 4.985 267 HG3 PRO 28 HG3 PRO 28 -14.938 -21.810 6.273 268 HD2 PRO 28 HD2 PRO 28 -15.316 -22.174 3.550 269 HD3 PRO 28 HD3 PRO 28 -16.358 -22.872 4.827 270 H THR 29 H THR 29 -17.875 -17.413 4.455 271 HA THR 29 HA THR 29 -15.791 -16.580 2.498 272 HB THR 29 HB THR 29 -17.691 -17.160 1.225 273 HG1 THR 29 HG1 THR 29 -17.928 -15.210 0.152 274 HG21 THR 29 HG21 THR 29 -19.360 -15.085 2.701 275 HG22 THR 29 HG22 THR 29 -19.830 -16.031 1.280 276 HG23 THR 29 HG23 THR 29 -19.549 -16.847 2.820 277 H GLN 30 H GLN 30 -14.772 -15.895 4.435 278 HA GLN 30 HA GLN 30 -15.663 -13.201 5.351 279 HB2 GLN 30 HB2 GLN 30 -14.505 -15.539 6.904 280 HB3 GLN 30 HB3 GLN 30 -14.521 -13.908 7.577 281 HG2 GLN 30 HG2 GLN 30 -16.829 -13.791 7.743 282 HG3 GLN 30 HG3 GLN 30 -17.117 -15.024 6.524 283 HE21 GLN 30 HE21 GLN 30 -16.708 -17.808 8.734 284 HE22 GLN 30 HE22 GLN 30 -16.550 -17.310 7.054 285 H LYS 31 H LYS 31 -13.771 -14.065 3.257 286 HA LYS 31 HA LYS 31 -11.167 -13.054 4.182 287 HB2 LYS 31 HB2 LYS 31 -11.865 -15.129 2.662 288 HB3 LYS 31 HB3 LYS 31 -11.707 -13.977 1.359 289 HG2 LYS 31 HG2 LYS 31 -9.548 -14.763 3.392 290 HG3 LYS 31 HG3 LYS 31 -9.724 -15.403 1.772 291 HD2 LYS 31 HD2 LYS 31 -8.015 -13.921 1.438 292 HD3 LYS 31 HD3 LYS 31 -9.401 -12.980 0.926 293 HE2 LYS 31 HE2 LYS 31 -8.016 -11.528 2.201 294 HE3 LYS 31 HE3 LYS 31 -9.399 -11.882 3.230 295 HZ1 LYS 31 HZ1 LYS 31 -6.734 -13.194 3.425 296 HZ2 LYS 31 HZ2 LYS 31 -7.297 -12.057 4.448 297 HZ3 LYS 31 HZ3 LYS 31 -8.000 -13.527 4.402 298 H THR 32 H THR 32 -13.052 -11.112 4.314 299 HA THR 32 HA THR 32 -12.301 -9.152 2.181 300 HB THR 32 HB THR 32 -14.413 -10.350 1.672 301 HG1 THR 32 HG1 THR 32 -15.555 -8.527 1.133 302 HG21 THR 32 HG21 THR 32 -15.560 -8.880 4.081 303 HG22 THR 32 HG22 THR 32 -16.467 -9.828 2.884 304 HG23 THR 32 HG23 THR 32 -15.312 -10.637 3.951 305 H GLY 33 H GLY 33 -11.881 -9.571 5.286 306 HA2 GLY 33 HA2 GLY 33 -13.222 -7.421 6.609 307 HA3 GLY 33 HA3 GLY 33 -11.855 -8.340 7.233 308 H GLU 34 H GLU 34 -9.710 -7.703 5.841 309 HA GLU 34 HA GLU 34 -9.333 -4.810 6.400 310 HB2 GLU 34 HB2 GLU 34 -7.374 -7.050 5.796 311 HB3 GLU 34 HB3 GLU 34 -6.906 -5.383 6.114 312 HG2 GLU 34 HG2 GLU 34 -8.418 -7.127 8.100 313 HG3 GLU 34 HG3 GLU 34 -6.674 -6.925 8.068 314 H LEU 35 H LEU 35 -9.312 -6.958 3.598 315 HA LEU 35 HA LEU 35 -9.191 -4.717 1.730 316 HB2 LEU 35 HB2 LEU 35 -7.181 -7.023 1.717 317 HB3 LEU 35 HB3 LEU 35 -7.614 -6.093 0.296 318 HG LEU 35 HG LEU 35 -6.945 -4.011 1.855 319 HD11 LEU 35 HD11 LEU 35 -5.078 -6.227 2.815 320 HD12 LEU 35 HD12 LEU 35 -4.930 -4.488 3.157 321 HD13 LEU 35 HD13 LEU 35 -6.277 -5.403 3.825 322 HD21 LEU 35 HD21 LEU 35 -5.984 -4.537 -0.355 323 HD22 LEU 35 HD22 LEU 35 -4.703 -4.118 0.788 324 HD23 LEU 35 HD23 LEU 35 -5.009 -5.820 0.362 325 H SER 36 H SER 36 -10.364 -5.090 0.018 326 HA SER 36 HA SER 36 -11.658 -7.743 -0.495 327 HB2 SER 36 HB2 SER 36 -13.268 -6.166 0.401 328 HB3 SER 36 HB3 SER 36 -12.847 -4.994 -0.858 329 HG SER 36 HG SER 36 -14.724 -6.312 -1.334 330 H GLU 37 H GLU 37 -11.274 -4.789 -2.376 331 HA GLU 37 HA GLU 37 -9.800 -6.218 -4.473 332 HB2 GLU 37 HB2 GLU 37 -12.559 -6.559 -4.405 333 HB3 GLU 37 HB3 GLU 37 -12.415 -5.139 -5.455 334 HG2 GLU 37 HG2 GLU 37 -10.658 -6.422 -6.761 335 HG3 GLU 37 HG3 GLU 37 -11.002 -7.813 -5.720 336 H GLU 38 H GLU 38 -11.792 -3.387 -3.683 337 HA GLU 38 HA GLU 38 -10.471 -1.528 -5.452 338 HB2 GLU 38 HB2 GLU 38 -11.916 -1.036 -2.815 339 HB3 GLU 38 HB3 GLU 38 -11.480 0.206 -3.986 340 HG2 GLU 38 HG2 GLU 38 -13.448 -2.081 -4.442 341 HG3 GLU 38 HG3 GLU 38 -13.856 -0.402 -4.129 342 H GLN 39 H GLN 39 -9.696 -2.761 -2.238 343 HA GLN 39 HA GLN 39 -7.729 -0.779 -1.526 344 HB2 GLN 39 HB2 GLN 39 -8.171 -3.628 -0.558 345 HB3 GLN 39 HB3 GLN 39 -7.086 -2.439 0.166 346 HG2 GLN 39 HG2 GLN 39 -9.043 -2.342 1.490 347 HG3 GLN 39 HG3 GLN 39 -9.070 -0.902 0.479 348 HE21 GLN 39 HE21 GLN 39 -12.465 -1.756 -0.022 349 HE22 GLN 39 HE22 GLN 39 -11.347 -0.699 0.840 350 H LYS 40 H LYS 40 -7.495 -3.867 -3.261 351 HA LYS 40 HA LYS 40 -4.598 -3.740 -3.634 352 HB2 LYS 40 HB2 LYS 40 -6.842 -5.257 -5.018 353 HB3 LYS 40 HB3 LYS 40 -5.154 -5.438 -5.505 354 HG2 LYS 40 HG2 LYS 40 -4.499 -6.492 -3.569 355 HG3 LYS 40 HG3 LYS 40 -5.733 -5.738 -2.578 356 HD2 LYS 40 HD2 LYS 40 -7.153 -7.352 -4.487 357 HD3 LYS 40 HD3 LYS 40 -5.796 -8.327 -3.889 358 HE2 LYS 40 HE2 LYS 40 -6.455 -7.733 -1.547 359 HE3 LYS 40 HE3 LYS 40 -7.821 -6.802 -2.190 360 HZ1 LYS 40 HZ1 LYS 40 -7.484 -9.715 -2.726 361 HZ2 LYS 40 HZ2 LYS 40 -8.341 -9.152 -1.453 362 HZ3 LYS 40 HZ3 LYS 40 -8.837 -8.798 -2.952 363 H LYS 41 H LYS 41 -7.390 -2.650 -5.512 364 HA LYS 41 HA LYS 41 -5.836 -1.525 -7.667 365 HB2 LYS 41 HB2 LYS 41 -8.535 -0.560 -6.642 366 HB3 LYS 41 HB3 LYS 41 -7.796 -0.078 -8.161 367 HG2 LYS 41 HG2 LYS 41 -7.909 -2.365 -9.024 368 HG3 LYS 41 HG3 LYS 41 -8.565 -2.937 -7.481 369 HD2 LYS 41 HD2 LYS 41 -10.483 -1.315 -7.769 370 HD3 LYS 41 HD3 LYS 41 -9.886 -0.971 -9.401 371 HE2 LYS 41 HE2 LYS 41 -10.213 -3.299 -10.065 372 HE3 LYS 41 HE3 LYS 41 -10.576 -3.765 -8.395 373 HZ1 LYS 41 HZ1 LYS 41 -12.250 -1.954 -10.044 374 HZ2 LYS 41 HZ2 LYS 41 -12.623 -3.495 -9.631 375 HZ3 LYS 41 HZ3 LYS 41 -12.539 -2.335 -8.476 376 H ILE 42 H ILE 42 -5.801 -0.542 -4.475 377 HA ILE 42 HA ILE 42 -4.589 2.099 -5.170 378 HB ILE 42 HB ILE 42 -5.580 0.917 -2.570 379 HG12 ILE 42 HG12 ILE 42 -6.556 3.539 -3.695 380 HG13 ILE 42 HG13 ILE 42 -7.079 2.093 -4.532 381 HG21 ILE 42 HG21 ILE 42 -4.201 3.600 -2.970 382 HG22 ILE 42 HG22 ILE 42 -5.048 3.071 -1.495 383 HG23 ILE 42 HG23 ILE 42 -3.596 2.228 -2.015 384 HD11 ILE 42 HD11 ILE 42 -7.483 2.580 -1.569 385 HD12 ILE 42 HD12 ILE 42 -8.719 2.623 -2.861 386 HD13 ILE 42 HD13 ILE 42 -7.905 1.105 -2.463 387 H VAL 43 H VAL 43 -3.884 -0.794 -3.094 388 HA VAL 43 HA VAL 43 -1.111 0.081 -2.884 389 HB VAL 43 HB VAL 43 -2.349 -2.475 -1.808 390 HG11 VAL 43 HG11 VAL 43 0.301 -1.024 -1.379 391 HG12 VAL 43 HG12 VAL 43 -0.328 -2.173 -0.196 392 HG13 VAL 43 HG13 VAL 43 0.044 -2.716 -1.834 393 HG21 VAL 43 HG21 VAL 43 -3.501 -0.540 -0.876 394 HG22 VAL 43 HG22 VAL 43 -2.415 -1.206 0.345 395 HG23 VAL 43 HG23 VAL 43 -1.967 0.272 -0.539 396 H ALA 44 H ALA 44 -2.581 -2.901 -4.320 397 HA ALA 44 HA ALA 44 -0.057 -3.888 -5.300 398 HB1 ALA 44 HB1 ALA 44 -2.866 -4.552 -6.248 399 HB2 ALA 44 HB2 ALA 44 -1.384 -5.511 -6.473 400 HB3 ALA 44 HB3 ALA 44 -2.047 -5.298 -4.842 401 H ASP 45 H ASP 45 -2.544 -1.765 -6.672 402 HA ASP 45 HA ASP 45 -1.437 -1.435 -9.293 403 HB2 ASP 45 HB2 ASP 45 -3.633 -0.571 -8.527 404 HB3 ASP 45 HB3 ASP 45 -2.806 0.611 -7.506 405 H TYR 46 H TYR 46 -0.466 0.096 -6.190 406 HA TYR 46 HA TYR 46 1.555 1.797 -7.347 407 HB2 TYR 46 HB2 TYR 46 0.302 1.711 -4.962 408 HB3 TYR 46 HB3 TYR 46 1.737 0.822 -4.505 409 HD1 TYR 46 HD1 TYR 46 3.658 2.506 -6.358 410 HD2 TYR 46 HD2 TYR 46 0.668 3.502 -3.449 411 HE1 TYR 46 HE1 TYR 46 4.763 4.673 -6.033 412 HE2 TYR 46 HE2 TYR 46 1.846 5.658 -2.979 413 HH TYR 46 HH TYR 46 4.757 6.669 -4.815 414 H ILE 47 H ILE 47 1.578 -1.520 -6.012 415 HA ILE 47 HA ILE 47 4.400 -1.965 -6.163 416 HB ILE 47 HB ILE 47 2.109 -3.949 -6.388 417 HG12 ILE 47 HG12 ILE 47 1.745 -3.043 -4.295 418 HG13 ILE 47 HG13 ILE 47 2.785 -4.376 -3.903 419 HG21 ILE 47 HG21 ILE 47 4.951 -4.575 -5.558 420 HG22 ILE 47 HG22 ILE 47 3.577 -5.690 -5.644 421 HG23 ILE 47 HG23 ILE 47 4.221 -4.992 -7.126 422 HD11 ILE 47 HD11 ILE 47 3.565 -1.426 -4.075 423 HD12 ILE 47 HD12 ILE 47 3.436 -2.431 -2.623 424 HD13 ILE 47 HD13 ILE 47 4.725 -2.756 -3.803 425 H SER 48 H SER 48 1.977 -1.982 -8.701 426 HA SER 48 HA SER 48 3.822 -2.984 -10.740 427 HB2 SER 48 HB2 SER 48 1.095 -1.677 -10.975 428 HB3 SER 48 HB3 SER 48 2.021 -2.365 -12.320 429 HG SER 48 HG SER 48 0.507 -3.862 -11.452 430 H GLU 49 H GLU 49 3.663 0.126 -9.232 431 HA GLU 49 HA GLU 49 4.498 1.552 -11.718 432 HB2 GLU 49 HB2 GLU 49 3.755 2.535 -8.940 433 HB3 GLU 49 HB3 GLU 49 4.320 3.574 -10.245 434 HG2 GLU 49 HG2 GLU 49 1.875 1.810 -10.483 435 HG3 GLU 49 HG3 GLU 49 1.822 3.444 -9.835 436 H VAL 50 H VAL 50 5.554 1.309 -8.316 437 HA VAL 50 HA VAL 50 8.248 2.258 -9.199 438 HB VAL 50 HB VAL 50 8.437 3.497 -7.182 439 HG11 VAL 50 HG11 VAL 50 5.620 3.965 -8.163 440 HG12 VAL 50 HG12 VAL 50 6.735 5.120 -7.407 441 HG13 VAL 50 HG13 VAL 50 7.089 4.486 -9.020 442 HG21 VAL 50 HG21 VAL 50 7.467 1.977 -5.554 443 HG22 VAL 50 HG22 VAL 50 6.709 3.566 -5.472 444 HG23 VAL 50 HG23 VAL 50 5.859 2.210 -6.257 445 H GLY 51 H GLY 51 6.812 -0.373 -7.458 446 HA2 GLY 51 HA2 GLY 51 8.426 -2.346 -7.695 447 HA3 GLY 51 HA3 GLY 51 9.506 -1.403 -6.659 448 H LEU 52 H LEU 52 8.925 -0.997 -4.589 449 HA LEU 52 HA LEU 52 6.540 -1.703 -3.243 450 HB2 LEU 52 HB2 LEU 52 7.212 -3.604 -1.872 451 HB3 LEU 52 HB3 LEU 52 7.186 -4.025 -3.563 452 HG LEU 52 HG LEU 52 9.867 -3.365 -3.221 453 HD11 LEU 52 HD11 LEU 52 8.964 -4.838 -0.708 454 HD12 LEU 52 HD12 LEU 52 10.634 -4.468 -1.183 455 HD13 LEU 52 HD13 LEU 52 9.529 -3.157 -0.738 456 HD21 LEU 52 HD21 LEU 52 9.001 -5.353 -4.374 457 HD22 LEU 52 HD22 LEU 52 10.279 -5.784 -3.224 458 HD23 LEU 52 HD23 LEU 52 8.578 -6.089 -2.811 459 H ASN 53 H ASN 53 9.961 -1.087 -3.015 460 HA ASN 53 HA ASN 53 9.755 0.010 -0.287 461 HB2 ASN 53 HB2 ASN 53 12.150 -0.135 -0.275 462 HB3 ASN 53 HB3 ASN 53 11.526 -1.636 -0.946 463 HD21 ASN 53 HD21 ASN 53 13.939 0.707 -3.203 464 HD22 ASN 53 HD22 ASN 53 13.635 1.032 -1.505 465 H ASN 54 H ASN 54 9.692 1.289 -3.465 466 HA ASN 54 HA ASN 54 10.887 3.872 -2.711 467 HB2 ASN 54 HB2 ASN 54 9.770 2.947 -5.379 468 HB3 ASN 54 HB3 ASN 54 10.780 4.361 -5.097 469 HD21 ASN 54 HD21 ASN 54 12.517 0.796 -5.714 470 HD22 ASN 54 HD22 ASN 54 10.868 1.200 -6.174 471 H LEU 55 H LEU 55 7.743 2.547 -2.808 472 HA LEU 55 HA LEU 55 6.220 4.929 -3.360 473 HB2 LEU 55 HB2 LEU 55 4.304 3.541 -2.532 474 HB3 LEU 55 HB3 LEU 55 5.237 2.884 -3.858 475 HG LEU 55 HG LEU 55 6.383 1.330 -2.306 476 HD11 LEU 55 HD11 LEU 55 4.289 2.331 -0.328 477 HD12 LEU 55 HD12 LEU 55 5.265 0.851 -0.161 478 HD13 LEU 55 HD13 LEU 55 6.060 2.415 -0.134 479 HD21 LEU 55 HD21 LEU 55 4.472 0.672 -3.687 480 HD22 LEU 55 HD22 LEU 55 4.448 -0.165 -2.122 481 HD23 LEU 55 HD23 LEU 55 3.346 1.197 -2.418 482 H ASN 56 H ASN 56 4.570 5.803 -1.862 483 HA ASN 56 HA ASN 56 5.779 6.420 0.805 484 HB2 ASN 56 HB2 ASN 56 5.630 8.300 -0.760 485 HB3 ASN 56 HB3 ASN 56 3.896 8.014 -0.962 486 HD21 ASN 56 HD21 ASN 56 3.999 10.731 1.426 487 HD22 ASN 56 HD22 ASN 56 4.138 10.426 -0.302 488 H ALA 57 H ALA 57 4.864 5.388 2.429 489 HA ALA 57 HA ALA 57 2.461 3.918 2.422 490 HB1 ALA 57 HB1 ALA 57 4.028 5.151 4.726 491 HB2 ALA 57 HB2 ALA 57 2.869 3.812 4.860 492 HB3 ALA 57 HB3 ALA 57 4.375 3.587 3.956 493 H THR 58 H THR 58 2.935 7.370 3.119 494 HA THR 58 HA THR 58 0.402 7.879 4.371 495 HB THR 58 HB THR 58 2.241 9.690 2.775 496 HG1 THR 58 HG1 THR 58 2.978 10.254 4.812 497 HG21 THR 58 HG21 THR 58 -0.090 10.355 4.611 498 HG22 THR 58 HG22 THR 58 1.173 11.522 4.136 499 HG23 THR 58 HG23 THR 58 0.137 10.804 2.901 500 H GLU 59 H GLU 59 1.379 7.861 0.912 501 HA GLU 59 HA GLU 59 -1.183 8.766 -0.085 502 HB2 GLU 59 HB2 GLU 59 0.989 7.104 -1.424 503 HB3 GLU 59 HB3 GLU 59 -0.375 7.830 -2.260 504 HG2 GLU 59 HG2 GLU 59 1.775 9.393 -0.765 505 HG3 GLU 59 HG3 GLU 59 1.765 9.090 -2.493 506 H LEU 60 H LEU 60 0.122 5.510 0.590 507 HA LEU 60 HA LEU 60 -2.155 4.015 -0.350 508 HB2 LEU 60 HB2 LEU 60 -0.083 3.446 1.813 509 HB3 LEU 60 HB3 LEU 60 -1.407 2.356 1.450 510 HG LEU 60 HG LEU 60 -0.570 2.132 -0.903 511 HD11 LEU 60 HD11 LEU 60 1.915 3.500 0.205 512 HD12 LEU 60 HD12 LEU 60 1.784 2.678 -1.355 513 HD13 LEU 60 HD13 LEU 60 0.865 4.157 -1.072 514 HD21 LEU 60 HD21 LEU 60 -0.086 0.455 0.837 515 HD22 LEU 60 HD22 LEU 60 1.342 0.662 -0.196 516 HD23 LEU 60 HD23 LEU 60 1.284 1.413 1.410 517 H SER 61 H SER 61 -1.407 5.331 2.935 518 HA SER 61 HA SER 61 -3.804 4.322 4.098 519 HB2 SER 61 HB2 SER 61 -3.129 5.576 6.066 520 HB3 SER 61 HB3 SER 61 -1.732 4.756 5.351 521 HG SER 61 HG SER 61 -1.156 6.861 5.822 522 H LYS 62 H LYS 62 -3.090 7.395 2.578 523 HA LYS 62 HA LYS 62 -5.508 8.813 3.292 524 HB2 LYS 62 HB2 LYS 62 -3.535 9.018 0.986 525 HB3 LYS 62 HB3 LYS 62 -4.959 10.056 1.071 526 HG2 LYS 62 HG2 LYS 62 -4.256 11.105 3.089 527 HG3 LYS 62 HG3 LYS 62 -3.023 9.894 3.401 528 HD2 LYS 62 HD2 LYS 62 -1.947 11.920 2.602 529 HD3 LYS 62 HD3 LYS 62 -1.732 10.624 1.433 530 HE2 LYS 62 HE2 LYS 62 -2.177 12.606 0.200 531 HE3 LYS 62 HE3 LYS 62 -3.610 11.590 0.063 532 HZ1 LYS 62 HZ1 LYS 62 -3.313 13.900 1.920 533 HZ2 LYS 62 HZ2 LYS 62 -4.178 13.913 0.540 534 HZ3 LYS 62 HZ3 LYS 62 -4.661 12.983 1.789 535 H ARG 63 H ARG 63 -4.831 6.540 0.656 536 HA ARG 63 HA ARG 63 -7.530 6.939 -0.525 537 HB2 ARG 63 HB2 ARG 63 -5.028 5.435 -1.353 538 HB3 ARG 63 HB3 ARG 63 -6.554 5.250 -2.217 539 HG2 ARG 63 HG2 ARG 63 -5.208 7.954 -1.809 540 HG3 ARG 63 HG3 ARG 63 -4.913 6.906 -3.202 541 HD2 ARG 63 HD2 ARG 63 -7.316 6.939 -3.775 542 HD3 ARG 63 HD3 ARG 63 -7.651 8.005 -2.416 543 HE ARG 63 HE ARG 63 -6.230 8.672 -4.939 544 HH11 ARG 63 HH11 ARG 63 -6.074 10.797 -5.527 545 HH12 ARG 63 HH12 ARG 63 -6.501 12.050 -4.400 546 HH21 ARG 63 HH21 ARG 63 -7.371 9.916 -1.861 547 HH22 ARG 63 HH22 ARG 63 -7.227 11.571 -2.385 548 H LEU 64 H LEU 64 -5.766 4.298 1.087 549 HA LEU 64 HA LEU 64 -8.066 2.498 0.930 550 HB2 LEU 64 HB2 LEU 64 -5.643 1.922 0.789 551 HB3 LEU 64 HB3 LEU 64 -5.483 2.217 2.516 552 HG LEU 64 HG LEU 64 -7.479 0.210 1.431 553 HD11 LEU 64 HD11 LEU 64 -4.493 -0.190 1.861 554 HD12 LEU 64 HD12 LEU 64 -5.650 -1.520 1.680 555 HD13 LEU 64 HD13 LEU 64 -5.411 -0.381 0.348 556 HD21 LEU 64 HD21 LEU 64 -7.567 0.587 3.883 557 HD22 LEU 64 HD22 LEU 64 -6.985 -1.027 3.514 558 HD23 LEU 64 HD23 LEU 64 -5.832 0.236 3.990 559 H ASN 65 H ASN 65 -6.984 4.942 3.150 560 HA ASN 65 HA ASN 65 -7.871 5.899 4.946 561 HB2 ASN 65 HB2 ASN 65 -9.989 5.744 3.611 562 HB3 ASN 65 HB3 ASN 65 -10.429 4.326 4.562 563 HD21 ASN 65 HD21 ASN 65 -11.003 6.263 7.566 564 HD22 ASN 65 HD22 ASN 65 -10.367 4.703 7.030 565 H ILE 66 H ILE 66 -6.108 4.677 5.748 566 HA ILE 66 HA ILE 66 -6.783 3.169 8.220 567 HB ILE 66 HB ILE 66 -4.617 1.838 7.839 568 HG12 ILE 66 HG12 ILE 66 -5.078 2.588 4.927 569 HG13 ILE 66 HG13 ILE 66 -3.845 3.309 5.976 570 HG21 ILE 66 HG21 ILE 66 -6.983 1.236 6.044 571 HG22 ILE 66 HG22 ILE 66 -5.739 0.076 6.562 572 HG23 ILE 66 HG23 ILE 66 -6.819 0.805 7.754 573 HD11 ILE 66 HD11 ILE 66 -3.916 0.374 5.228 574 HD12 ILE 66 HD12 ILE 66 -2.937 1.641 4.466 575 HD13 ILE 66 HD13 ILE 66 -2.678 1.227 6.177 576 H THR 67 H THR 67 -4.476 3.077 9.474 577 HA THR 67 HA THR 67 -3.420 5.850 9.625 578 HB THR 67 HB THR 67 -3.954 4.738 11.734 579 HG1 THR 67 HG1 THR 67 -2.057 5.373 12.691 580 HG21 THR 67 HG21 THR 67 -1.575 2.910 11.180 581 HG22 THR 67 HG22 THR 67 -2.542 2.995 12.660 582 HG23 THR 67 HG23 THR 67 -3.277 2.382 11.175 583 H VAL 68 H VAL 68 -1.111 6.230 9.520 584 HA VAL 68 HA VAL 68 0.051 5.243 7.105 585 HB VAL 68 HB VAL 68 1.626 6.492 9.383 586 HG11 VAL 68 HG11 VAL 68 1.911 6.680 6.344 587 HG12 VAL 68 HG12 VAL 68 2.967 7.455 7.541 588 HG13 VAL 68 HG13 VAL 68 2.929 5.696 7.411 589 HG21 VAL 68 HG21 VAL 68 -0.311 7.973 9.064 590 HG22 VAL 68 HG22 VAL 68 1.132 8.716 8.384 591 HG23 VAL 68 HG23 VAL 68 -0.056 7.966 7.303 592 H ASP 69 H ASP 69 0.614 4.321 10.487 593 HA ASP 69 HA ASP 69 2.796 2.570 9.926 594 HB2 ASP 69 HB2 ASP 69 0.922 2.771 12.303 595 HB3 ASP 69 HB3 ASP 69 2.356 1.737 12.267 596 H LYS 70 H LYS 70 -0.655 1.950 9.720 597 HA LYS 70 HA LYS 70 -0.347 -0.961 9.502 598 HB2 LYS 70 HB2 LYS 70 -2.569 1.034 9.049 599 HB3 LYS 70 HB3 LYS 70 -2.615 -0.420 8.060 600 HG2 LYS 70 HG2 LYS 70 -2.532 -1.844 10.065 601 HG3 LYS 70 HG3 LYS 70 -2.543 -0.400 11.097 602 HD2 LYS 70 HD2 LYS 70 -4.727 0.268 10.228 603 HD3 LYS 70 HD3 LYS 70 -4.737 -1.051 9.054 604 HE2 LYS 70 HE2 LYS 70 -4.605 -1.508 12.061 605 HE3 LYS 70 HE3 LYS 70 -6.133 -1.341 11.196 606 HZ1 LYS 70 HZ1 LYS 70 -4.125 -3.420 10.521 607 HZ2 LYS 70 HZ2 LYS 70 -5.422 -3.673 11.474 608 HZ3 LYS 70 HZ3 LYS 70 -5.646 -3.312 9.911 609 H ALA 71 H ALA 71 -0.205 1.754 7.244 610 HA ALA 71 HA ALA 71 -0.032 0.028 4.874 611 HB1 ALA 71 HB1 ALA 71 0.743 2.957 5.303 612 HB2 ALA 71 HB2 ALA 71 0.668 2.120 3.743 613 HB3 ALA 71 HB3 ALA 71 -0.805 2.367 4.695 614 H LYS 72 H LYS 72 2.332 1.801 6.881 615 HA LYS 72 HA LYS 72 4.743 1.105 5.585 616 HB2 LYS 72 HB2 LYS 72 4.095 1.636 8.491 617 HB3 LYS 72 HB3 LYS 72 5.744 1.354 7.921 618 HG2 LYS 72 HG2 LYS 72 5.756 3.317 6.580 619 HG3 LYS 72 HG3 LYS 72 4.017 3.549 6.773 620 HD2 LYS 72 HD2 LYS 72 5.336 5.131 8.140 621 HD3 LYS 72 HD3 LYS 72 4.220 4.139 9.079 622 HE2 LYS 72 HE2 LYS 72 6.133 2.617 9.666 623 HE3 LYS 72 HE3 LYS 72 7.232 3.730 8.828 624 HZ1 LYS 72 HZ1 LYS 72 5.525 4.347 11.185 625 HZ2 LYS 72 HZ2 LYS 72 7.152 4.194 11.207 626 HZ3 LYS 72 HZ3 LYS 72 6.473 5.461 10.427 627 H THR 73 H THR 73 2.958 -0.860 8.028 628 HA THR 73 HA THR 73 5.039 -2.971 7.751 629 HB THR 73 HB THR 73 3.945 -2.437 9.946 630 HG1 THR 73 HG1 THR 73 4.046 -4.602 10.504 631 HG21 THR 73 HG21 THR 73 1.701 -4.238 8.932 632 HG22 THR 73 HG22 THR 73 1.894 -3.548 10.554 633 HG23 THR 73 HG23 THR 73 1.538 -2.481 9.191 634 H TYR 74 H TYR 74 1.619 -2.553 6.699 635 HA TYR 74 HA TYR 74 1.305 -5.136 5.615 636 HB2 TYR 74 HB2 TYR 74 -0.554 -3.651 6.007 637 HB3 TYR 74 HB3 TYR 74 0.086 -2.466 4.861 638 HD1 TYR 74 HD1 TYR 74 -1.146 -6.012 5.062 639 HD2 TYR 74 HD2 TYR 74 -0.524 -2.511 2.611 640 HE1 TYR 74 HE1 TYR 74 -2.220 -7.168 3.136 641 HE2 TYR 74 HE2 TYR 74 -1.652 -3.642 0.722 642 HH TYR 74 HH TYR 74 -2.730 -7.064 0.912 643 H ILE 75 H ILE 75 2.746 -2.245 4.097 644 HA ILE 75 HA ILE 75 3.114 -3.040 1.452 645 HB ILE 75 HB ILE 75 4.835 -1.467 3.390 646 HG12 ILE 75 HG12 ILE 75 3.519 -0.483 0.830 647 HG13 ILE 75 HG13 ILE 75 2.574 -0.648 2.293 648 HG21 ILE 75 HG21 ILE 75 5.460 -1.967 0.448 649 HG22 ILE 75 HG22 ILE 75 6.226 -0.710 1.438 650 HG23 ILE 75 HG23 ILE 75 6.484 -2.390 1.844 651 HD11 ILE 75 HD11 ILE 75 5.109 1.054 2.124 652 HD12 ILE 75 HD12 ILE 75 3.454 1.666 1.994 653 HD13 ILE 75 HD13 ILE 75 4.016 0.925 3.497 654 H LYS 76 H LYS 76 5.315 -3.904 4.195 655 HA LYS 76 HA LYS 76 6.718 -5.804 2.407 656 HB2 LYS 76 HB2 LYS 76 8.327 -6.076 4.132 657 HB3 LYS 76 HB3 LYS 76 7.997 -4.350 3.956 658 HG2 LYS 76 HG2 LYS 76 6.556 -4.449 5.998 659 HG3 LYS 76 HG3 LYS 76 6.963 -6.171 6.171 660 HD2 LYS 76 HD2 LYS 76 9.414 -5.483 6.281 661 HD3 LYS 76 HD3 LYS 76 8.878 -3.801 6.246 662 HE2 LYS 76 HE2 LYS 76 9.245 -4.249 8.522 663 HE3 LYS 76 HE3 LYS 76 7.490 -4.291 8.331 664 HZ1 LYS 76 HZ1 LYS 76 9.272 -6.677 8.441 665 HZ2 LYS 76 HZ2 LYS 76 8.312 -6.164 9.654 666 HZ3 LYS 76 HZ3 LYS 76 7.644 -6.739 8.283 667 H ASN 77 H ASN 77 4.394 -5.997 5.058 668 HA ASN 77 HA ASN 77 4.753 -8.786 5.503 669 HB2 ASN 77 HB2 ASN 77 3.583 -6.954 6.951 670 HB3 ASN 77 HB3 ASN 77 2.142 -7.296 5.988 671 HD21 ASN 77 HD21 ASN 77 3.581 -9.988 8.740 672 HD22 ASN 77 HD22 ASN 77 4.578 -8.649 8.180 673 H SER 78 H SER 78 2.772 -7.095 3.128 674 HA SER 78 HA SER 78 1.405 -9.513 2.200 675 HB2 SER 78 HB2 SER 78 0.406 -7.228 2.208 676 HB3 SER 78 HB3 SER 78 1.547 -6.753 0.938 677 HG SER 78 HG SER 78 -0.501 -7.458 0.119 678 H ASN 79 H ASN 79 4.083 -7.489 1.013 679 HA ASN 79 HA ASN 79 4.731 -9.523 -1.062 680 HB2 ASN 79 HB2 ASN 79 4.761 -7.754 -2.790 681 HB3 ASN 79 HB3 ASN 79 3.168 -8.062 -2.113 682 HD21 ASN 79 HD21 ASN 79 4.950 -4.465 -1.298 683 HD22 ASN 79 HD22 ASN 79 5.951 -5.841 -1.762 684 H ARG 80 H ARG 80 6.313 -9.347 1.138 685 HA ARG 80 HA ARG 80 8.536 -7.659 1.082 686 HB2 ARG 80 HB2 ARG 80 7.861 -9.500 2.792 687 HB3 ARG 80 HB3 ARG 80 8.708 -10.632 1.751 688 HG2 ARG 80 HG2 ARG 80 10.799 -9.334 2.041 689 HG3 ARG 80 HG3 ARG 80 9.921 -8.128 3.011 690 HD2 ARG 80 HD2 ARG 80 9.423 -9.799 4.720 691 HD3 ARG 80 HD3 ARG 80 10.178 -11.073 3.738 692 HE ARG 80 HE ARG 80 12.122 -9.058 4.089 693 HH11 ARG 80 HH11 ARG 80 13.779 -9.218 5.556 694 HH12 ARG 80 HH12 ARG 80 13.613 -10.245 6.950 695 HH21 ARG 80 HH21 ARG 80 10.454 -11.332 6.170 696 HH22 ARG 80 HH22 ARG 80 11.782 -11.413 7.297 697 H MET 81 H MET 81 8.096 -10.608 -0.790 698 HA MET 81 HA MET 81 10.793 -10.510 -1.968 699 HB2 MET 81 HB2 MET 81 8.443 -12.364 -2.525 700 HB3 MET 81 HB3 MET 81 10.100 -12.575 -3.112 701 HG2 MET 81 HG2 MET 81 10.914 -12.748 -0.781 702 HG3 MET 81 HG3 MET 81 9.263 -12.547 -0.186 703 HE1 MET 81 HE1 MET 81 9.190 -14.641 1.268 704 HE2 MET 81 HE2 MET 81 9.789 -16.234 0.760 705 HE3 MET 81 HE3 MET 81 10.917 -14.867 0.904 706 H GLY 82 H GLY 82 7.582 -9.504 -2.927 707 HA2 GLY 82 HA2 GLY 82 7.127 -7.835 -4.522 708 HA3 GLY 82 HA3 GLY 82 8.686 -8.116 -5.293 709 H ARG 83 H ARG 83 7.875 -11.132 -5.233 710 HA ARG 83 HA ARG 83 5.775 -11.159 -7.361 711 HB2 ARG 83 HB2 ARG 83 8.457 -11.986 -7.661 712 HB3 ARG 83 HB3 ARG 83 7.590 -13.485 -7.397 713 HG2 ARG 83 HG2 ARG 83 7.589 -13.150 -9.739 714 HG3 ARG 83 HG3 ARG 83 5.951 -12.731 -9.219 715 HD2 ARG 83 HD2 ARG 83 6.663 -10.298 -9.182 716 HD3 ARG 83 HD3 ARG 83 8.228 -10.775 -9.823 717 HE ARG 83 HE ARG 83 5.664 -10.597 -11.238 718 HH11 ARG 83 HH11 ARG 83 5.607 -10.798 -13.436 719 HH12 ARG 83 HH12 ARG 83 6.970 -11.454 -14.292 720 HH21 ARG 83 HH21 ARG 83 8.893 -11.947 -11.494 721 HH22 ARG 83 HH22 ARG 83 8.788 -12.081 -13.227 722 H THR 84 H THR 84 5.457 -11.279 -4.514 723 HA THR 84 HA THR 84 4.490 -12.430 -2.801 724 HB THR 84 HB THR 84 2.531 -13.423 -4.869 725 HG1 THR 84 HG1 THR 84 1.709 -11.331 -4.911 726 HG21 THR 84 HG21 THR 84 2.215 -12.059 -2.144 727 HG22 THR 84 HG22 THR 84 0.891 -12.639 -3.180 728 HG23 THR 84 HG23 THR 84 2.003 -13.796 -2.440 729 H ASN 85 H ASN 85 6.647 -13.879 -3.536 730 HA ASN 85 HA ASN 85 7.695 -15.877 -3.514 731 HB2 ASN 85 HB2 ASN 85 6.734 -15.763 -1.235 732 HB3 ASN 85 HB3 ASN 85 5.333 -16.683 -1.774 733 HD21 ASN 85 HD21 ASN 85 8.893 -18.666 -1.255 734 HD22 ASN 85 HD22 ASN 85 8.929 -16.936 -1.573 735 H ASN 86 H ASN 86 5.222 -15.657 -5.581 736 HA ASN 86 HA ASN 86 4.625 -18.461 -6.006 737 HB2 ASN 86 HB2 ASN 86 2.832 -17.734 -7.103 738 HB3 ASN 86 HB3 ASN 86 3.208 -16.180 -6.368 739 HD21 ASN 86 HD21 ASN 86 4.522 -14.868 -9.510 740 HD22 ASN 86 HD22 ASN 86 4.887 -14.865 -7.780 741 H PHE 87 H PHE 87 7.328 -16.844 -6.872 742 HA PHE 87 HA PHE 87 7.759 -17.581 -9.602 743 HB2 PHE 87 HB2 PHE 87 10.005 -16.700 -9.195 744 HB3 PHE 87 HB3 PHE 87 8.769 -15.644 -8.543 745 HD1 PHE 87 HD1 PHE 87 8.711 -15.065 -6.205 746 HD2 PHE 87 HD2 PHE 87 11.389 -18.148 -7.599 747 HE1 PHE 87 HE1 PHE 87 9.865 -15.067 -4.012 748 HE2 PHE 87 HE2 PHE 87 12.497 -18.182 -5.388 749 HZ PHE 87 HZ PHE 87 11.742 -16.639 -3.586 750 H LYS 88 H LYS 88 7.236 -19.860 -7.559 751 HA LYS 88 HA LYS 88 9.747 -21.426 -7.580 752 HB2 LYS 88 HB2 LYS 88 8.620 -22.861 -6.015 753 HB3 LYS 88 HB3 LYS 88 8.372 -21.180 -5.545 754 HG2 LYS 88 HG2 LYS 88 6.071 -21.372 -6.784 755 HG3 LYS 88 HG3 LYS 88 6.404 -23.106 -6.839 756 HD2 LYS 88 HD2 LYS 88 4.992 -22.732 -4.965 757 HD3 LYS 88 HD3 LYS 88 6.607 -23.088 -4.326 758 HE2 LYS 88 HE2 LYS 88 7.001 -20.606 -4.097 759 HE3 LYS 88 HE3 LYS 88 5.372 -20.299 -4.677 760 HZ1 LYS 88 HZ1 LYS 88 5.995 -21.889 -2.239 761 HZ2 LYS 88 HZ2 LYS 88 5.614 -20.307 -2.220 762 HZ3 LYS 88 HZ3 LYS 88 4.503 -21.415 -2.720 763 H THR 89 H THR 89 6.994 -21.165 -9.485 764 HA THR 89 HA THR 89 7.268 -23.884 -10.707 765 HB THR 89 HB THR 89 4.803 -22.126 -10.393 766 HG1 THR 89 HG1 THR 89 4.189 -23.727 -8.918 767 HG21 THR 89 HG21 THR 89 5.163 -24.973 -11.383 768 HG22 THR 89 HG22 THR 89 3.597 -24.179 -11.058 769 HG23 THR 89 HG23 THR 89 4.643 -23.568 -12.352 770 H ILE 90 H ILE 90 6.471 -20.462 -11.336 771 HA ILE 90 HA ILE 90 6.892 -20.652 -14.230 772 HB ILE 90 HB ILE 90 6.965 -18.064 -12.665 773 HG12 ILE 90 HG12 ILE 90 4.407 -19.573 -13.372 774 HG13 ILE 90 HG13 ILE 90 5.004 -19.259 -11.741 775 HG21 ILE 90 HG21 ILE 90 5.836 -18.851 -15.405 776 HG22 ILE 90 HG22 ILE 90 5.863 -17.204 -14.741 777 HG23 ILE 90 HG23 ILE 90 7.364 -17.984 -15.132 778 HD11 ILE 90 HD11 ILE 90 3.941 -17.180 -13.660 779 HD12 ILE 90 HD12 ILE 90 3.267 -17.720 -12.121 780 HD13 ILE 90 HD13 ILE 90 4.787 -16.806 -12.134 781 H LYS 91 H LYS 91 8.656 -19.295 -15.216 782 HA LYS 91 HA LYS 91 10.792 -18.774 -15.647 783 HB2 LYS 91 HB2 LYS 91 11.245 -18.577 -12.653 784 HB3 LYS 91 HB3 LYS 91 12.245 -17.866 -13.886 785 HG2 LYS 91 HG2 LYS 91 9.361 -16.983 -13.873 786 HG3 LYS 91 HG3 LYS 91 10.336 -16.553 -12.481 787 HD2 LYS 91 HD2 LYS 91 10.379 -14.748 -14.064 788 HD3 LYS 91 HD3 LYS 91 11.996 -15.447 -13.917 789 HE2 LYS 91 HE2 LYS 91 11.628 -16.721 -16.027 790 HE3 LYS 91 HE3 LYS 91 10.002 -16.028 -16.158 791 HZ1 LYS 91 HZ1 LYS 91 12.536 -14.465 -16.198 792 HZ2 LYS 91 HZ2 LYS 91 11.615 -14.795 -17.503 793 HZ3 LYS 91 HZ3 LYS 91 11.038 -13.823 -16.328 794 H MET 92 H MET 92 10.248 -21.653 -13.943 795 HA MET 92 HA MET 92 12.959 -22.653 -14.766 796 HB2 MET 92 HB2 MET 92 12.951 -24.133 -12.916 797 HB3 MET 92 HB3 MET 92 12.526 -22.535 -12.325 798 HG2 MET 92 HG2 MET 92 11.046 -23.856 -11.171 799 HG3 MET 92 HG3 MET 92 10.044 -23.361 -12.529 800 HE1 MET 92 HE1 MET 92 8.277 -25.350 -12.072 801 HE2 MET 92 HE2 MET 92 8.787 -27.008 -11.699 802 HE3 MET 92 HE3 MET 92 9.243 -25.677 -10.611 803 H PHE 93 H PHE 93 9.719 -22.901 -15.576 804 HA PHE 93 HA PHE 93 9.808 -25.798 -16.226 805 HB2 PHE 93 HB2 PHE 93 8.317 -24.890 -14.472 806 HB3 PHE 93 HB3 PHE 93 7.510 -23.893 -15.675 807 HD1 PHE 93 HD1 PHE 93 8.372 -27.449 -14.852 808 HD2 PHE 93 HD2 PHE 93 5.595 -24.753 -16.743 809 HE1 PHE 93 HE1 PHE 93 6.810 -29.352 -15.262 810 HE2 PHE 93 HE2 PHE 93 4.026 -26.651 -17.148 811 HZ PHE 93 HZ PHE 93 4.638 -28.949 -16.410 812 H GLU 94 H GLU 94 9.678 -22.779 -17.881 813 HA GLU 94 HA GLU 94 8.296 -23.871 -20.256 814 HB2 GLU 94 HB2 GLU 94 8.338 -21.600 -21.103 815 HB3 GLU 94 HB3 GLU 94 7.656 -21.659 -19.482 816 HG2 GLU 94 HG2 GLU 94 9.705 -20.777 -18.505 817 HG3 GLU 94 HG3 GLU 94 10.547 -20.884 -20.054 818 H ASP 95 H ASP 95 11.216 -24.438 -19.249 819 HA ASP 95 HA ASP 95 12.807 -23.669 -21.614 820 HB2 ASP 95 HB2 ASP 95 13.592 -24.923 -18.960 821 HB3 ASP 95 HB3 ASP 95 14.712 -24.431 -20.227 822 H ASP 96 H ASP 96 14.179 -25.125 -22.743 823 HA ASP 96 HA ASP 96 13.106 -27.816 -23.234 824 HB2 ASP 96 HB2 ASP 96 15.551 -26.374 -24.330 825 HB3 ASP 96 HB3 ASP 96 14.984 -27.956 -24.855 826 H VAL 97 H VAL 97 14.084 -29.761 -22.781 827 HA VAL 97 HA VAL 97 16.481 -29.786 -20.982 828 HB VAL 97 HB VAL 97 13.949 -31.420 -20.557 829 HG11 VAL 97 HG11 VAL 97 16.516 -31.247 -18.914 830 HG12 VAL 97 HG12 VAL 97 15.034 -32.100 -18.426 831 HG13 VAL 97 HG13 VAL 97 15.943 -32.664 -19.826 832 HG21 VAL 97 HG21 VAL 97 13.563 -29.100 -19.854 833 HG22 VAL 97 HG22 VAL 97 13.729 -30.135 -18.438 834 HG23 VAL 97 HG23 VAL 97 15.086 -29.099 -18.938 835 H SER 98 H SER 98 14.378 -31.840 -23.016 836 HA SER 98 HA SER 98 16.747 -33.551 -23.669 837 HB2 SER 98 HB2 SER 98 13.799 -34.269 -23.729 838 HB3 SER 98 HB3 SER 98 15.162 -35.355 -24.062 839 HG SER 98 HG SER 98 14.404 -35.554 -21.902 840 H SER 99 H SER 99 15.141 -31.079 -25.039 841 HA SER 99 HA SER 99 14.602 -32.227 -27.657 842 HB2 SER 99 HB2 SER 99 14.217 -29.384 -26.692 843 HB3 SER 99 HB3 SER 99 13.504 -30.127 -28.136 844 HG SER 99 HG SER 99 12.056 -30.088 -26.339 845 H ALA 100 H ALA 100 17.386 -30.963 -26.362 846 HA ALA 100 HA ALA 100 18.253 -29.312 -28.616 847 HB1 ALA 100 HB1 ALA 100 19.672 -30.220 -26.081 848 HB2 ALA 100 HB2 ALA 100 20.275 -29.011 -27.234 849 HB3 ALA 100 HB3 ALA 100 18.794 -28.691 -26.309 850 H SER 101 H SER 101 19.746 -29.780 -30.158 851 HA SER 101 HA SER 101 21.162 -32.378 -30.266 852 HB2 SER 101 HB2 SER 101 19.221 -31.431 -32.419 853 HB3 SER 101 HB3 SER 101 20.379 -32.759 -32.601 854 HG SER 101 HG SER 101 18.288 -33.507 -32.029 855 H ALA 102 H ALA 102 22.987 -32.331 -31.558 856 HA ALA 102 HA ALA 102 24.855 -31.479 -32.449 857 HB1 ALA 102 HB1 ALA 102 22.937 -29.876 -34.162 858 HB2 ALA 102 HB2 ALA 102 24.602 -30.339 -34.572 859 HB3 ALA 102 HB3 ALA 102 23.356 -31.589 -34.403 860 H GLN 103 H GLN 103 23.732 -29.886 -30.136 861 HA GLN 103 HA GLN 103 24.626 -27.166 -30.512 862 HB2 GLN 103 HB2 GLN 103 23.909 -28.764 -28.029 863 HB3 GLN 103 HB3 GLN 103 24.361 -27.068 -27.979 864 HG2 GLN 103 HG2 GLN 103 21.975 -28.174 -29.519 865 HG3 GLN 103 HG3 GLN 103 21.911 -27.435 -27.927 866 HE21 GLN 103 HE21 GLN 103 20.935 -24.773 -30.295 867 HE22 GLN 103 HE22 GLN 103 20.275 -26.320 -29.785 868 HA PRO 104 HA PRO 104 28.946 -27.818 -29.540 869 HB2 PRO 104 HB2 PRO 104 29.838 -25.306 -29.088 870 HB3 PRO 104 HB3 PRO 104 29.147 -25.790 -30.662 871 HG2 PRO 104 HG2 PRO 104 27.714 -24.380 -28.381 872 HG3 PRO 104 HG3 PRO 104 27.773 -23.906 -30.109 873 HD2 PRO 104 HD2 PRO 104 25.720 -25.372 -29.039 874 HD3 PRO 104 HD3 PRO 104 26.275 -25.597 -30.724 875 H ASN 105 H ASN 105 27.905 -29.042 -27.625 876 HA ASN 105 HA ASN 105 27.663 -29.602 -25.454 877 HB2 ASN 105 HB2 ASN 105 30.210 -29.495 -25.823 878 HB3 ASN 105 HB3 ASN 105 30.182 -28.032 -24.843 879 HD21 ASN 105 HD21 ASN 105 29.377 -29.883 -21.814 880 HD22 ASN 105 HD22 ASN 105 28.995 -28.361 -22.633 881 H LEU 106 H LEU 106 25.984 -27.638 -26.132 882 HA LEU 106 HA LEU 106 25.876 -25.732 -23.836 883 HB2 LEU 106 HB2 LEU 106 26.551 -24.758 -26.043 884 HB3 LEU 106 HB3 LEU 106 25.003 -25.267 -26.700 885 HG LEU 106 HG LEU 106 23.886 -23.837 -24.878 886 HD11 LEU 106 HD11 LEU 106 26.732 -22.757 -24.628 887 HD12 LEU 106 HD12 LEU 106 25.274 -22.009 -23.939 888 HD13 LEU 106 HD13 LEU 106 25.817 -23.582 -23.348 889 HD21 LEU 106 HD21 LEU 106 24.057 -23.118 -27.221 890 HD22 LEU 106 HD22 LEU 106 24.262 -21.743 -26.126 891 HD23 LEU 106 HD23 LEU 106 25.683 -22.463 -26.920 892 HA PRO 107 HA PRO 107 22.024 -28.278 -23.621 893 HB2 PRO 107 HB2 PRO 107 21.730 -28.328 -20.908 894 HB3 PRO 107 HB3 PRO 107 22.869 -29.392 -21.791 895 HG2 PRO 107 HG2 PRO 107 23.476 -26.769 -20.389 896 HG3 PRO 107 HG3 PRO 107 24.360 -28.323 -20.263 897 HD2 PRO 107 HD2 PRO 107 25.170 -26.316 -21.917 898 HD3 PRO 107 HD3 PRO 107 25.359 -28.034 -22.377 Start of MODEL 8 1 H1 GLY -5 H1 GLY -5 26.483 20.818 31.416 2 H2 GLY -5 H2 GLY -5 26.152 21.408 29.924 3 H3 GLY -5 H3 GLY -5 27.702 21.102 30.357 4 HA2 GLY -5 HA2 GLY -5 25.592 19.066 30.025 5 HA3 GLY -5 HA3 GLY -5 26.895 19.390 28.868 6 H SER -4 H SER -4 25.970 17.347 31.297 7 HA SER -4 HA SER -4 28.764 16.479 31.921 8 HB2 SER -4 HB2 SER -4 26.503 16.773 33.938 9 HB3 SER -4 HB3 SER -4 28.107 16.084 34.255 10 HG SER -4 HG SER -4 27.931 18.305 34.880 11 H HIS -3 H HIS -3 29.065 14.321 31.743 12 HA HIS -3 HA HIS -3 26.848 12.390 32.019 13 HB2 HIS -3 HB2 HIS -3 26.868 13.350 29.638 14 HB3 HIS -3 HB3 HIS -3 28.417 12.565 29.411 15 HD2 HIS -3 HD2 HIS -3 26.642 9.989 31.303 16 HE1 HIS -3 HE1 HIS -3 25.077 9.460 27.378 17 HE2 HIS -3 HE2 HIS -3 25.300 8.418 29.689 18 H MET -2 H MET -2 27.705 10.843 33.298 19 HA MET -2 HA MET -2 30.497 9.865 32.882 20 HB2 MET -2 HB2 MET -2 29.191 10.764 35.474 21 HB3 MET -2 HB3 MET -2 30.657 9.791 35.436 22 HG2 MET -2 HG2 MET -2 30.648 12.404 33.933 23 HG3 MET -2 HG3 MET -2 30.705 12.408 35.681 24 HE1 MET -2 HE1 MET -2 32.577 11.448 32.392 25 HE2 MET -2 HE2 MET -2 34.117 10.793 32.984 26 HE3 MET -2 HE3 MET -2 32.640 9.828 33.140 27 H ALA -1 H ALA -1 29.017 8.274 31.684 28 HA ALA -1 HA ALA -1 28.114 6.109 33.547 29 HB1 ALA -1 HB1 ALA -1 27.200 6.743 30.709 30 HB2 ALA -1 HB2 ALA -1 26.546 5.469 31.760 31 HB3 ALA -1 HB3 ALA -1 26.321 7.174 32.196 32 H SER 0 H SER 0 30.505 6.776 31.282 33 HA SER 0 HA SER 0 30.921 4.502 29.791 34 HB2 SER 0 HB2 SER 0 32.898 6.373 31.124 35 HB3 SER 0 HB3 SER 0 33.292 5.315 29.738 36 HG SER 0 HG SER 0 32.744 7.458 29.076 37 H MET 1 H MET 1 31.721 4.893 33.174 38 HA MET 1 HA MET 1 33.620 2.658 33.236 39 HB2 MET 1 HB2 MET 1 32.552 4.421 35.467 40 HB3 MET 1 HB3 MET 1 33.938 3.321 35.585 41 HG2 MET 1 HG2 MET 1 35.091 4.610 33.806 42 HG3 MET 1 HG3 MET 1 33.751 5.752 33.763 43 HE1 MET 1 HE1 MET 1 32.980 6.254 36.830 44 HE2 MET 1 HE2 MET 1 34.016 7.656 37.148 45 HE3 MET 1 HE3 MET 1 33.180 7.512 35.586 46 H ASP 2 H ASP 2 30.328 2.920 33.590 47 HA ASP 2 HA ASP 2 30.041 0.345 35.112 48 HB2 ASP 2 HB2 ASP 2 29.060 2.394 36.139 49 HB3 ASP 2 HB3 ASP 2 28.070 2.626 34.699 50 H GLN 3 H GLN 3 29.286 2.075 32.158 51 HA GLN 3 HA GLN 3 27.486 0.188 30.928 52 HB2 GLN 3 HB2 GLN 3 27.674 2.563 30.350 53 HB3 GLN 3 HB3 GLN 3 29.369 2.342 29.916 54 HG2 GLN 3 HG2 GLN 3 28.589 0.819 28.019 55 HG3 GLN 3 HG3 GLN 3 26.931 1.288 28.426 56 HE21 GLN 3 HE21 GLN 3 29.545 4.131 26.893 57 HE22 GLN 3 HE22 GLN 3 30.178 2.783 27.832 58 H LEU 4 H LEU 4 31.014 0.348 31.133 59 HA LEU 4 HA LEU 4 31.330 -1.696 28.998 60 HB2 LEU 4 HB2 LEU 4 33.346 0.209 30.222 61 HB3 LEU 4 HB3 LEU 4 33.663 -0.918 28.908 62 HG LEU 4 HG LEU 4 31.751 1.457 28.790 63 HD11 LEU 4 HD11 LEU 4 34.405 0.936 27.394 64 HD12 LEU 4 HD12 LEU 4 33.371 2.371 27.202 65 HD13 LEU 4 HD13 LEU 4 34.148 2.047 28.760 66 HD21 LEU 4 HD21 LEU 4 30.859 -0.289 27.351 67 HD22 LEU 4 HD22 LEU 4 31.610 0.960 26.359 68 HD23 LEU 4 HD23 LEU 4 32.467 -0.571 26.640 69 H ASP 5 H ASP 5 33.269 -3.152 29.285 70 HA ASP 5 HA ASP 5 34.061 -5.052 30.158 71 HB2 ASP 5 HB2 ASP 5 34.308 -3.399 32.680 72 HB3 ASP 5 HB3 ASP 5 35.118 -4.934 32.386 73 H GLU 6 H GLU 6 31.088 -4.641 30.422 74 HA GLU 6 HA GLU 6 30.363 -6.451 32.633 75 HB2 GLU 6 HB2 GLU 6 28.065 -5.823 32.119 76 HB3 GLU 6 HB3 GLU 6 29.092 -4.415 32.376 77 HG2 GLU 6 HG2 GLU 6 29.175 -3.912 30.026 78 HG3 GLU 6 HG3 GLU 6 28.494 -5.471 29.586 79 H ILE 7 H ILE 7 31.811 -7.518 30.263 80 HA ILE 7 HA ILE 7 30.109 -8.660 28.357 81 HB ILE 7 HB ILE 7 32.845 -9.677 29.192 82 HG12 ILE 7 HG12 ILE 7 33.123 -7.328 28.831 83 HG13 ILE 7 HG13 ILE 7 33.806 -8.199 27.477 84 HG21 ILE 7 HG21 ILE 7 31.336 -9.928 26.561 85 HG22 ILE 7 HG22 ILE 7 33.058 -10.314 26.772 86 HG23 ILE 7 HG23 ILE 7 31.840 -11.237 27.647 87 HD11 ILE 7 HD11 ILE 7 31.120 -6.759 27.490 88 HD12 ILE 7 HD12 ILE 7 32.614 -6.219 26.705 89 HD13 ILE 7 HD13 ILE 7 31.787 -7.671 26.113 90 H ILE 8 H ILE 8 31.030 -10.044 31.466 91 HA ILE 8 HA ILE 8 29.281 -12.412 30.936 92 HB ILE 8 HB ILE 8 31.835 -12.548 32.568 93 HG12 ILE 8 HG12 ILE 8 31.390 -13.430 29.679 94 HG13 ILE 8 HG13 ILE 8 32.454 -12.129 30.216 95 HG21 ILE 8 HG21 ILE 8 30.053 -14.748 31.400 96 HG22 ILE 8 HG22 ILE 8 31.435 -14.965 32.496 97 HG23 ILE 8 HG23 ILE 8 29.972 -14.201 33.083 98 HD11 ILE 8 HD11 ILE 8 32.861 -15.088 30.731 99 HD12 ILE 8 HD12 ILE 8 33.825 -14.004 29.721 100 HD13 ILE 8 HD13 ILE 8 33.827 -13.790 31.482 101 H GLU 9 H GLU 9 27.846 -10.617 31.803 102 HA GLU 9 HA GLU 9 27.646 -10.834 34.802 103 HB2 GLU 9 HB2 GLU 9 27.042 -8.485 32.974 104 HB3 GLU 9 HB3 GLU 9 26.596 -8.541 34.668 105 HG2 GLU 9 HG2 GLU 9 29.443 -8.658 33.586 106 HG3 GLU 9 HG3 GLU 9 28.654 -7.247 34.276 107 H GLN 10 H GLN 10 25.803 -11.079 31.798 108 HA GLN 10 HA GLN 10 23.462 -12.064 33.309 109 HB2 GLN 10 HB2 GLN 10 23.011 -9.708 33.370 110 HB3 GLN 10 HB3 GLN 10 23.411 -9.504 31.660 111 HG2 GLN 10 HG2 GLN 10 21.480 -10.837 30.991 112 HG3 GLN 10 HG3 GLN 10 21.090 -11.198 32.676 113 HE21 GLN 10 HE21 GLN 10 19.670 -7.919 33.284 114 HE22 GLN 10 HE22 GLN 10 20.420 -9.293 34.085 115 H ILE 11 H ILE 11 24.301 -10.935 30.056 116 HA ILE 11 HA ILE 11 24.050 -11.569 28.002 117 HB ILE 11 HB ILE 11 24.920 -13.462 27.288 118 HG12 ILE 11 HG12 ILE 11 24.768 -15.711 28.662 119 HG13 ILE 11 HG13 ILE 11 23.314 -15.000 29.326 120 HG21 ILE 11 HG21 ILE 11 25.524 -13.805 30.225 121 HG22 ILE 11 HG22 ILE 11 26.569 -14.273 28.860 122 HG23 ILE 11 HG23 ILE 11 26.268 -12.550 29.198 123 HD11 ILE 11 HD11 ILE 11 23.908 -15.526 26.366 124 HD12 ILE 11 HD12 ILE 11 22.871 -16.515 27.407 125 HD13 ILE 11 HD13 ILE 11 22.374 -14.876 26.980 126 H GLN 12 H GLN 12 22.442 -11.389 26.614 127 HA GLN 12 HA GLN 12 19.874 -12.811 27.101 128 HB2 GLN 12 HB2 GLN 12 20.215 -9.826 26.656 129 HB3 GLN 12 HB3 GLN 12 18.669 -10.668 26.531 130 HG2 GLN 12 HG2 GLN 12 20.355 -10.583 29.058 131 HG3 GLN 12 HG3 GLN 12 18.999 -9.525 28.706 132 HE21 GLN 12 HE21 GLN 12 18.204 -13.465 29.661 133 HE22 GLN 12 HE22 GLN 12 19.862 -12.964 29.369 134 H LYS 13 H LYS 13 21.946 -13.502 25.324 135 HA LYS 13 HA LYS 13 20.915 -13.249 22.593 136 HB2 LYS 13 HB2 LYS 13 22.644 -15.346 23.998 137 HB3 LYS 13 HB3 LYS 13 22.112 -15.486 22.331 138 HG2 LYS 13 HG2 LYS 13 24.269 -14.670 22.178 139 HG3 LYS 13 HG3 LYS 13 23.232 -13.296 21.804 140 HD2 LYS 13 HD2 LYS 13 23.665 -12.325 24.024 141 HD3 LYS 13 HD3 LYS 13 24.564 -13.787 24.510 142 HE2 LYS 13 HE2 LYS 13 26.184 -13.366 22.656 143 HE3 LYS 13 HE3 LYS 13 25.303 -11.894 22.231 144 HZ1 LYS 13 HZ1 LYS 13 26.671 -12.378 24.828 145 HZ2 LYS 13 HZ2 LYS 13 27.214 -11.406 23.640 146 HZ3 LYS 13 HZ3 LYS 13 25.851 -11.011 24.441 147 H GLU 14 H GLU 14 19.868 -14.872 25.461 148 HA GLU 14 HA GLU 14 17.440 -15.767 24.120 149 HB2 GLU 14 HB2 GLU 14 17.522 -18.031 25.109 150 HB3 GLU 14 HB3 GLU 14 18.727 -17.774 23.846 151 HG2 GLU 14 HG2 GLU 14 20.480 -17.462 25.607 152 HG3 GLU 14 HG3 GLU 14 19.264 -17.779 26.848 153 H ALA 15 H ALA 15 15.708 -15.799 25.318 154 HA ALA 15 HA ALA 15 15.621 -15.833 28.203 155 HB1 ALA 15 HB1 ALA 15 15.085 -13.178 26.793 156 HB2 ALA 15 HB2 ALA 15 14.642 -13.548 28.480 157 HB3 ALA 15 HB3 ALA 15 16.341 -13.523 27.991 158 H ILE 16 H ILE 16 13.430 -13.989 26.213 159 HA ILE 16 HA ILE 16 11.263 -16.023 26.446 160 HB ILE 16 HB ILE 16 11.241 -13.104 27.262 161 HG12 ILE 16 HG12 ILE 16 10.860 -15.627 28.943 162 HG13 ILE 16 HG13 ILE 16 12.312 -14.632 28.907 163 HG21 ILE 16 HG21 ILE 16 8.907 -15.063 27.214 164 HG22 ILE 16 HG22 ILE 16 8.873 -13.522 28.100 165 HG23 ILE 16 HG23 ILE 16 9.029 -13.497 26.375 166 HD11 ILE 16 HD11 ILE 16 9.657 -13.855 30.110 167 HD12 ILE 16 HD12 ILE 16 11.224 -14.065 30.890 168 HD13 ILE 16 HD13 ILE 16 10.976 -12.696 29.789 169 H ASN 17 H ASN 17 13.033 -14.844 24.265 170 HA ASN 17 HA ASN 17 11.029 -13.619 22.496 171 HB2 ASN 17 HB2 ASN 17 14.032 -13.988 22.138 172 HB3 ASN 17 HB3 ASN 17 12.986 -13.076 21.054 173 HD21 ASN 17 HD21 ASN 17 14.528 -11.098 24.105 174 HD22 ASN 17 HD22 ASN 17 15.188 -12.583 23.439 175 H SER 18 H SER 18 11.789 -16.728 23.085 176 HA SER 18 HA SER 18 11.287 -17.642 20.253 177 HB2 SER 18 HB2 SER 18 13.531 -18.199 21.084 178 HB3 SER 18 HB3 SER 18 12.813 -19.088 22.441 179 HG SER 18 HG SER 18 13.362 -20.441 20.638 180 H ASN 19 H ASN 19 10.697 -18.608 23.671 181 HA ASN 19 HA ASN 19 8.695 -20.533 23.113 182 HB2 ASN 19 HB2 ASN 19 8.209 -20.366 25.532 183 HB3 ASN 19 HB3 ASN 19 9.930 -20.511 25.207 184 HD21 ASN 19 HD21 ASN 19 9.582 -17.890 27.785 185 HD22 ASN 19 HD22 ASN 19 9.196 -19.608 27.696 186 H VAL 20 H VAL 20 8.413 -17.106 23.432 187 HA VAL 20 HA VAL 20 5.458 -17.088 23.361 188 HB VAL 20 HB VAL 20 7.512 -14.854 23.249 189 HG11 VAL 20 HG11 VAL 20 4.477 -14.652 23.456 190 HG12 VAL 20 HG12 VAL 20 5.614 -13.319 23.759 191 HG13 VAL 20 HG13 VAL 20 5.499 -14.014 22.145 192 HG21 VAL 20 HG21 VAL 20 7.375 -16.012 25.436 193 HG22 VAL 20 HG22 VAL 20 6.705 -14.385 25.548 194 HG23 VAL 20 HG23 VAL 20 5.614 -15.786 25.457 195 H VAL 21 H VAL 21 8.050 -16.990 21.020 196 HA VAL 21 HA VAL 21 6.182 -16.175 18.837 197 HB VAL 21 HB VAL 21 9.196 -15.876 18.757 198 HG11 VAL 21 HG11 VAL 21 6.924 -14.610 17.139 199 HG12 VAL 21 HG12 VAL 21 8.657 -14.280 16.937 200 HG13 VAL 21 HG13 VAL 21 8.020 -15.877 16.549 201 HG21 VAL 21 HG21 VAL 21 8.410 -14.419 20.566 202 HG22 VAL 21 HG22 VAL 21 8.781 -13.444 19.148 203 HG23 VAL 21 HG23 VAL 21 7.086 -13.812 19.542 204 H LEU 22 H LEU 22 5.613 -18.495 19.286 205 HA LEU 22 HA LEU 22 6.928 -20.260 17.300 206 HB2 LEU 22 HB2 LEU 22 6.769 -20.642 20.248 207 HB3 LEU 22 HB3 LEU 22 6.171 -22.019 19.354 208 HG LEU 22 HG LEU 22 8.910 -20.770 18.864 209 HD11 LEU 22 HD11 LEU 22 8.139 -23.261 20.451 210 HD12 LEU 22 HD12 LEU 22 9.793 -22.709 20.098 211 HD13 LEU 22 HD13 LEU 22 8.742 -21.735 21.132 212 HD21 LEU 22 HD21 LEU 22 8.078 -22.062 16.917 213 HD22 LEU 22 HD22 LEU 22 9.382 -22.925 17.730 214 HD23 LEU 22 HD23 LEU 22 7.702 -23.438 17.984 215 H LYS 23 H LYS 23 5.459 -22.384 17.193 216 HA LYS 23 HA LYS 23 3.620 -23.244 16.209 217 HB2 LYS 23 HB2 LYS 23 2.929 -22.842 18.671 218 HB3 LYS 23 HB3 LYS 23 1.933 -21.535 18.040 219 HG2 LYS 23 HG2 LYS 23 0.978 -23.387 16.409 220 HG3 LYS 23 HG3 LYS 23 1.799 -24.519 17.480 221 HD2 LYS 23 HD2 LYS 23 -0.485 -24.385 18.197 222 HD3 LYS 23 HD3 LYS 23 0.478 -23.527 19.414 223 HE2 LYS 23 HE2 LYS 23 -0.112 -21.355 18.310 224 HE3 LYS 23 HE3 LYS 23 -1.052 -22.232 17.102 225 HZ1 LYS 23 HZ1 LYS 23 -1.634 -22.189 20.017 226 HZ2 LYS 23 HZ2 LYS 23 -2.468 -21.378 18.875 227 HZ3 LYS 23 HZ3 LYS 23 -2.507 -23.009 18.903 228 H ASN 24 H ASN 24 4.684 -21.454 14.632 229 HA ASN 24 HA ASN 24 4.449 -20.028 12.878 230 HB2 ASN 24 HB2 ASN 24 3.375 -22.213 12.241 231 HB3 ASN 24 HB3 ASN 24 1.803 -21.469 12.521 232 HD21 ASN 24 HD21 ASN 24 2.010 -19.430 9.555 233 HD22 ASN 24 HD22 ASN 24 1.377 -19.438 11.209 234 HA PRO 25 HA PRO 25 1.656 -17.107 15.177 235 HB2 PRO 25 HB2 PRO 25 3.415 -15.302 16.168 236 HB3 PRO 25 HB3 PRO 25 3.251 -16.944 16.853 237 HG2 PRO 25 HG2 PRO 25 5.317 -15.984 14.842 238 HG3 PRO 25 HG3 PRO 25 5.587 -16.889 16.363 239 HD2 PRO 25 HD2 PRO 25 5.402 -18.113 13.912 240 HD3 PRO 25 HD3 PRO 25 4.852 -18.889 15.422 241 H ARG 26 H ARG 26 0.940 -16.862 12.929 242 HA ARG 26 HA ARG 26 1.656 -14.179 11.772 243 HB2 ARG 26 HB2 ARG 26 1.172 -16.804 10.302 244 HB3 ARG 26 HB3 ARG 26 1.236 -15.237 9.497 245 HG2 ARG 26 HG2 ARG 26 3.527 -16.386 11.147 246 HG3 ARG 26 HG3 ARG 26 3.380 -16.572 9.406 247 HD2 ARG 26 HD2 ARG 26 3.866 -14.350 8.948 248 HD3 ARG 26 HD3 ARG 26 3.212 -13.765 10.462 249 HE ARG 26 HE ARG 26 5.191 -14.135 11.575 250 HH11 ARG 26 HH11 ARG 26 7.388 -14.297 11.698 251 HH12 ARG 26 HH12 ARG 26 8.294 -14.970 10.376 252 HH21 ARG 26 HH21 ARG 26 5.563 -15.511 8.369 253 HH22 ARG 26 HH22 ARG 26 7.293 -15.640 8.534 254 H VAL 27 H VAL 27 -0.922 -16.612 11.758 255 HA VAL 27 HA VAL 27 -3.115 -16.465 11.097 256 HB VAL 27 HB VAL 27 -3.042 -14.513 13.393 257 HG11 VAL 27 HG11 VAL 27 -5.233 -16.422 12.403 258 HG12 VAL 27 HG12 VAL 27 -5.322 -15.419 13.868 259 HG13 VAL 27 HG13 VAL 27 -5.304 -14.658 12.278 260 HG21 VAL 27 HG21 VAL 27 -1.856 -16.552 14.021 261 HG22 VAL 27 HG22 VAL 27 -3.436 -16.526 14.799 262 HG23 VAL 27 HG23 VAL 27 -3.178 -17.555 13.373 263 HA PRO 28 HA PRO 28 -2.966 -12.662 8.469 264 HB2 PRO 28 HB2 PRO 28 -3.905 -13.799 6.156 265 HB3 PRO 28 HB3 PRO 28 -2.179 -13.734 6.631 266 HG2 PRO 28 HG2 PRO 28 -4.127 -16.037 7.006 267 HG3 PRO 28 HG3 PRO 28 -2.444 -16.105 6.402 268 HD2 PRO 28 HD2 PRO 28 -3.080 -16.696 8.970 269 HD3 PRO 28 HD3 PRO 28 -1.567 -15.820 8.585 270 H THR 29 H THR 29 -4.608 -11.539 7.360 271 HA THR 29 HA THR 29 -7.227 -11.867 8.696 272 HB THR 29 HB THR 29 -7.083 -9.307 8.555 273 HG1 THR 29 HG1 THR 29 -5.010 -8.467 8.321 274 HG21 THR 29 HG21 THR 29 -4.947 -10.714 10.208 275 HG22 THR 29 HG22 THR 29 -5.635 -9.106 10.525 276 HG23 THR 29 HG23 THR 29 -6.658 -10.546 10.660 277 H GLN 30 H GLN 30 -7.420 -13.184 6.614 278 HA GLN 30 HA GLN 30 -8.317 -11.643 4.339 279 HB2 GLN 30 HB2 GLN 30 -8.852 -13.799 3.294 280 HB3 GLN 30 HB3 GLN 30 -7.227 -13.778 3.947 281 HG2 GLN 30 HG2 GLN 30 -9.572 -14.925 5.521 282 HG3 GLN 30 HG3 GLN 30 -8.688 -15.895 4.340 283 HE21 GLN 30 HE21 GLN 30 -7.147 -15.473 8.026 284 HE22 GLN 30 HE22 GLN 30 -8.851 -15.309 7.615 285 H LYS 31 H LYS 31 -9.748 -11.012 6.707 286 HA LYS 31 HA LYS 31 -12.480 -12.065 6.387 287 HB2 LYS 31 HB2 LYS 31 -10.828 -11.211 8.541 288 HB3 LYS 31 HB3 LYS 31 -12.127 -10.051 8.505 289 HG2 LYS 31 HG2 LYS 31 -12.552 -13.083 8.551 290 HG3 LYS 31 HG3 LYS 31 -12.381 -12.091 9.990 291 HD2 LYS 31 HD2 LYS 31 -14.673 -12.422 9.767 292 HD3 LYS 31 HD3 LYS 31 -14.395 -10.751 9.270 293 HE2 LYS 31 HE2 LYS 31 -14.584 -11.415 6.897 294 HE3 LYS 31 HE3 LYS 31 -14.730 -13.117 7.365 295 HZ1 LYS 31 HZ1 LYS 31 -16.666 -10.976 8.078 296 HZ2 LYS 31 HZ2 LYS 31 -16.901 -12.111 6.930 297 HZ3 LYS 31 HZ3 LYS 31 -16.811 -12.550 8.498 298 H THR 32 H THR 32 -11.353 -10.370 4.356 299 HA THR 32 HA THR 32 -11.839 -8.858 2.870 300 HB THR 32 HB THR 32 -13.906 -8.842 2.070 301 HG1 THR 32 HG1 THR 32 -15.809 -8.803 3.282 302 HG21 THR 32 HG21 THR 32 -14.338 -11.043 4.092 303 HG22 THR 32 HG22 THR 32 -15.034 -10.909 2.463 304 HG23 THR 32 HG23 THR 32 -13.290 -11.204 2.661 305 H GLY 33 H GLY 33 -11.846 -7.849 5.879 306 HA2 GLY 33 HA2 GLY 33 -13.228 -5.357 5.669 307 HA3 GLY 33 HA3 GLY 33 -12.270 -5.922 7.042 308 H GLU 34 H GLU 34 -9.755 -6.202 5.656 309 HA GLU 34 HA GLU 34 -8.913 -3.375 5.484 310 HB2 GLU 34 HB2 GLU 34 -7.234 -5.894 5.327 311 HB3 GLU 34 HB3 GLU 34 -6.640 -4.246 5.505 312 HG2 GLU 34 HG2 GLU 34 -8.299 -5.773 7.566 313 HG3 GLU 34 HG3 GLU 34 -6.562 -5.550 7.600 314 H LEU 35 H LEU 35 -8.821 -6.254 3.359 315 HA LEU 35 HA LEU 35 -8.701 -4.549 0.962 316 HB2 LEU 35 HB2 LEU 35 -7.120 -6.959 1.804 317 HB3 LEU 35 HB3 LEU 35 -7.833 -7.055 0.203 318 HG LEU 35 HG LEU 35 -6.830 -4.891 -0.391 319 HD11 LEU 35 HD11 LEU 35 -5.314 -5.182 2.229 320 HD12 LEU 35 HD12 LEU 35 -4.854 -4.084 0.911 321 HD13 LEU 35 HD13 LEU 35 -6.385 -3.845 1.750 322 HD21 LEU 35 HD21 LEU 35 -5.816 -7.103 -0.968 323 HD22 LEU 35 HD22 LEU 35 -4.603 -5.828 -0.786 324 HD23 LEU 35 HD23 LEU 35 -4.853 -7.019 0.514 325 H SER 36 H SER 36 -10.593 -4.533 0.091 326 HA SER 36 HA SER 36 -12.220 -7.031 -0.180 327 HB2 SER 36 HB2 SER 36 -13.421 -5.194 0.925 328 HB3 SER 36 HB3 SER 36 -13.135 -4.168 -0.490 329 HG SER 36 HG SER 36 -15.192 -5.239 -0.529 330 H GLU 37 H GLU 37 -11.717 -4.162 -2.149 331 HA GLU 37 HA GLU 37 -10.686 -5.704 -4.391 332 HB2 GLU 37 HB2 GLU 37 -13.460 -5.790 -4.022 333 HB3 GLU 37 HB3 GLU 37 -13.273 -4.426 -5.143 334 HG2 GLU 37 HG2 GLU 37 -11.700 -5.984 -6.472 335 HG3 GLU 37 HG3 GLU 37 -12.293 -7.281 -5.428 336 H GLU 38 H GLU 38 -12.317 -2.737 -3.336 337 HA GLU 38 HA GLU 38 -10.905 -1.017 -5.220 338 HB2 GLU 38 HB2 GLU 38 -12.710 -0.370 -2.857 339 HB3 GLU 38 HB3 GLU 38 -12.105 0.798 -4.042 340 HG2 GLU 38 HG2 GLU 38 -13.232 -0.496 -5.863 341 HG3 GLU 38 HG3 GLU 38 -13.939 -1.560 -4.647 342 H GLN 39 H GLN 39 -9.641 -2.619 -2.703 343 HA GLN 39 HA GLN 39 -7.762 -0.396 -1.937 344 HB2 GLN 39 HB2 GLN 39 -8.348 -3.086 -0.634 345 HB3 GLN 39 HB3 GLN 39 -7.162 -1.920 -0.077 346 HG2 GLN 39 HG2 GLN 39 -9.011 -1.439 1.282 347 HG3 GLN 39 HG3 GLN 39 -9.110 -0.211 0.037 348 HE21 GLN 39 HE21 GLN 39 -12.557 -1.224 0.147 349 HE22 GLN 39 HE22 GLN 39 -11.398 -0.074 0.805 350 H LYS 40 H LYS 40 -7.674 -3.853 -2.977 351 HA LYS 40 HA LYS 40 -4.821 -3.823 -3.421 352 HB2 LYS 40 HB2 LYS 40 -5.115 -5.997 -4.393 353 HB3 LYS 40 HB3 LYS 40 -6.115 -5.839 -2.955 354 HG2 LYS 40 HG2 LYS 40 -8.041 -5.213 -4.641 355 HG3 LYS 40 HG3 LYS 40 -6.946 -5.854 -5.865 356 HD2 LYS 40 HD2 LYS 40 -8.504 -7.582 -5.210 357 HD3 LYS 40 HD3 LYS 40 -6.907 -8.040 -4.610 358 HE2 LYS 40 HE2 LYS 40 -7.526 -7.334 -2.314 359 HE3 LYS 40 HE3 LYS 40 -9.048 -6.671 -2.893 360 HZ1 LYS 40 HZ1 LYS 40 -8.322 -9.552 -3.016 361 HZ2 LYS 40 HZ2 LYS 40 -9.354 -8.877 -1.939 362 HZ3 LYS 40 HZ3 LYS 40 -9.745 -8.905 -3.511 363 H LYS 41 H LYS 41 -7.505 -2.830 -5.433 364 HA LYS 41 HA LYS 41 -6.042 -2.393 -7.894 365 HB2 LYS 41 HB2 LYS 41 -8.557 -1.138 -6.728 366 HB3 LYS 41 HB3 LYS 41 -7.957 -0.791 -8.354 367 HG2 LYS 41 HG2 LYS 41 -8.212 -3.106 -9.047 368 HG3 LYS 41 HG3 LYS 41 -8.627 -3.604 -7.409 369 HD2 LYS 41 HD2 LYS 41 -10.609 -1.934 -7.579 370 HD3 LYS 41 HD3 LYS 41 -10.269 -1.902 -9.323 371 HE2 LYS 41 HE2 LYS 41 -10.535 -4.392 -9.384 372 HE3 LYS 41 HE3 LYS 41 -10.818 -4.386 -7.639 373 HZ1 LYS 41 HZ1 LYS 41 -12.588 -3.224 -9.713 374 HZ2 LYS 41 HZ2 LYS 41 -12.936 -4.444 -8.663 375 HZ3 LYS 41 HZ3 LYS 41 -12.785 -2.920 -8.117 376 H ILE 42 H ILE 42 -5.741 -0.812 -4.878 377 HA ILE 42 HA ILE 42 -4.197 1.409 -6.146 378 HB ILE 42 HB ILE 42 -5.295 1.084 -3.339 379 HG12 ILE 42 HG12 ILE 42 -5.912 3.615 -4.229 380 HG13 ILE 42 HG13 ILE 42 -5.882 2.768 -5.760 381 HG21 ILE 42 HG21 ILE 42 -3.313 3.206 -4.242 382 HG22 ILE 42 HG22 ILE 42 -4.187 3.165 -2.693 383 HG23 ILE 42 HG23 ILE 42 -3.010 1.920 -3.046 384 HD11 ILE 42 HD11 ILE 42 -7.542 2.019 -3.320 385 HD12 ILE 42 HD12 ILE 42 -8.140 2.808 -4.792 386 HD13 ILE 42 HD13 ILE 42 -7.558 1.136 -4.865 387 H VAL 43 H VAL 43 -3.789 -1.105 -3.530 388 HA VAL 43 HA VAL 43 -1.008 -0.453 -3.398 389 HB VAL 43 HB VAL 43 -2.282 -2.993 -2.334 390 HG11 VAL 43 HG11 VAL 43 0.279 -1.475 -1.628 391 HG12 VAL 43 HG12 VAL 43 -0.377 -2.827 -0.691 392 HG13 VAL 43 HG13 VAL 43 0.176 -3.102 -2.334 393 HG21 VAL 43 HG21 VAL 43 -3.488 -1.072 -1.442 394 HG22 VAL 43 HG22 VAL 43 -2.408 -1.678 -0.190 395 HG23 VAL 43 HG23 VAL 43 -1.968 -0.223 -1.102 396 H ALA 44 H ALA 44 -2.560 -3.319 -4.984 397 HA ALA 44 HA ALA 44 0.002 -4.419 -5.778 398 HB1 ALA 44 HB1 ALA 44 -2.767 -4.955 -6.937 399 HB2 ALA 44 HB2 ALA 44 -1.318 -5.958 -7.126 400 HB3 ALA 44 HB3 ALA 44 -2.064 -5.783 -5.526 401 H ASP 45 H ASP 45 -2.418 -2.347 -7.386 402 HA ASP 45 HA ASP 45 -1.083 -1.974 -9.873 403 HB2 ASP 45 HB2 ASP 45 -3.405 -1.282 -9.334 404 HB3 ASP 45 HB3 ASP 45 -2.770 0.001 -8.298 405 H TYR 46 H TYR 46 -0.572 -0.205 -6.767 406 HA TYR 46 HA TYR 46 1.311 1.646 -7.881 407 HB2 TYR 46 HB2 TYR 46 -0.123 1.946 -5.852 408 HB3 TYR 46 HB3 TYR 46 0.916 0.821 -4.983 409 HD1 TYR 46 HD1 TYR 46 2.809 3.034 -7.198 410 HD2 TYR 46 HD2 TYR 46 0.863 2.748 -3.371 411 HE1 TYR 46 HE1 TYR 46 4.044 4.994 -6.469 412 HE2 TYR 46 HE2 TYR 46 2.041 4.830 -2.624 413 HH TYR 46 HH TYR 46 4.332 6.572 -4.773 414 H ILE 47 H ILE 47 1.704 -1.501 -6.245 415 HA ILE 47 HA ILE 47 4.574 -1.538 -6.200 416 HB ILE 47 HB ILE 47 2.354 -3.513 -5.919 417 HG12 ILE 47 HG12 ILE 47 3.743 -4.239 -4.008 418 HG13 ILE 47 HG13 ILE 47 5.060 -3.213 -4.581 419 HG21 ILE 47 HG21 ILE 47 5.149 -4.454 -6.670 420 HG22 ILE 47 HG22 ILE 47 3.861 -5.470 -5.990 421 HG23 ILE 47 HG23 ILE 47 3.649 -4.757 -7.590 422 HD11 ILE 47 HD11 ILE 47 2.400 -2.283 -3.434 423 HD12 ILE 47 HD12 ILE 47 4.018 -2.151 -2.706 424 HD13 ILE 47 HD13 ILE 47 3.612 -1.201 -4.142 425 H SER 48 H SER 48 2.290 -2.304 -8.827 426 HA SER 48 HA SER 48 4.357 -2.988 -10.740 427 HB2 SER 48 HB2 SER 48 1.502 -2.037 -11.155 428 HB3 SER 48 HB3 SER 48 2.561 -2.671 -12.418 429 HG SER 48 HG SER 48 1.185 -4.297 -11.548 430 H GLU 49 H GLU 49 3.509 0.138 -9.435 431 HA GLU 49 HA GLU 49 4.166 1.522 -11.976 432 HB2 GLU 49 HB2 GLU 49 2.048 1.989 -10.714 433 HB3 GLU 49 HB3 GLU 49 3.030 2.564 -9.369 434 HG2 GLU 49 HG2 GLU 49 2.290 4.466 -10.536 435 HG3 GLU 49 HG3 GLU 49 4.003 4.309 -10.897 436 H VAL 50 H VAL 50 5.299 1.321 -8.549 437 HA VAL 50 HA VAL 50 7.814 2.695 -9.413 438 HB VAL 50 HB VAL 50 7.851 4.120 -7.514 439 HG11 VAL 50 HG11 VAL 50 5.035 4.333 -8.594 440 HG12 VAL 50 HG12 VAL 50 6.033 5.610 -7.872 441 HG13 VAL 50 HG13 VAL 50 6.495 4.913 -9.430 442 HG21 VAL 50 HG21 VAL 50 6.957 2.719 -5.784 443 HG22 VAL 50 HG22 VAL 50 6.102 4.244 -5.840 444 HG23 VAL 50 HG23 VAL 50 5.341 2.772 -6.517 445 H GLY 51 H GLY 51 6.387 0.134 -7.426 446 HA2 GLY 51 HA2 GLY 51 7.627 -1.682 -6.636 447 HA3 GLY 51 HA3 GLY 51 9.098 -0.719 -6.590 448 H LEU 52 H LEU 52 7.314 -2.242 -4.716 449 HA LEU 52 HA LEU 52 6.281 -0.942 -2.517 450 HB2 LEU 52 HB2 LEU 52 6.861 -2.905 -1.232 451 HB3 LEU 52 HB3 LEU 52 6.275 -3.350 -2.808 452 HG LEU 52 HG LEU 52 9.150 -3.212 -3.010 453 HD11 LEU 52 HD11 LEU 52 8.188 -4.872 -0.650 454 HD12 LEU 52 HD12 LEU 52 9.820 -4.882 -1.348 455 HD13 LEU 52 HD13 LEU 52 9.205 -3.421 -0.555 456 HD21 LEU 52 HD21 LEU 52 7.712 -4.657 -4.369 457 HD22 LEU 52 HD22 LEU 52 8.966 -5.586 -3.532 458 HD23 LEU 52 HD23 LEU 52 7.296 -5.614 -2.932 459 H ASN 53 H ASN 53 9.580 -1.020 -3.391 460 HA ASN 53 HA ASN 53 10.565 -0.185 -0.767 461 HB2 ASN 53 HB2 ASN 53 11.964 -0.904 -3.370 462 HB3 ASN 53 HB3 ASN 53 12.834 -0.295 -1.969 463 HD21 ASN 53 HD21 ASN 53 12.489 -4.140 -2.025 464 HD22 ASN 53 HD22 ASN 53 12.639 -3.067 -3.407 465 H ASN 54 H ASN 54 9.448 1.394 -3.563 466 HA ASN 54 HA ASN 54 11.058 3.847 -3.033 467 HB2 ASN 54 HB2 ASN 54 9.680 2.977 -5.589 468 HB3 ASN 54 HB3 ASN 54 10.746 4.364 -5.398 469 HD21 ASN 54 HD21 ASN 54 12.396 0.914 -6.426 470 HD22 ASN 54 HD22 ASN 54 10.711 1.383 -6.685 471 H LEU 55 H LEU 55 7.801 2.613 -3.138 472 HA LEU 55 HA LEU 55 6.428 5.168 -3.202 473 HB2 LEU 55 HB2 LEU 55 4.485 3.839 -2.463 474 HB3 LEU 55 HB3 LEU 55 5.262 3.249 -3.912 475 HG LEU 55 HG LEU 55 6.408 1.492 -2.384 476 HD11 LEU 55 HD11 LEU 55 4.090 2.322 -0.588 477 HD12 LEU 55 HD12 LEU 55 5.073 0.851 -0.423 478 HD13 LEU 55 HD13 LEU 55 5.819 2.423 -0.173 479 HD21 LEU 55 HD21 LEU 55 4.713 0.899 -4.000 480 HD22 LEU 55 HD22 LEU 55 4.322 0.104 -2.463 481 HD23 LEU 55 HD23 LEU 55 3.421 1.539 -2.957 482 H ASN 56 H ASN 56 4.925 5.758 -1.326 483 HA ASN 56 HA ASN 56 6.312 5.493 1.291 484 HB2 ASN 56 HB2 ASN 56 5.754 7.696 1.906 485 HB3 ASN 56 HB3 ASN 56 6.505 7.790 0.325 486 HD21 ASN 56 HD21 ASN 56 3.815 10.078 -0.172 487 HD22 ASN 56 HD22 ASN 56 5.500 9.962 0.329 488 H ALA 57 H ALA 57 4.788 5.862 3.118 489 HA ALA 57 HA ALA 57 2.549 3.979 2.884 490 HB1 ALA 57 HB1 ALA 57 3.803 5.540 5.178 491 HB2 ALA 57 HB2 ALA 57 2.564 4.280 5.361 492 HB3 ALA 57 HB3 ALA 57 4.159 3.859 4.710 493 H THR 58 H THR 58 2.985 7.454 3.008 494 HA THR 58 HA THR 58 0.509 8.346 3.985 495 HB THR 58 HB THR 58 2.245 9.669 1.873 496 HG1 THR 58 HG1 THR 58 3.303 10.580 3.661 497 HG21 THR 58 HG21 THR 58 0.359 10.809 3.976 498 HG22 THR 58 HG22 THR 58 1.475 11.770 2.973 499 HG23 THR 58 HG23 THR 58 0.165 10.867 2.207 500 H GLU 59 H GLU 59 1.458 7.694 0.575 501 HA GLU 59 HA GLU 59 -1.109 8.351 -0.549 502 HB2 GLU 59 HB2 GLU 59 1.167 6.569 -1.495 503 HB3 GLU 59 HB3 GLU 59 -0.252 6.901 -2.487 504 HG2 GLU 59 HG2 GLU 59 1.609 9.071 -1.418 505 HG3 GLU 59 HG3 GLU 59 1.767 8.316 -2.997 506 H LEU 60 H LEU 60 0.089 5.279 0.802 507 HA LEU 60 HA LEU 60 -2.278 3.756 0.075 508 HB2 LEU 60 HB2 LEU 60 -0.013 3.348 2.048 509 HB3 LEU 60 HB3 LEU 60 -1.476 2.379 2.156 510 HG LEU 60 HG LEU 60 -1.165 1.724 -0.265 511 HD11 LEU 60 HD11 LEU 60 1.621 2.859 0.208 512 HD12 LEU 60 HD12 LEU 60 1.148 1.823 -1.151 513 HD13 LEU 60 HD13 LEU 60 0.444 3.438 -0.992 514 HD21 LEU 60 HD21 LEU 60 -0.655 0.218 1.591 515 HD22 LEU 60 HD22 LEU 60 0.567 0.028 0.325 516 HD23 LEU 60 HD23 LEU 60 0.946 0.960 1.791 517 H SER 61 H SER 61 -1.368 5.442 3.159 518 HA SER 61 HA SER 61 -3.776 4.810 4.520 519 HB2 SER 61 HB2 SER 61 -3.136 6.621 6.068 520 HB3 SER 61 HB3 SER 61 -1.809 5.496 5.719 521 HG SER 61 HG SER 61 -1.142 7.680 5.640 522 H LYS 62 H LYS 62 -3.276 7.078 1.979 523 HA LYS 62 HA LYS 62 -5.598 8.808 2.654 524 HB2 LYS 62 HB2 LYS 62 -3.580 8.720 0.387 525 HB3 LYS 62 HB3 LYS 62 -5.009 9.757 0.320 526 HG2 LYS 62 HG2 LYS 62 -4.342 11.054 2.192 527 HG3 LYS 62 HG3 LYS 62 -3.134 9.883 2.702 528 HD2 LYS 62 HD2 LYS 62 -2.015 11.780 1.709 529 HD3 LYS 62 HD3 LYS 62 -1.774 10.366 0.674 530 HE2 LYS 62 HE2 LYS 62 -3.671 11.189 -0.782 531 HE3 LYS 62 HE3 LYS 62 -3.765 12.641 0.227 532 HZ1 LYS 62 HZ1 LYS 62 -1.395 11.765 -1.355 533 HZ2 LYS 62 HZ2 LYS 62 -2.381 13.015 -1.735 534 HZ3 LYS 62 HZ3 LYS 62 -1.435 13.105 -0.405 535 H ARG 63 H ARG 63 -4.902 6.079 0.551 536 HA ARG 63 HA ARG 63 -7.600 6.272 -0.752 537 HB2 ARG 63 HB2 ARG 63 -4.972 4.969 -1.489 538 HB3 ARG 63 HB3 ARG 63 -6.485 4.407 -2.191 539 HG2 ARG 63 HG2 ARG 63 -5.366 5.980 -3.675 540 HG3 ARG 63 HG3 ARG 63 -6.949 6.577 -3.174 541 HD2 ARG 63 HD2 ARG 63 -5.965 8.173 -1.663 542 HD3 ARG 63 HD3 ARG 63 -4.366 7.458 -1.838 543 HE ARG 63 HE ARG 63 -5.801 9.186 -3.786 544 HH11 ARG 63 HH11 ARG 63 -4.508 10.351 -5.209 545 HH12 ARG 63 HH12 ARG 63 -2.830 9.907 -5.388 546 HH21 ARG 63 HH21 ARG 63 -2.891 7.336 -3.166 547 HH22 ARG 63 HH22 ARG 63 -1.908 8.441 -4.117 548 H LEU 64 H LEU 64 -5.659 4.002 1.190 549 HA LEU 64 HA LEU 64 -7.879 2.056 1.300 550 HB2 LEU 64 HB2 LEU 64 -5.012 2.121 2.245 551 HB3 LEU 64 HB3 LEU 64 -6.150 1.100 3.101 552 HG LEU 64 HG LEU 64 -6.781 -0.044 1.063 553 HD11 LEU 64 HD11 LEU 64 -4.645 1.653 -0.288 554 HD12 LEU 64 HD12 LEU 64 -5.381 0.197 -0.988 555 HD13 LEU 64 HD13 LEU 64 -6.387 1.604 -0.674 556 HD21 LEU 64 HD21 LEU 64 -4.959 -0.910 2.473 557 HD22 LEU 64 HD22 LEU 64 -4.720 -1.321 0.774 558 HD23 LEU 64 HD23 LEU 64 -3.773 -0.001 1.504 559 H ASN 65 H ASN 65 -6.946 4.846 3.112 560 HA ASN 65 HA ASN 65 -7.729 5.792 5.002 561 HB2 ASN 65 HB2 ASN 65 -9.872 5.434 3.679 562 HB3 ASN 65 HB3 ASN 65 -10.214 4.067 4.733 563 HD21 ASN 65 HD21 ASN 65 -10.941 6.183 7.576 564 HD22 ASN 65 HD22 ASN 65 -10.181 4.639 7.166 565 H ILE 66 H ILE 66 -5.874 4.115 5.432 566 HA ILE 66 HA ILE 66 -6.411 2.666 7.990 567 HB ILE 66 HB ILE 66 -4.214 1.498 7.493 568 HG12 ILE 66 HG12 ILE 66 -4.656 2.620 4.687 569 HG13 ILE 66 HG13 ILE 66 -3.313 2.973 5.780 570 HG21 ILE 66 HG21 ILE 66 -6.488 0.885 5.575 571 HG22 ILE 66 HG22 ILE 66 -5.256 -0.244 6.198 572 HG23 ILE 66 HG23 ILE 66 -6.442 0.449 7.299 573 HD11 ILE 66 HD11 ILE 66 -3.901 0.315 4.423 574 HD12 ILE 66 HD12 ILE 66 -2.618 1.462 4.038 575 HD13 ILE 66 HD13 ILE 66 -2.589 0.595 5.596 576 H THR 67 H THR 67 -4.673 2.893 9.618 577 HA THR 67 HA THR 67 -3.519 5.578 9.717 578 HB THR 67 HB THR 67 -4.185 4.446 11.778 579 HG1 THR 67 HG1 THR 67 -2.378 5.111 12.886 580 HG21 THR 67 HG21 THR 67 -1.728 2.678 11.391 581 HG22 THR 67 HG22 THR 67 -2.804 2.725 12.800 582 HG23 THR 67 HG23 THR 67 -3.414 2.119 11.255 583 H VAL 68 H VAL 68 -1.273 6.083 9.722 584 HA VAL 68 HA VAL 68 0.070 5.127 7.414 585 HB VAL 68 HB VAL 68 1.424 6.550 9.737 586 HG11 VAL 68 HG11 VAL 68 1.910 6.619 6.721 587 HG12 VAL 68 HG12 VAL 68 2.809 7.544 7.945 588 HG13 VAL 68 HG13 VAL 68 2.929 5.785 7.915 589 HG21 VAL 68 HG21 VAL 68 -0.591 7.852 9.231 590 HG22 VAL 68 HG22 VAL 68 0.825 8.682 8.593 591 HG23 VAL 68 HG23 VAL 68 -0.234 7.775 7.492 592 H ASP 69 H ASP 69 0.471 4.204 10.818 593 HA ASP 69 HA ASP 69 2.785 2.580 10.367 594 HB2 ASP 69 HB2 ASP 69 2.121 3.556 12.565 595 HB3 ASP 69 HB3 ASP 69 0.734 2.465 12.616 596 H LYS 70 H LYS 70 -0.649 1.791 10.067 597 HA LYS 70 HA LYS 70 -0.152 -1.085 9.734 598 HB2 LYS 70 HB2 LYS 70 -2.522 0.729 9.108 599 HB3 LYS 70 HB3 LYS 70 -2.451 -0.948 8.560 600 HG2 LYS 70 HG2 LYS 70 -2.169 -1.726 10.897 601 HG3 LYS 70 HG3 LYS 70 -2.326 -0.054 11.470 602 HD2 LYS 70 HD2 LYS 70 -4.597 0.075 10.453 603 HD3 LYS 70 HD3 LYS 70 -4.413 -1.578 9.835 604 HE2 LYS 70 HE2 LYS 70 -4.163 -2.407 12.174 605 HE3 LYS 70 HE3 LYS 70 -4.427 -0.764 12.775 606 HZ1 LYS 70 HZ1 LYS 70 -6.382 -2.302 11.140 607 HZ2 LYS 70 HZ2 LYS 70 -6.482 -2.099 12.760 608 HZ3 LYS 70 HZ3 LYS 70 -6.639 -0.814 11.767 609 H ALA 71 H ALA 71 -0.218 1.756 7.631 610 HA ALA 71 HA ALA 71 -0.087 0.216 5.151 611 HB1 ALA 71 HB1 ALA 71 0.685 3.109 5.763 612 HB2 ALA 71 HB2 ALA 71 0.541 2.395 4.148 613 HB3 ALA 71 HB3 ALA 71 -0.887 2.562 5.190 614 H LYS 72 H LYS 72 2.360 1.851 7.161 615 HA LYS 72 HA LYS 72 4.718 1.208 5.726 616 HB2 LYS 72 HB2 LYS 72 4.160 1.633 8.685 617 HB3 LYS 72 HB3 LYS 72 5.793 1.343 8.068 618 HG2 LYS 72 HG2 LYS 72 5.758 3.355 6.749 619 HG3 LYS 72 HG3 LYS 72 4.046 3.601 7.080 620 HD2 LYS 72 HD2 LYS 72 5.396 5.131 8.422 621 HD3 LYS 72 HD3 LYS 72 4.435 4.041 9.409 622 HE2 LYS 72 HE2 LYS 72 6.565 4.251 10.449 623 HE3 LYS 72 HE3 LYS 72 6.452 2.618 9.801 624 HZ1 LYS 72 HZ1 LYS 72 7.905 4.880 8.517 625 HZ2 LYS 72 HZ2 LYS 72 8.607 3.643 9.310 626 HZ3 LYS 72 HZ3 LYS 72 7.826 3.364 7.906 627 H THR 73 H THR 73 3.068 -0.804 8.218 628 HA THR 73 HA THR 73 5.152 -2.870 7.854 629 HB THR 73 HB THR 73 4.180 -2.240 10.085 630 HG1 THR 73 HG1 THR 73 4.412 -4.366 10.753 631 HG21 THR 73 HG21 THR 73 1.955 -4.182 9.314 632 HG22 THR 73 HG22 THR 73 2.209 -3.378 10.876 633 HG23 THR 73 HG23 THR 73 1.738 -2.424 9.464 634 H TYR 74 H TYR 74 1.757 -2.468 6.859 635 HA TYR 74 HA TYR 74 1.353 -5.121 5.907 636 HB2 TYR 74 HB2 TYR 74 -0.496 -3.631 6.284 637 HB3 TYR 74 HB3 TYR 74 0.164 -2.439 5.155 638 HD1 TYR 74 HD1 TYR 74 -0.513 -2.372 2.957 639 HD2 TYR 74 HD2 TYR 74 -1.089 -5.990 5.248 640 HE1 TYR 74 HE1 TYR 74 -1.608 -3.423 1.019 641 HE2 TYR 74 HE2 TYR 74 -2.166 -7.060 3.265 642 HH TYR 74 HH TYR 74 -2.397 -5.385 0.113 643 H ILE 75 H ILE 75 2.765 -2.255 4.271 644 HA ILE 75 HA ILE 75 3.084 -3.182 1.658 645 HB ILE 75 HB ILE 75 4.838 -1.487 3.457 646 HG12 ILE 75 HG12 ILE 75 3.391 -0.678 0.901 647 HG13 ILE 75 HG13 ILE 75 2.538 -0.757 2.430 648 HG21 ILE 75 HG21 ILE 75 5.379 -2.097 0.517 649 HG22 ILE 75 HG22 ILE 75 6.162 -0.804 1.448 650 HG23 ILE 75 HG23 ILE 75 6.447 -2.471 1.895 651 HD11 ILE 75 HD11 ILE 75 4.980 1.006 1.912 652 HD12 ILE 75 HD12 ILE 75 3.295 1.538 1.972 653 HD13 ILE 75 HD13 ILE 75 4.081 0.903 3.429 654 H LYS 76 H LYS 76 5.333 -3.898 4.393 655 HA LYS 76 HA LYS 76 6.773 -5.818 2.683 656 HB2 LYS 76 HB2 LYS 76 8.325 -6.050 4.541 657 HB3 LYS 76 HB3 LYS 76 8.058 -4.352 4.145 658 HG2 LYS 76 HG2 LYS 76 6.531 -4.119 6.083 659 HG3 LYS 76 HG3 LYS 76 6.752 -5.838 6.470 660 HD2 LYS 76 HD2 LYS 76 9.174 -5.440 6.830 661 HD3 LYS 76 HD3 LYS 76 8.936 -3.715 6.466 662 HE2 LYS 76 HE2 LYS 76 7.339 -3.537 8.363 663 HE3 LYS 76 HE3 LYS 76 7.556 -5.254 8.717 664 HZ1 LYS 76 HZ1 LYS 76 9.705 -3.203 8.860 665 HZ2 LYS 76 HZ2 LYS 76 8.956 -3.879 10.142 666 HZ3 LYS 76 HZ3 LYS 76 9.907 -4.793 9.184 667 H ASN 77 H ASN 77 4.349 -6.117 5.245 668 HA ASN 77 HA ASN 77 4.856 -8.980 5.526 669 HB2 ASN 77 HB2 ASN 77 2.719 -7.106 6.577 670 HB3 ASN 77 HB3 ASN 77 2.548 -8.852 6.726 671 HD21 ASN 77 HD21 ASN 77 5.380 -6.991 9.000 672 HD22 ASN 77 HD22 ASN 77 4.588 -6.104 7.703 673 H SER 78 H SER 78 2.826 -7.130 3.334 674 HA SER 78 HA SER 78 1.442 -9.545 2.362 675 HB2 SER 78 HB2 SER 78 0.407 -7.265 2.604 676 HB3 SER 78 HB3 SER 78 1.381 -6.734 1.222 677 HG SER 78 HG SER 78 -0.780 -7.501 0.703 678 H ASN 79 H ASN 79 4.128 -7.488 1.321 679 HA ASN 79 HA ASN 79 4.892 -9.457 -0.727 680 HB2 ASN 79 HB2 ASN 79 4.952 -7.692 -2.520 681 HB3 ASN 79 HB3 ASN 79 3.348 -8.211 -2.014 682 HD21 ASN 79 HD21 ASN 79 4.510 -4.382 -1.155 683 HD22 ASN 79 HD22 ASN 79 5.734 -5.628 -1.390 684 H ARG 80 H ARG 80 6.464 -9.398 1.276 685 HA ARG 80 HA ARG 80 8.424 -7.427 1.571 686 HB2 ARG 80 HB2 ARG 80 8.020 -9.523 2.986 687 HB3 ARG 80 HB3 ARG 80 8.939 -10.430 1.796 688 HG2 ARG 80 HG2 ARG 80 10.942 -9.184 2.268 689 HG3 ARG 80 HG3 ARG 80 10.051 -7.955 3.191 690 HD2 ARG 80 HD2 ARG 80 9.576 -9.470 4.977 691 HD3 ARG 80 HD3 ARG 80 10.132 -10.868 4.056 692 HE ARG 80 HE ARG 80 11.801 -8.812 5.392 693 HH11 ARG 80 HH11 ARG 80 13.968 -9.205 5.669 694 HH12 ARG 80 HH12 ARG 80 14.714 -10.566 4.884 695 HH21 ARG 80 HH21 ARG 80 11.855 -11.664 3.347 696 HH22 ARG 80 HH22 ARG 80 13.554 -11.933 3.621 697 H MET 81 H MET 81 8.416 -10.026 -0.779 698 HA MET 81 HA MET 81 10.455 -8.595 -2.429 699 HB2 MET 81 HB2 MET 81 10.525 -11.566 -1.744 700 HB3 MET 81 HB3 MET 81 11.486 -10.801 -3.018 701 HG2 MET 81 HG2 MET 81 12.550 -9.325 -1.341 702 HG3 MET 81 HG3 MET 81 11.630 -10.119 -0.057 703 HE1 MET 81 HE1 MET 81 13.907 -10.407 1.231 704 HE2 MET 81 HE2 MET 81 15.318 -11.275 0.582 705 HE3 MET 81 HE3 MET 81 14.833 -9.717 -0.121 706 H GLY 82 H GLY 82 7.893 -11.097 -2.339 707 HA2 GLY 82 HA2 GLY 82 6.542 -9.995 -4.633 708 HA3 GLY 82 HA3 GLY 82 7.440 -11.442 -5.094 709 H ARG 83 H ARG 83 4.698 -10.199 -3.389 710 HA ARG 83 HA ARG 83 2.947 -11.100 -2.195 711 HB2 ARG 83 HB2 ARG 83 3.120 -13.175 -4.411 712 HB3 ARG 83 HB3 ARG 83 1.744 -12.900 -3.357 713 HG2 ARG 83 HG2 ARG 83 1.127 -11.842 -5.285 714 HG3 ARG 83 HG3 ARG 83 1.637 -10.512 -4.246 715 HD2 ARG 83 HD2 ARG 83 3.730 -10.292 -5.486 716 HD3 ARG 83 HD3 ARG 83 3.428 -11.782 -6.374 717 HE ARG 83 HE ARG 83 2.203 -9.124 -6.796 718 HH11 ARG 83 HH11 ARG 83 1.068 -8.750 -8.663 719 HH12 ARG 83 HH12 ARG 83 0.624 -10.076 -9.694 720 HH21 ARG 83 HH21 ARG 83 2.074 -12.497 -7.750 721 HH22 ARG 83 HH22 ARG 83 1.178 -12.141 -9.201 722 H THR 84 H THR 84 5.310 -11.773 -0.951 723 HA THR 84 HA THR 84 6.472 -13.225 0.357 724 HB THR 84 HB THR 84 3.736 -13.936 1.439 725 HG1 THR 84 HG1 THR 84 3.948 -11.993 2.567 726 HG21 THR 84 HG21 THR 84 6.457 -13.493 2.780 727 HG22 THR 84 HG22 THR 84 4.918 -13.735 3.637 728 HG23 THR 84 HG23 THR 84 5.595 -15.043 2.674 729 H ASN 85 H ASN 85 6.010 -14.320 -2.197 730 HA ASN 85 HA ASN 85 6.205 -16.153 -3.425 731 HB2 ASN 85 HB2 ASN 85 8.278 -16.242 -2.005 732 HB3 ASN 85 HB3 ASN 85 7.473 -17.429 -0.977 733 HD21 ASN 85 HD21 ASN 85 8.635 -18.541 -4.776 734 HD22 ASN 85 HD22 ASN 85 8.262 -16.853 -4.469 735 H ASN 86 H ASN 86 3.640 -15.847 -2.114 736 HA ASN 86 HA ASN 86 2.760 -18.557 -1.458 737 HB2 ASN 86 HB2 ASN 86 0.848 -17.587 -0.591 738 HB3 ASN 86 HB3 ASN 86 2.197 -16.535 -0.162 739 HD21 ASN 86 HD21 ASN 86 -0.153 -14.070 -0.994 740 HD22 ASN 86 HD22 ASN 86 0.455 -15.111 0.301 741 H PHE 87 H PHE 87 2.978 -16.879 -4.344 742 HA PHE 87 HA PHE 87 0.418 -17.258 -5.462 743 HB2 PHE 87 HB2 PHE 87 1.429 -16.200 -7.435 744 HB3 PHE 87 HB3 PHE 87 1.810 -15.374 -5.935 745 HD1 PHE 87 HD1 PHE 87 3.203 -17.707 -8.498 746 HD2 PHE 87 HD2 PHE 87 4.068 -15.069 -5.202 747 HE1 PHE 87 HE1 PHE 87 5.635 -17.846 -9.021 748 HE2 PHE 87 HE2 PHE 87 6.492 -15.181 -5.742 749 HZ PHE 87 HZ PHE 87 7.278 -16.583 -7.647 750 H LYS 88 H LYS 88 2.145 -19.787 -4.900 751 HA LYS 88 HA LYS 88 2.326 -21.145 -7.518 752 HB2 LYS 88 HB2 LYS 88 3.286 -22.976 -6.183 753 HB3 LYS 88 HB3 LYS 88 4.106 -21.450 -5.887 754 HG2 LYS 88 HG2 LYS 88 1.897 -21.805 -3.985 755 HG3 LYS 88 HG3 LYS 88 2.947 -23.225 -3.979 756 HD2 LYS 88 HD2 LYS 88 4.878 -21.864 -3.405 757 HD3 LYS 88 HD3 LYS 88 3.979 -20.382 -3.732 758 HE2 LYS 88 HE2 LYS 88 4.111 -20.634 -1.347 759 HE3 LYS 88 HE3 LYS 88 2.436 -20.864 -1.841 760 HZ1 LYS 88 HZ1 LYS 88 4.353 -23.060 -1.220 761 HZ2 LYS 88 HZ2 LYS 88 3.152 -22.558 -0.239 762 HZ3 LYS 88 HZ3 LYS 88 2.792 -23.282 -1.655 763 H THR 89 H THR 89 -0.143 -20.685 -5.322 764 HA THR 89 HA THR 89 -1.544 -23.263 -5.885 765 HB THR 89 HB THR 89 -1.082 -21.892 -3.207 766 HG1 THR 89 HG1 THR 89 -0.056 -23.919 -2.780 767 HG21 THR 89 HG21 THR 89 -2.646 -24.404 -3.909 768 HG22 THR 89 HG22 THR 89 -2.188 -23.906 -2.257 769 HG23 THR 89 HG23 THR 89 -3.289 -22.899 -3.203 770 H ILE 90 H ILE 90 -1.824 -19.870 -4.710 771 HA ILE 90 HA ILE 90 -4.707 -19.742 -5.011 772 HB ILE 90 HB ILE 90 -4.361 -17.337 -4.762 773 HG12 ILE 90 HG12 ILE 90 -1.415 -17.835 -4.262 774 HG13 ILE 90 HG13 ILE 90 -1.997 -17.380 -5.864 775 HG21 ILE 90 HG21 ILE 90 -2.890 -18.974 -2.658 776 HG22 ILE 90 HG22 ILE 90 -3.694 -17.412 -2.419 777 HG23 ILE 90 HG23 ILE 90 -4.653 -18.841 -2.815 778 HD11 ILE 90 HD11 ILE 90 -2.338 -15.756 -3.317 779 HD12 ILE 90 HD12 ILE 90 -1.290 -15.387 -4.703 780 HD13 ILE 90 HD13 ILE 90 -3.053 -15.343 -4.894 781 H LYS 91 H LYS 91 -5.627 -18.046 -6.472 782 HA LYS 91 HA LYS 91 -6.262 -17.305 -8.507 783 HB2 LYS 91 HB2 LYS 91 -3.451 -17.697 -9.536 784 HB3 LYS 91 HB3 LYS 91 -4.673 -16.612 -10.167 785 HG2 LYS 91 HG2 LYS 91 -3.223 -16.283 -7.501 786 HG3 LYS 91 HG3 LYS 91 -2.779 -15.528 -9.005 787 HD2 LYS 91 HD2 LYS 91 -3.869 -13.896 -7.709 788 HD3 LYS 91 HD3 LYS 91 -4.962 -14.291 -9.037 789 HE2 LYS 91 HE2 LYS 91 -6.454 -15.469 -7.611 790 HE3 LYS 91 HE3 LYS 91 -5.234 -15.650 -6.339 791 HZ1 LYS 91 HZ1 LYS 91 -6.441 -13.031 -7.105 792 HZ2 LYS 91 HZ2 LYS 91 -6.900 -13.927 -5.820 793 HZ3 LYS 91 HZ3 LYS 91 -5.397 -13.293 -5.885 794 H MET 92 H MET 92 -4.757 -20.467 -8.472 795 HA MET 92 HA MET 92 -6.317 -21.150 -10.944 796 HB2 MET 92 HB2 MET 92 -4.691 -22.801 -11.452 797 HB3 MET 92 HB3 MET 92 -3.875 -21.281 -11.125 798 HG2 MET 92 HG2 MET 92 -2.514 -22.780 -10.046 799 HG3 MET 92 HG3 MET 92 -3.516 -22.226 -8.711 800 HE1 MET 92 HE1 MET 92 -2.819 -24.391 -7.180 801 HE2 MET 92 HE2 MET 92 -2.652 -26.001 -7.906 802 HE3 MET 92 HE3 MET 92 -1.670 -24.651 -8.516 803 H PHE 93 H PHE 93 -6.406 -21.630 -7.622 804 HA PHE 93 HA PHE 93 -7.524 -24.378 -7.783 805 HB2 PHE 93 HB2 PHE 93 -5.439 -23.769 -6.534 806 HB3 PHE 93 HB3 PHE 93 -6.420 -22.811 -5.428 807 HD1 PHE 93 HD1 PHE 93 -5.438 -26.144 -6.570 808 HD2 PHE 93 HD2 PHE 93 -7.874 -23.955 -3.781 809 HE1 PHE 93 HE1 PHE 93 -5.728 -28.219 -5.200 810 HE2 PHE 93 HE2 PHE 93 -8.171 -26.017 -2.410 811 HZ PHE 93 HZ PHE 93 -7.096 -28.147 -3.121 812 H GLU 94 H GLU 94 -8.461 -21.125 -6.767 813 HA GLU 94 HA GLU 94 -10.873 -22.041 -5.337 814 HB2 GLU 94 HB2 GLU 94 -9.810 -19.270 -6.001 815 HB3 GLU 94 HB3 GLU 94 -11.282 -19.577 -5.086 816 HG2 GLU 94 HG2 GLU 94 -8.491 -20.469 -4.234 817 HG3 GLU 94 HG3 GLU 94 -9.319 -19.031 -3.662 818 H ASP 95 H ASP 95 -13.013 -21.404 -5.907 819 HA ASP 95 HA ASP 95 -13.531 -21.334 -8.832 820 HB2 ASP 95 HB2 ASP 95 -14.557 -23.116 -7.458 821 HB3 ASP 95 HB3 ASP 95 -15.375 -21.892 -6.484 822 H ASP 96 H ASP 96 -14.858 -19.779 -9.802 823 HA ASP 96 HA ASP 96 -15.353 -17.257 -8.259 824 HB2 ASP 96 HB2 ASP 96 -14.427 -17.599 -11.131 825 HB3 ASP 96 HB3 ASP 96 -15.009 -16.084 -10.447 826 H VAL 97 H VAL 97 -17.234 -16.202 -8.520 827 HA VAL 97 HA VAL 97 -19.373 -17.453 -10.219 828 HB VAL 97 HB VAL 97 -19.700 -16.213 -7.460 829 HG11 VAL 97 HG11 VAL 97 -21.702 -17.645 -9.264 830 HG12 VAL 97 HG12 VAL 97 -22.000 -17.137 -7.587 831 HG13 VAL 97 HG13 VAL 97 -21.724 -15.919 -8.832 832 HG21 VAL 97 HG21 VAL 97 -18.602 -18.404 -7.261 833 HG22 VAL 97 HG22 VAL 97 -20.278 -18.519 -6.728 834 HG23 VAL 97 HG23 VAL 97 -19.817 -19.135 -8.331 835 H SER 98 H SER 98 -18.355 -14.411 -8.636 836 HA SER 98 HA SER 98 -19.701 -12.869 -10.812 837 HB2 SER 98 HB2 SER 98 -19.236 -12.026 -7.934 838 HB3 SER 98 HB3 SER 98 -20.090 -11.103 -9.186 839 HG SER 98 HG SER 98 -21.534 -12.254 -7.820 840 H SER 99 H SER 99 -16.781 -13.866 -10.464 841 HA SER 99 HA SER 99 -15.482 -11.349 -11.234 842 HB2 SER 99 HB2 SER 99 -15.259 -11.899 -8.699 843 HB3 SER 99 HB3 SER 99 -14.102 -13.132 -9.221 844 HG SER 99 HG SER 99 -13.117 -11.095 -8.742 845 H ALA 100 H ALA 100 -16.308 -13.657 -12.773 846 HA ALA 100 HA ALA 100 -13.781 -14.957 -13.620 847 HB1 ALA 100 HB1 ALA 100 -16.664 -15.442 -14.461 848 HB2 ALA 100 HB2 ALA 100 -15.250 -16.401 -14.946 849 HB3 ALA 100 HB3 ALA 100 -15.755 -16.372 -13.246 850 H SER 101 H SER 101 -13.123 -14.984 -15.823 851 HA SER 101 HA SER 101 -14.097 -12.846 -17.653 852 HB2 SER 101 HB2 SER 101 -11.210 -13.250 -16.760 853 HB3 SER 101 HB3 SER 101 -11.709 -12.248 -18.134 854 HG SER 101 HG SER 101 -11.455 -10.981 -16.280 855 H ALA 102 H ALA 102 -12.831 -13.142 -19.856 856 HA ALA 102 HA ALA 102 -13.426 -15.722 -20.856 857 HB1 ALA 102 HB1 ALA 102 -11.692 -13.520 -22.060 858 HB2 ALA 102 HB2 ALA 102 -12.432 -14.866 -22.952 859 HB3 ALA 102 HB3 ALA 102 -13.464 -13.638 -22.196 860 H GLN 103 H GLN 103 -10.659 -14.731 -19.235 861 HA GLN 103 HA GLN 103 -9.583 -17.426 -19.363 862 HB2 GLN 103 HB2 GLN 103 -7.273 -16.724 -19.772 863 HB3 GLN 103 HB3 GLN 103 -8.322 -16.235 -21.106 864 HG2 GLN 103 HG2 GLN 103 -8.363 -13.917 -20.270 865 HG3 GLN 103 HG3 GLN 103 -7.384 -14.378 -18.880 866 HE21 GLN 103 HE21 GLN 103 -4.984 -12.883 -21.203 867 HE22 GLN 103 HE22 GLN 103 -6.266 -12.378 -20.108 868 HA PRO 104 HA PRO 104 -9.127 -16.562 -15.051 869 HB2 PRO 104 HB2 PRO 104 -7.661 -18.642 -14.143 870 HB3 PRO 104 HB3 PRO 104 -9.222 -18.889 -14.973 871 HG2 PRO 104 HG2 PRO 104 -6.444 -19.027 -16.203 872 HG3 PRO 104 HG3 PRO 104 -7.754 -20.248 -16.300 873 HD2 PRO 104 HD2 PRO 104 -7.338 -18.357 -18.244 874 HD3 PRO 104 HD3 PRO 104 -8.970 -18.965 -17.835 875 H ASN 105 H ASN 105 -7.787 -14.618 -16.150 876 HA ASN 105 HA ASN 105 -5.183 -14.401 -14.696 877 HB2 ASN 105 HB2 ASN 105 -4.831 -14.944 -17.121 878 HB3 ASN 105 HB3 ASN 105 -5.684 -13.456 -17.544 879 HD21 ASN 105 HD21 ASN 105 -2.226 -12.420 -17.714 880 HD22 ASN 105 HD22 ASN 105 -3.464 -13.229 -18.664 881 H LEU 106 H LEU 106 -6.726 -13.478 -13.148 882 HA LEU 106 HA LEU 106 -6.923 -10.549 -13.456 883 HB2 LEU 106 HB2 LEU 106 -9.127 -11.689 -14.115 884 HB3 LEU 106 HB3 LEU 106 -9.217 -12.288 -12.464 885 HG LEU 106 HG LEU 106 -9.154 -9.827 -11.706 886 HD11 LEU 106 HD11 LEU 106 -9.838 -9.365 -14.651 887 HD12 LEU 106 HD12 LEU 106 -9.857 -8.148 -13.358 888 HD13 LEU 106 HD13 LEU 106 -8.327 -8.858 -13.884 889 HD21 LEU 106 HD21 LEU 106 -11.219 -11.159 -11.718 890 HD22 LEU 106 HD22 LEU 106 -11.548 -9.488 -12.196 891 HD23 LEU 106 HD23 LEU 106 -11.484 -10.769 -13.429 892 HA PRO 107 HA PRO 107 -5.175 -11.089 -9.347 893 HB2 PRO 107 HB2 PRO 107 -5.312 -8.537 -8.347 894 HB3 PRO 107 HB3 PRO 107 -4.142 -9.062 -9.596 895 HG2 PRO 107 HG2 PRO 107 -6.796 -7.650 -10.005 896 HG3 PRO 107 HG3 PRO 107 -5.207 -7.263 -10.739 897 HD2 PRO 107 HD2 PRO 107 -7.081 -8.719 -12.053 898 HD3 PRO 107 HD3 PRO 107 -5.342 -9.094 -12.223 Start of MODEL 9 1 H1 GLY -5 H1 GLY -5 13.150 -64.371 28.878 2 H2 GLY -5 H2 GLY -5 13.710 -64.345 30.416 3 H3 GLY -5 H3 GLY -5 14.584 -65.078 29.238 4 HA2 GLY -5 HA2 GLY -5 15.575 -62.959 29.789 5 HA3 GLY -5 HA3 GLY -5 14.971 -62.988 28.123 6 H SER -4 H SER -4 15.171 -60.585 28.629 7 HA SER -4 HA SER -4 12.476 -59.527 29.189 8 HB2 SER -4 HB2 SER -4 13.819 -59.438 31.363 9 HB3 SER -4 HB3 SER -4 14.891 -58.278 30.545 10 HG SER -4 HG SER -4 13.156 -57.289 31.742 11 H HIS -3 H HIS -3 12.203 -57.336 28.405 12 HA HIS -3 HA HIS -3 14.272 -56.169 26.659 13 HB2 HIS -3 HB2 HIS -3 13.134 -57.809 25.198 14 HB3 HIS -3 HB3 HIS -3 11.576 -57.080 25.573 15 HD2 HIS -3 HD2 HIS -3 15.009 -55.758 24.173 16 HE1 HIS -3 HE1 HIS -3 11.886 -54.109 21.781 17 HE2 HIS -3 HE2 HIS -3 14.410 -54.280 22.081 18 H MET -2 H MET -2 14.311 -54.097 27.144 19 HA MET -2 HA MET -2 11.805 -52.557 27.579 20 HB2 MET -2 HB2 MET -2 14.233 -52.519 29.430 21 HB3 MET -2 HB3 MET -2 12.844 -51.432 29.539 22 HG2 MET -2 HG2 MET -2 11.354 -53.346 29.984 23 HG3 MET -2 HG3 MET -2 12.734 -54.442 29.889 24 HE1 MET -2 HE1 MET -2 10.906 -51.666 31.946 25 HE2 MET -2 HE2 MET -2 11.987 -51.420 33.334 26 HE3 MET -2 HE3 MET -2 12.468 -50.841 31.729 27 H ALA -1 H ALA -1 13.324 -52.617 25.236 28 HA ALA -1 HA ALA -1 15.122 -50.312 25.151 29 HB1 ALA -1 HB1 ALA -1 13.983 -51.967 22.870 30 HB2 ALA -1 HB2 ALA -1 15.339 -50.825 22.786 31 HB3 ALA -1 HB3 ALA -1 15.492 -52.303 23.755 32 H SER 0 H SER 0 12.029 -50.973 23.502 33 HA SER 0 HA SER 0 10.448 -49.670 22.575 34 HB2 SER 0 HB2 SER 0 10.636 -48.392 25.310 35 HB3 SER 0 HB3 SER 0 9.199 -48.434 24.266 36 HG SER 0 HG SER 0 9.133 -50.104 25.826 37 H MET 1 H MET 1 12.886 -48.563 21.757 38 HA MET 1 HA MET 1 12.035 -45.864 20.917 39 HB2 MET 1 HB2 MET 1 14.541 -46.339 22.586 40 HB3 MET 1 HB3 MET 1 14.376 -44.958 21.501 41 HG2 MET 1 HG2 MET 1 12.315 -44.271 22.704 42 HG3 MET 1 HG3 MET 1 12.617 -45.550 23.892 43 HE1 MET 1 HE1 MET 1 12.319 -43.382 25.599 44 HE2 MET 1 HE2 MET 1 13.446 -42.005 25.603 45 HE3 MET 1 HE3 MET 1 12.319 -42.224 24.248 46 H ASP 2 H ASP 2 14.464 -48.296 20.820 47 HA ASP 2 HA ASP 2 15.658 -47.330 18.304 48 HB2 ASP 2 HB2 ASP 2 16.952 -48.188 20.283 49 HB3 ASP 2 HB3 ASP 2 16.318 -49.799 19.950 50 H GLN 3 H GLN 3 12.996 -49.158 18.912 51 HA GLN 3 HA GLN 3 13.189 -50.884 16.490 52 HB2 GLN 3 HB2 GLN 3 14.150 -51.923 18.588 53 HB3 GLN 3 HB3 GLN 3 12.568 -51.805 19.325 54 HG2 GLN 3 HG2 GLN 3 12.280 -53.206 16.791 55 HG3 GLN 3 HG3 GLN 3 13.691 -53.854 17.611 56 HE21 GLN 3 HE21 GLN 3 10.032 -54.198 19.534 57 HE22 GLN 3 HE22 GLN 3 10.339 -52.827 18.458 58 H LEU 4 H LEU 4 11.443 -48.469 17.284 59 HA LEU 4 HA LEU 4 8.920 -49.666 16.347 60 HB2 LEU 4 HB2 LEU 4 9.046 -47.904 18.833 61 HB3 LEU 4 HB3 LEU 4 7.614 -48.128 17.849 62 HG LEU 4 HG LEU 4 8.118 -50.739 18.285 63 HD11 LEU 4 HD11 LEU 4 9.088 -49.339 20.817 64 HD12 LEU 4 HD12 LEU 4 8.828 -51.087 20.614 65 HD13 LEU 4 HD13 LEU 4 10.131 -50.279 19.733 66 HD21 LEU 4 HD21 LEU 4 6.020 -49.573 18.788 67 HD22 LEU 4 HD22 LEU 4 6.492 -50.627 20.127 68 HD23 LEU 4 HD23 LEU 4 6.740 -48.870 20.254 69 H ASP 5 H ASP 5 7.725 -48.424 15.101 70 HA ASP 5 HA ASP 5 8.306 -45.546 14.602 71 HB2 ASP 5 HB2 ASP 5 8.559 -47.760 12.524 72 HB3 ASP 5 HB3 ASP 5 8.275 -46.081 12.087 73 H GLU 6 H GLU 6 6.149 -48.266 14.530 74 HA GLU 6 HA GLU 6 4.081 -47.078 12.882 75 HB2 GLU 6 HB2 GLU 6 2.895 -49.172 13.281 76 HB3 GLU 6 HB3 GLU 6 4.520 -49.423 12.683 77 HG2 GLU 6 HG2 GLU 6 4.022 -49.560 15.674 78 HG3 GLU 6 HG3 GLU 6 3.522 -50.891 14.643 79 H ILE 7 H ILE 7 4.526 -45.345 14.949 80 HA ILE 7 HA ILE 7 2.263 -45.659 16.881 81 HB ILE 7 HB ILE 7 4.755 -43.972 17.031 82 HG12 ILE 7 HG12 ILE 7 3.794 -46.360 18.694 83 HG13 ILE 7 HG13 ILE 7 4.973 -46.487 17.389 84 HG21 ILE 7 HG21 ILE 7 2.439 -44.257 19.018 85 HG22 ILE 7 HG22 ILE 7 3.942 -43.357 19.299 86 HG23 ILE 7 HG23 ILE 7 2.818 -42.796 18.078 87 HD11 ILE 7 HD11 ILE 7 5.354 -44.960 19.968 88 HD12 ILE 7 HD12 ILE 7 6.161 -46.447 19.439 89 HD13 ILE 7 HD13 ILE 7 6.477 -44.924 18.579 90 H ILE 8 H ILE 8 0.456 -44.702 16.237 91 HA ILE 8 HA ILE 8 0.524 -41.948 15.080 92 HB ILE 8 HB ILE 8 -1.432 -44.080 14.127 93 HG12 ILE 8 HG12 ILE 8 -0.135 -43.505 11.854 94 HG13 ILE 8 HG13 ILE 8 1.212 -43.204 12.940 95 HG21 ILE 8 HG21 ILE 8 -0.842 -41.248 13.154 96 HG22 ILE 8 HG22 ILE 8 -2.026 -42.372 12.451 97 HG23 ILE 8 HG23 ILE 8 -2.277 -41.747 14.075 98 HD11 ILE 8 HD11 ILE 8 -0.403 -45.789 12.667 99 HD12 ILE 8 HD12 ILE 8 1.239 -45.501 12.057 100 HD13 ILE 8 HD13 ILE 8 0.943 -45.573 13.800 101 H GLU 9 H GLU 9 -1.668 -44.422 16.510 102 HA GLU 9 HA GLU 9 -2.706 -42.347 18.400 103 HB2 GLU 9 HB2 GLU 9 -4.300 -44.497 16.951 104 HB3 GLU 9 HB3 GLU 9 -4.884 -43.558 18.331 105 HG2 GLU 9 HG2 GLU 9 -4.554 -41.456 17.033 106 HG3 GLU 9 HG3 GLU 9 -4.047 -42.409 15.636 107 H GLN 10 H GLN 10 -2.162 -42.836 20.391 108 HA GLN 10 HA GLN 10 -2.520 -45.483 21.524 109 HB2 GLN 10 HB2 GLN 10 -0.023 -45.116 20.440 110 HB3 GLN 10 HB3 GLN 10 0.236 -44.427 22.048 111 HG2 GLN 10 HG2 GLN 10 -0.546 -46.556 23.080 112 HG3 GLN 10 HG3 GLN 10 -0.920 -47.195 21.481 113 HE21 GLN 10 HE21 GLN 10 2.284 -48.759 22.053 114 HE22 GLN 10 HE22 GLN 10 0.568 -48.981 22.359 115 H ILE 11 H ILE 11 -1.237 -45.139 23.947 116 HA ILE 11 HA ILE 11 -2.321 -42.675 25.120 117 HB ILE 11 HB ILE 11 -3.951 -44.380 25.468 118 HG12 ILE 11 HG12 ILE 11 -2.321 -43.984 27.997 119 HG13 ILE 11 HG13 ILE 11 -3.327 -42.743 27.236 120 HG21 ILE 11 HG21 ILE 11 -1.836 -46.154 26.772 121 HG22 ILE 11 HG22 ILE 11 -3.567 -46.501 26.611 122 HG23 ILE 11 HG23 ILE 11 -2.562 -46.440 25.175 123 HD11 ILE 11 HD11 ILE 11 -4.303 -45.373 28.429 124 HD12 ILE 11 HD12 ILE 11 -4.584 -43.738 29.053 125 HD13 ILE 11 HD13 ILE 11 -5.327 -44.238 27.516 126 H GLN 12 H GLN 12 -0.959 -41.663 26.238 127 HA GLN 12 HA GLN 12 1.407 -42.779 27.602 128 HB2 GLN 12 HB2 GLN 12 2.955 -41.299 26.337 129 HB3 GLN 12 HB3 GLN 12 2.283 -42.589 25.372 130 HG2 GLN 12 HG2 GLN 12 1.057 -39.801 25.310 131 HG3 GLN 12 HG3 GLN 12 2.481 -40.198 24.360 132 HE21 GLN 12 HE21 GLN 12 -1.106 -41.342 22.913 133 HE22 GLN 12 HE22 GLN 12 -0.963 -40.190 24.222 134 H LYS 13 H LYS 13 2.793 -40.769 28.434 135 HA LYS 13 HA LYS 13 1.045 -39.155 30.118 136 HB2 LYS 13 HB2 LYS 13 3.166 -40.246 30.870 137 HB3 LYS 13 HB3 LYS 13 4.078 -39.077 29.904 138 HG2 LYS 13 HG2 LYS 13 3.053 -37.218 31.234 139 HG3 LYS 13 HG3 LYS 13 2.141 -38.392 32.178 140 HD2 LYS 13 HD2 LYS 13 5.189 -38.286 32.040 141 HD3 LYS 13 HD3 LYS 13 4.212 -37.484 33.280 142 HE2 LYS 13 HE2 LYS 13 3.246 -39.686 33.941 143 HE3 LYS 13 HE3 LYS 13 4.280 -40.490 32.754 144 HZ1 LYS 13 HZ1 LYS 13 5.265 -38.899 35.064 145 HZ2 LYS 13 HZ2 LYS 13 5.270 -40.526 34.975 146 HZ3 LYS 13 HZ3 LYS 13 6.218 -39.656 33.974 147 H GLU 14 H GLU 14 0.015 -38.248 28.185 148 HA GLU 14 HA GLU 14 1.384 -36.020 26.855 149 HB2 GLU 14 HB2 GLU 14 -0.532 -36.035 25.338 150 HB3 GLU 14 HB3 GLU 14 0.086 -37.665 25.576 151 HG2 GLU 14 HG2 GLU 14 -1.756 -37.978 27.356 152 HG3 GLU 14 HG3 GLU 14 -2.430 -36.449 26.805 153 H ALA 15 H ALA 15 0.736 -35.766 29.668 154 HA ALA 15 HA ALA 15 -1.392 -33.981 30.186 155 HB1 ALA 15 HB1 ALA 15 1.242 -34.562 31.577 156 HB2 ALA 15 HB2 ALA 15 -0.128 -33.684 32.318 157 HB3 ALA 15 HB3 ALA 15 -0.305 -35.388 31.828 158 H ILE 16 H ILE 16 2.028 -33.070 30.368 159 HA ILE 16 HA ILE 16 1.451 -30.354 29.295 160 HB ILE 16 HB ILE 16 2.769 -31.166 31.890 161 HG12 ILE 16 HG12 ILE 16 0.365 -29.365 31.347 162 HG13 ILE 16 HG13 ILE 16 0.297 -31.028 31.918 163 HG21 ILE 16 HG21 ILE 16 2.743 -28.382 30.633 164 HG22 ILE 16 HG22 ILE 16 3.135 -28.680 32.343 165 HG23 ILE 16 HG23 ILE 16 4.167 -29.339 31.111 166 HD11 ILE 16 HD11 ILE 16 1.275 -28.652 33.498 167 HD12 ILE 16 HD12 ILE 16 -0.107 -29.708 33.799 168 HD13 ILE 16 HD13 ILE 16 1.536 -30.348 33.991 169 H ASN 17 H ASN 17 2.856 -32.916 28.408 170 HA ASN 17 HA ASN 17 5.557 -31.870 27.835 171 HB2 ASN 17 HB2 ASN 17 4.312 -34.608 27.324 172 HB3 ASN 17 HB3 ASN 17 5.995 -34.189 27.013 173 HD21 ASN 17 HD21 ASN 17 5.096 -35.429 30.667 174 HD22 ASN 17 HD22 ASN 17 4.119 -35.759 29.238 175 H SER 18 H SER 18 2.609 -31.617 26.365 176 HA SER 18 HA SER 18 3.670 -31.646 23.558 177 HB2 SER 18 HB2 SER 18 1.277 -31.932 22.927 178 HB3 SER 18 HB3 SER 18 1.946 -33.267 23.887 179 HG SER 18 HG SER 18 -0.108 -32.633 24.674 180 H ASN 19 H ASN 19 1.247 -29.885 25.505 181 HA ASN 19 HA ASN 19 0.964 -27.636 23.850 182 HB2 ASN 19 HB2 ASN 19 -0.080 -26.596 25.834 183 HB3 ASN 19 HB3 ASN 19 -0.633 -28.247 25.591 184 HD21 ASN 19 HD21 ASN 19 0.018 -27.918 29.204 185 HD22 ASN 19 HD22 ASN 19 -1.097 -27.180 28.054 186 H VAL 20 H VAL 20 3.489 -28.255 26.090 187 HA VAL 20 HA VAL 20 4.618 -25.531 26.041 188 HB VAL 20 HB VAL 20 5.529 -28.156 27.259 189 HG11 VAL 20 HG11 VAL 20 6.880 -25.433 27.500 190 HG12 VAL 20 HG12 VAL 20 7.208 -26.832 28.545 191 HG13 VAL 20 HG13 VAL 20 7.592 -26.920 26.831 192 HG21 VAL 20 HG21 VAL 20 3.594 -27.049 28.354 193 HG22 VAL 20 HG22 VAL 20 5.019 -27.013 29.386 194 HG23 VAL 20 HG23 VAL 20 4.531 -25.551 28.502 195 H VAL 21 H VAL 21 4.855 -28.315 24.005 196 HA VAL 21 HA VAL 21 7.318 -27.277 22.672 197 HB VAL 21 HB VAL 21 6.794 -30.237 23.097 198 HG11 VAL 21 HG11 VAL 21 9.300 -28.653 22.327 199 HG12 VAL 21 HG12 VAL 21 9.190 -30.417 22.505 200 HG13 VAL 21 HG13 VAL 21 8.316 -29.611 21.204 201 HG21 VAL 21 HG21 VAL 21 7.177 -29.327 25.329 202 HG22 VAL 21 HG22 VAL 21 8.625 -30.166 24.785 203 HG23 VAL 21 HG23 VAL 21 8.573 -28.389 24.744 204 H LEU 22 H LEU 22 5.362 -26.272 21.569 205 HA LEU 22 HA LEU 22 4.748 -27.822 19.117 206 HB2 LEU 22 HB2 LEU 22 2.798 -26.736 21.123 207 HB3 LEU 22 HB3 LEU 22 2.392 -26.451 19.444 208 HG LEU 22 HG LEU 22 2.999 -29.226 20.546 209 HD11 LEU 22 HD11 LEU 22 0.323 -27.871 19.986 210 HD12 LEU 22 HD12 LEU 22 0.561 -29.567 20.470 211 HD13 LEU 22 HD13 LEU 22 0.979 -28.264 21.590 212 HD21 LEU 22 HD21 LEU 22 3.318 -29.088 18.104 213 HD22 LEU 22 HD22 LEU 22 1.842 -29.973 18.476 214 HD23 LEU 22 HD23 LEU 22 1.739 -28.288 17.925 215 H LYS 23 H LYS 23 3.877 -26.498 17.379 216 HA LYS 23 HA LYS 23 5.502 -24.028 17.072 217 HB2 LYS 23 HB2 LYS 23 4.380 -25.981 15.028 218 HB3 LYS 23 HB3 LYS 23 5.313 -24.529 14.637 219 HG2 LYS 23 HG2 LYS 23 7.240 -25.366 15.918 220 HG3 LYS 23 HG3 LYS 23 6.369 -26.850 16.315 221 HD2 LYS 23 HD2 LYS 23 7.036 -25.945 13.479 222 HD3 LYS 23 HD3 LYS 23 7.998 -27.082 14.436 223 HE2 LYS 23 HE2 LYS 23 6.028 -28.598 14.619 224 HE3 LYS 23 HE3 LYS 23 5.088 -27.491 13.608 225 HZ1 LYS 23 HZ1 LYS 23 7.562 -28.897 12.746 226 HZ2 LYS 23 HZ2 LYS 23 6.045 -29.298 12.298 227 HZ3 LYS 23 HZ3 LYS 23 6.689 -27.879 11.810 228 H ASN 24 H ASN 24 3.156 -23.761 18.488 229 HA ASN 24 HA ASN 24 1.202 -22.627 18.700 230 HB2 ASN 24 HB2 ASN 24 3.094 -20.977 18.282 231 HB3 ASN 24 HB3 ASN 24 2.425 -20.748 16.666 232 HD21 ASN 24 HD21 ASN 24 -0.451 -18.942 17.882 233 HD22 ASN 24 HD22 ASN 24 0.052 -20.078 16.620 234 HA PRO 25 HA PRO 25 -0.728 -24.218 14.729 235 HB2 PRO 25 HB2 PRO 25 -2.161 -26.341 15.652 236 HB3 PRO 25 HB3 PRO 25 -0.408 -26.423 15.321 237 HG2 PRO 25 HG2 PRO 25 -1.754 -25.939 18.006 238 HG3 PRO 25 HG3 PRO 25 -0.487 -27.141 17.604 239 HD2 PRO 25 HD2 PRO 25 0.130 -24.726 18.695 240 HD3 PRO 25 HD3 PRO 25 1.174 -25.486 17.456 241 H ARG 26 H ARG 26 -1.763 -22.175 14.799 242 HA ARG 26 HA ARG 26 -4.665 -22.327 15.558 243 HB2 ARG 26 HB2 ARG 26 -2.767 -20.008 16.091 244 HB3 ARG 26 HB3 ARG 26 -4.522 -19.818 15.996 245 HG2 ARG 26 HG2 ARG 26 -4.795 -21.532 17.794 246 HG3 ARG 26 HG3 ARG 26 -3.032 -21.583 17.985 247 HD2 ARG 26 HD2 ARG 26 -2.961 -19.245 18.623 248 HD3 ARG 26 HD3 ARG 26 -4.659 -19.012 18.219 249 HE ARG 26 HE ARG 26 -3.553 -20.239 20.647 250 HH11 ARG 26 HH11 ARG 26 -4.918 -20.692 22.341 251 HH12 ARG 26 HH12 ARG 26 -6.640 -20.692 22.095 252 HH21 ARG 26 HH21 ARG 26 -6.499 -19.877 18.772 253 HH22 ARG 26 HH22 ARG 26 -7.516 -20.244 20.137 254 H VAL 27 H VAL 27 -2.417 -20.359 13.632 255 HA VAL 27 HA VAL 27 -2.751 -19.035 11.811 256 HB VAL 27 HB VAL 27 -3.702 -21.683 10.745 257 HG11 VAL 27 HG11 VAL 27 -2.339 -19.307 9.359 258 HG12 VAL 27 HG12 VAL 27 -2.688 -20.876 8.601 259 HG13 VAL 27 HG13 VAL 27 -4.012 -19.819 9.082 260 HG21 VAL 27 HG21 VAL 27 -1.567 -21.961 11.896 261 HG22 VAL 27 HG22 VAL 27 -1.308 -22.018 10.155 262 HG23 VAL 27 HG23 VAL 27 -0.896 -20.543 11.056 263 HA PRO 28 HA PRO 28 -7.239 -18.098 12.304 264 HB2 PRO 28 HB2 PRO 28 -7.073 -15.397 12.584 265 HB3 PRO 28 HB3 PRO 28 -6.828 -16.550 13.930 266 HG2 PRO 28 HG2 PRO 28 -4.690 -15.237 12.208 267 HG3 PRO 28 HG3 PRO 28 -4.743 -15.351 13.998 268 HD2 PRO 28 HD2 PRO 28 -3.297 -17.079 12.489 269 HD3 PRO 28 HD3 PRO 28 -4.169 -17.651 13.943 270 H THR 29 H THR 29 -8.687 -16.711 11.120 271 HA THR 29 HA THR 29 -8.003 -16.907 8.253 272 HB THR 29 HB THR 29 -10.461 -17.570 8.186 273 HG1 THR 29 HG1 THR 29 -11.333 -18.271 10.131 274 HG21 THR 29 HG21 THR 29 -8.567 -19.282 9.849 275 HG22 THR 29 HG22 THR 29 -9.984 -19.863 8.942 276 HG23 THR 29 HG23 THR 29 -8.588 -19.194 8.077 277 H GLN 30 H GLN 30 -7.340 -14.570 8.705 278 HA GLN 30 HA GLN 30 -9.649 -12.738 8.558 279 HB2 GLN 30 HB2 GLN 30 -6.721 -12.280 9.196 280 HB3 GLN 30 HB3 GLN 30 -7.911 -10.976 9.140 281 HG2 GLN 30 HG2 GLN 30 -9.100 -11.747 11.011 282 HG3 GLN 30 HG3 GLN 30 -8.417 -13.369 10.934 283 HE21 GLN 30 HE21 GLN 30 -5.304 -12.489 12.493 284 HE22 GLN 30 HE22 GLN 30 -5.994 -13.559 11.277 285 H LYS 31 H LYS 31 -8.610 -14.261 6.261 286 HA LYS 31 HA LYS 31 -7.325 -12.461 4.450 287 HB2 LYS 31 HB2 LYS 31 -7.607 -15.190 4.770 288 HB3 LYS 31 HB3 LYS 31 -8.580 -14.935 3.346 289 HG2 LYS 31 HG2 LYS 31 -5.648 -14.107 3.691 290 HG3 LYS 31 HG3 LYS 31 -6.214 -15.596 2.952 291 HD2 LYS 31 HD2 LYS 31 -5.732 -14.335 1.104 292 HD3 LYS 31 HD3 LYS 31 -7.475 -14.100 1.252 293 HE2 LYS 31 HE2 LYS 31 -7.002 -11.905 2.425 294 HE3 LYS 31 HE3 LYS 31 -5.273 -12.187 2.188 295 HZ1 LYS 31 HZ1 LYS 31 -7.287 -11.917 0.022 296 HZ2 LYS 31 HZ2 LYS 31 -6.193 -10.774 0.445 297 HZ3 LYS 31 HZ3 LYS 31 -5.689 -12.178 -0.220 298 H THR 32 H THR 32 -10.031 -11.684 5.369 299 HA THR 32 HA THR 32 -11.239 -10.846 2.796 300 HB THR 32 HB THR 32 -12.170 -13.054 3.375 301 HG1 THR 32 HG1 THR 32 -14.324 -12.527 3.251 302 HG21 THR 32 HG21 THR 32 -13.206 -11.739 5.919 303 HG22 THR 32 HG22 THR 32 -13.615 -13.367 5.335 304 HG23 THR 32 HG23 THR 32 -11.954 -13.000 5.815 305 H GLY 33 H GLY 33 -10.095 -9.852 5.620 306 HA2 GLY 33 HA2 GLY 33 -12.272 -8.030 6.486 307 HA3 GLY 33 HA3 GLY 33 -10.764 -8.359 7.327 308 H GLU 34 H GLU 34 -8.735 -7.613 5.962 309 HA GLU 34 HA GLU 34 -9.055 -4.722 5.934 310 HB2 GLU 34 HB2 GLU 34 -6.629 -6.523 5.598 311 HB3 GLU 34 HB3 GLU 34 -6.546 -4.767 5.713 312 HG2 GLU 34 HG2 GLU 34 -7.690 -6.564 7.897 313 HG3 GLU 34 HG3 GLU 34 -6.035 -5.976 7.839 314 H LEU 35 H LEU 35 -8.718 -7.091 3.354 315 HA LEU 35 HA LEU 35 -8.846 -4.958 1.356 316 HB2 LEU 35 HB2 LEU 35 -6.711 -7.144 1.373 317 HB3 LEU 35 HB3 LEU 35 -7.247 -6.312 -0.075 318 HG LEU 35 HG LEU 35 -6.679 -4.121 1.375 319 HD11 LEU 35 HD11 LEU 35 -4.679 -6.177 2.394 320 HD12 LEU 35 HD12 LEU 35 -4.585 -4.410 2.617 321 HD13 LEU 35 HD13 LEU 35 -5.876 -5.326 3.384 322 HD21 LEU 35 HD21 LEU 35 -5.765 -4.686 -0.845 323 HD22 LEU 35 HD22 LEU 35 -4.496 -4.090 0.232 324 HD23 LEU 35 HD23 LEU 35 -4.638 -5.833 -0.099 325 H SER 36 H SER 36 -10.201 -5.370 -0.119 326 HA SER 36 HA SER 36 -11.398 -8.079 -0.544 327 HB2 SER 36 HB2 SER 36 -12.774 -5.393 -0.696 328 HB3 SER 36 HB3 SER 36 -13.501 -6.974 -1.043 329 HG SER 36 HG SER 36 -13.933 -6.275 1.103 330 H GLU 37 H GLU 37 -11.282 -5.026 -2.340 331 HA GLU 37 HA GLU 37 -10.176 -6.318 -4.701 332 HB2 GLU 37 HB2 GLU 37 -12.899 -6.787 -4.242 333 HB3 GLU 37 HB3 GLU 37 -12.946 -5.364 -5.297 334 HG2 GLU 37 HG2 GLU 37 -11.389 -6.563 -6.861 335 HG3 GLU 37 HG3 GLU 37 -11.429 -7.955 -5.770 336 H GLU 38 H GLU 38 -11.978 -3.555 -3.394 337 HA GLU 38 HA GLU 38 -11.043 -1.622 -5.365 338 HB2 GLU 38 HB2 GLU 38 -12.115 -1.337 -2.520 339 HB3 GLU 38 HB3 GLU 38 -11.744 0.024 -3.588 340 HG2 GLU 38 HG2 GLU 38 -13.392 -0.769 -5.233 341 HG3 GLU 38 HG3 GLU 38 -13.777 -2.159 -4.215 342 H GLN 39 H GLN 39 -9.766 -3.031 -2.400 343 HA GLN 39 HA GLN 39 -7.831 -0.968 -1.873 344 HB2 GLN 39 HB2 GLN 39 -8.048 -3.806 -0.809 345 HB3 GLN 39 HB3 GLN 39 -7.005 -2.525 -0.193 346 HG2 GLN 39 HG2 GLN 39 -8.811 -2.475 1.277 347 HG3 GLN 39 HG3 GLN 39 -9.123 -1.127 0.199 348 HE21 GLN 39 HE21 GLN 39 -12.400 -2.709 0.495 349 HE22 GLN 39 HE22 GLN 39 -11.350 -1.608 1.372 350 H LYS 40 H LYS 40 -7.660 -4.056 -3.605 351 HA LYS 40 HA LYS 40 -4.793 -4.008 -4.103 352 HB2 LYS 40 HB2 LYS 40 -7.211 -5.391 -5.303 353 HB3 LYS 40 HB3 LYS 40 -5.643 -5.531 -6.110 354 HG2 LYS 40 HG2 LYS 40 -4.639 -6.695 -4.444 355 HG3 LYS 40 HG3 LYS 40 -5.632 -6.023 -3.156 356 HD2 LYS 40 HD2 LYS 40 -7.314 -7.553 -5.013 357 HD3 LYS 40 HD3 LYS 40 -5.965 -8.544 -4.424 358 HE2 LYS 40 HE2 LYS 40 -6.553 -7.937 -2.080 359 HE3 LYS 40 HE3 LYS 40 -7.897 -6.952 -2.672 360 HZ1 LYS 40 HZ1 LYS 40 -7.681 -9.873 -3.227 361 HZ2 LYS 40 HZ2 LYS 40 -8.526 -9.262 -1.962 362 HZ3 LYS 40 HZ3 LYS 40 -8.992 -8.911 -3.467 363 H LYS 41 H LYS 41 -7.573 -2.780 -5.871 364 HA LYS 41 HA LYS 41 -6.083 -1.626 -8.047 365 HB2 LYS 41 HB2 LYS 41 -8.734 -0.711 -6.842 366 HB3 LYS 41 HB3 LYS 41 -8.066 -0.121 -8.358 367 HG2 LYS 41 HG2 LYS 41 -8.167 -2.380 -9.334 368 HG3 LYS 41 HG3 LYS 41 -8.840 -3.016 -7.823 369 HD2 LYS 41 HD2 LYS 41 -10.774 -1.448 -8.037 370 HD3 LYS 41 HD3 LYS 41 -10.105 -0.860 -9.574 371 HE2 LYS 41 HE2 LYS 41 -10.240 -3.188 -10.484 372 HE3 LYS 41 HE3 LYS 41 -10.971 -3.723 -8.964 373 HZ1 LYS 41 HZ1 LYS 41 -12.142 -1.701 -10.806 374 HZ2 LYS 41 HZ2 LYS 41 -12.666 -3.235 -10.634 375 HZ3 LYS 41 HZ3 LYS 41 -12.820 -2.181 -9.398 376 H ILE 42 H ILE 42 -5.809 -0.768 -4.828 377 HA ILE 42 HA ILE 42 -4.533 1.834 -5.573 378 HB ILE 42 HB ILE 42 -5.488 0.842 -2.881 379 HG12 ILE 42 HG12 ILE 42 -6.561 3.394 -4.032 380 HG13 ILE 42 HG13 ILE 42 -7.077 1.949 -4.874 381 HG21 ILE 42 HG21 ILE 42 -4.112 3.458 -3.622 382 HG22 ILE 42 HG22 ILE 42 -4.908 3.130 -2.073 383 HG23 ILE 42 HG23 ILE 42 -3.494 2.194 -2.535 384 HD11 ILE 42 HD11 ILE 42 -7.423 2.431 -1.900 385 HD12 ILE 42 HD12 ILE 42 -8.691 2.431 -3.157 386 HD13 ILE 42 HD13 ILE 42 -7.840 0.935 -2.765 387 H VAL 43 H VAL 43 -4.018 -1.088 -3.477 388 HA VAL 43 HA VAL 43 -1.252 -0.489 -2.994 389 HB VAL 43 HB VAL 43 -2.743 -3.133 -2.751 390 HG11 VAL 43 HG11 VAL 43 -0.027 -2.331 -1.603 391 HG12 VAL 43 HG12 VAL 43 -0.906 -3.846 -1.289 392 HG13 VAL 43 HG13 VAL 43 -0.283 -3.530 -2.889 393 HG21 VAL 43 HG21 VAL 43 -3.627 -1.374 -1.264 394 HG22 VAL 43 HG22 VAL 43 -2.773 -2.612 -0.346 395 HG23 VAL 43 HG23 VAL 43 -1.983 -1.053 -0.659 396 H ALA 44 H ALA 44 -2.624 -3.108 -5.072 397 HA ALA 44 HA ALA 44 -0.022 -3.828 -6.087 398 HB1 ALA 44 HB1 ALA 44 -2.792 -4.516 -7.137 399 HB2 ALA 44 HB2 ALA 44 -1.253 -5.343 -7.515 400 HB3 ALA 44 HB3 ALA 44 -1.898 -5.405 -5.864 401 H ASP 45 H ASP 45 -2.593 -1.702 -7.206 402 HA ASP 45 HA ASP 45 -1.539 -0.992 -9.765 403 HB2 ASP 45 HB2 ASP 45 -3.756 -0.342 -8.863 404 HB3 ASP 45 HB3 ASP 45 -2.964 0.784 -7.755 405 H TYR 46 H TYR 46 -0.572 0.197 -6.511 406 HA TYR 46 HA TYR 46 1.430 2.059 -7.515 407 HB2 TYR 46 HB2 TYR 46 0.097 1.834 -5.188 408 HB3 TYR 46 HB3 TYR 46 1.497 0.892 -4.725 409 HD1 TYR 46 HD1 TYR 46 3.547 2.656 -6.321 410 HD2 TYR 46 HD2 TYR 46 0.376 3.545 -3.573 411 HE1 TYR 46 HE1 TYR 46 4.608 4.817 -5.872 412 HE2 TYR 46 HE2 TYR 46 1.506 5.695 -2.995 413 HH TYR 46 HH TYR 46 4.516 6.770 -4.612 414 H ILE 47 H ILE 47 1.483 -1.366 -6.390 415 HA ILE 47 HA ILE 47 4.336 -1.702 -6.546 416 HB ILE 47 HB ILE 47 2.144 -3.756 -7.009 417 HG12 ILE 47 HG12 ILE 47 1.698 -3.074 -4.837 418 HG13 ILE 47 HG13 ILE 47 2.793 -4.395 -4.564 419 HG21 ILE 47 HG21 ILE 47 5.026 -4.239 -6.202 420 HG22 ILE 47 HG22 ILE 47 3.744 -5.454 -6.398 421 HG23 ILE 47 HG23 ILE 47 4.328 -4.572 -7.805 422 HD11 ILE 47 HD11 ILE 47 3.443 -1.412 -4.418 423 HD12 ILE 47 HD12 ILE 47 3.331 -2.563 -3.078 424 HD13 ILE 47 HD13 ILE 47 4.658 -2.706 -4.249 425 H SER 48 H SER 48 1.843 -1.850 -9.056 426 HA SER 48 HA SER 48 3.750 -2.285 -11.225 427 HB2 SER 48 HB2 SER 48 0.841 -1.417 -11.226 428 HB3 SER 48 HB3 SER 48 1.793 -1.775 -12.679 429 HG SER 48 HG SER 48 0.579 -3.591 -11.950 430 H GLU 49 H GLU 49 3.383 0.492 -9.331 431 HA GLU 49 HA GLU 49 3.698 2.382 -11.602 432 HB2 GLU 49 HB2 GLU 49 1.937 2.709 -9.819 433 HB3 GLU 49 HB3 GLU 49 3.247 2.996 -8.664 434 HG2 GLU 49 HG2 GLU 49 4.046 4.867 -10.066 435 HG3 GLU 49 HG3 GLU 49 2.727 4.565 -11.205 436 H VAL 50 H VAL 50 5.326 1.460 -8.527 437 HA VAL 50 HA VAL 50 7.807 2.844 -9.505 438 HB VAL 50 HB VAL 50 8.191 3.790 -7.341 439 HG11 VAL 50 HG11 VAL 50 5.318 4.377 -8.055 440 HG12 VAL 50 HG12 VAL 50 6.481 5.420 -7.210 441 HG13 VAL 50 HG13 VAL 50 6.732 5.024 -8.915 442 HG21 VAL 50 HG21 VAL 50 7.346 2.080 -5.852 443 HG22 VAL 50 HG22 VAL 50 6.540 3.617 -5.527 444 HG23 VAL 50 HG23 VAL 50 5.694 2.338 -6.426 445 H GLY 51 H GLY 51 6.672 -0.104 -8.115 446 HA2 GLY 51 HA2 GLY 51 8.349 -1.826 -8.930 447 HA3 GLY 51 HA3 GLY 51 9.506 -1.055 -7.845 448 H LEU 52 H LEU 52 8.931 -0.960 -5.569 449 HA LEU 52 HA LEU 52 6.790 -2.539 -4.457 450 HB2 LEU 52 HB2 LEU 52 8.387 -4.351 -5.103 451 HB3 LEU 52 HB3 LEU 52 9.629 -3.649 -4.083 452 HG LEU 52 HG LEU 52 7.021 -4.093 -2.745 453 HD11 LEU 52 HD11 LEU 52 8.716 -6.459 -3.673 454 HD12 LEU 52 HD12 LEU 52 7.377 -6.563 -2.516 455 HD13 LEU 52 HD13 LEU 52 7.053 -6.090 -4.189 456 HD21 LEU 52 HD21 LEU 52 8.975 -3.459 -1.424 457 HD22 LEU 52 HD22 LEU 52 8.379 -5.038 -0.936 458 HD23 LEU 52 HD23 LEU 52 9.826 -4.931 -1.956 459 H ASN 53 H ASN 53 9.979 -1.364 -3.803 460 HA ASN 53 HA ASN 53 9.397 -0.560 -1.032 461 HB2 ASN 53 HB2 ASN 53 11.947 -0.696 -2.695 462 HB3 ASN 53 HB3 ASN 53 11.910 -0.133 -1.030 463 HD21 ASN 53 HD21 ASN 53 12.158 -4.051 -1.625 464 HD22 ASN 53 HD22 ASN 53 12.391 -2.884 -2.916 465 H ASN 54 H ASN 54 9.575 1.120 -4.043 466 HA ASN 54 HA ASN 54 10.717 3.546 -2.920 467 HB2 ASN 54 HB2 ASN 54 9.617 3.036 -5.702 468 HB3 ASN 54 HB3 ASN 54 10.667 4.366 -5.217 469 HD21 ASN 54 HD21 ASN 54 12.325 0.867 -6.255 470 HD22 ASN 54 HD22 ASN 54 10.681 1.350 -6.665 471 H LEU 55 H LEU 55 7.516 2.428 -3.212 472 HA LEU 55 HA LEU 55 6.092 4.946 -3.112 473 HB2 LEU 55 HB2 LEU 55 4.189 3.538 -2.476 474 HB3 LEU 55 HB3 LEU 55 5.070 2.923 -3.859 475 HG LEU 55 HG LEU 55 6.223 1.276 -2.253 476 HD11 LEU 55 HD11 LEU 55 3.832 2.093 -0.542 477 HD12 LEU 55 HD12 LEU 55 4.787 0.606 -0.339 478 HD13 LEU 55 HD13 LEU 55 5.549 2.168 -0.077 479 HD21 LEU 55 HD21 LEU 55 4.558 0.670 -3.949 480 HD22 LEU 55 HD22 LEU 55 4.334 -0.269 -2.467 481 HD23 LEU 55 HD23 LEU 55 3.241 1.089 -2.830 482 H ASN 56 H ASN 56 4.643 5.458 -1.110 483 HA ASN 56 HA ASN 56 6.122 4.965 1.412 484 HB2 ASN 56 HB2 ASN 56 5.988 7.187 2.144 485 HB3 ASN 56 HB3 ASN 56 6.650 7.238 0.524 486 HD21 ASN 56 HD21 ASN 56 4.379 9.961 0.241 487 HD22 ASN 56 HD22 ASN 56 6.057 9.519 0.537 488 H ALA 57 H ALA 57 4.856 5.445 3.325 489 HA ALA 57 HA ALA 57 2.439 3.836 3.300 490 HB1 ALA 57 HB1 ALA 57 4.007 5.344 5.440 491 HB2 ALA 57 HB2 ALA 57 2.702 4.190 5.777 492 HB3 ALA 57 HB3 ALA 57 4.193 3.637 4.989 493 H THR 58 H THR 58 3.162 7.285 3.470 494 HA THR 58 HA THR 58 0.737 8.265 4.555 495 HB THR 58 HB THR 58 2.598 9.642 2.577 496 HG1 THR 58 HG1 THR 58 3.664 10.339 4.446 497 HG21 THR 58 HG21 THR 58 0.736 10.743 4.728 498 HG22 THR 58 HG22 THR 58 1.918 11.701 3.803 499 HG23 THR 58 HG23 THR 58 0.563 10.937 2.967 500 H GLU 59 H GLU 59 1.681 7.851 1.098 501 HA GLU 59 HA GLU 59 -0.804 8.751 -0.026 502 HB2 GLU 59 HB2 GLU 59 1.370 6.865 -1.001 503 HB3 GLU 59 HB3 GLU 59 -0.063 7.210 -1.968 504 HG2 GLU 59 HG2 GLU 59 1.884 9.330 -0.978 505 HG3 GLU 59 HG3 GLU 59 1.914 8.594 -2.576 506 H LEU 60 H LEU 60 0.262 5.378 0.710 507 HA LEU 60 HA LEU 60 -2.175 4.102 0.025 508 HB2 LEU 60 HB2 LEU 60 -0.112 3.460 2.173 509 HB3 LEU 60 HB3 LEU 60 -1.405 2.367 1.721 510 HG LEU 60 HG LEU 60 0.886 3.288 -0.059 511 HD11 LEU 60 HD11 LEU 60 0.104 0.536 0.999 512 HD12 LEU 60 HD12 LEU 60 1.563 0.955 0.069 513 HD13 LEU 60 HD13 LEU 60 1.342 1.584 1.714 514 HD21 LEU 60 HD21 LEU 60 -1.057 3.013 -1.514 515 HD22 LEU 60 HD22 LEU 60 0.019 1.628 -1.710 516 HD23 LEU 60 HD23 LEU 60 -1.460 1.464 -0.738 517 H SER 61 H SER 61 -1.286 5.617 3.127 518 HA SER 61 HA SER 61 -3.637 5.050 4.591 519 HB2 SER 61 HB2 SER 61 -1.769 7.432 4.773 520 HB3 SER 61 HB3 SER 61 -2.957 6.966 5.990 521 HG SER 61 HG SER 61 -0.670 5.538 5.100 522 H LYS 62 H LYS 62 -3.101 7.416 2.082 523 HA LYS 62 HA LYS 62 -5.469 9.074 2.787 524 HB2 LYS 62 HB2 LYS 62 -3.340 9.251 0.623 525 HB3 LYS 62 HB3 LYS 62 -4.727 10.337 0.694 526 HG2 LYS 62 HG2 LYS 62 -4.023 11.354 2.699 527 HG3 LYS 62 HG3 LYS 62 -2.934 10.037 3.117 528 HD2 LYS 62 HD2 LYS 62 -1.631 11.952 2.400 529 HD3 LYS 62 HD3 LYS 62 -1.429 10.631 1.244 530 HE2 LYS 62 HE2 LYS 62 -3.185 11.738 -0.216 531 HE3 LYS 62 HE3 LYS 62 -3.210 13.093 0.922 532 HZ1 LYS 62 HZ1 LYS 62 -0.860 12.168 -0.661 533 HZ2 LYS 62 HZ2 LYS 62 -1.705 13.544 -0.917 534 HZ3 LYS 62 HZ3 LYS 62 -0.807 13.390 0.439 535 H ARG 63 H ARG 63 -4.588 6.611 0.425 536 HA ARG 63 HA ARG 63 -7.192 6.941 -1.007 537 HB2 ARG 63 HB2 ARG 63 -4.712 5.320 -1.669 538 HB3 ARG 63 HB3 ARG 63 -6.218 5.268 -2.585 539 HG2 ARG 63 HG2 ARG 63 -4.861 6.690 -3.826 540 HG3 ARG 63 HG3 ARG 63 -5.958 7.783 -2.974 541 HD2 ARG 63 HD2 ARG 63 -4.168 8.290 -1.330 542 HD3 ARG 63 HD3 ARG 63 -3.156 7.035 -2.064 543 HE ARG 63 HE ARG 63 -2.274 8.659 -3.338 544 HH11 ARG 63 HH11 ARG 63 -1.867 10.534 -4.023 545 HH12 ARG 63 HH12 ARG 63 -3.127 11.719 -4.365 546 HH21 ARG 63 HH21 ARG 63 -5.596 9.755 -2.935 547 HH22 ARG 63 HH22 ARG 63 -5.216 11.293 -3.662 548 H LEU 64 H LEU 64 -5.582 4.529 1.058 549 HA LEU 64 HA LEU 64 -7.894 2.686 0.873 550 HB2 LEU 64 HB2 LEU 64 -5.319 2.587 2.482 551 HB3 LEU 64 HB3 LEU 64 -6.526 1.329 2.502 552 HG LEU 64 HG LEU 64 -5.320 2.173 -0.139 553 HD11 LEU 64 HD11 LEU 64 -4.142 0.083 1.723 554 HD12 LEU 64 HD12 LEU 64 -3.588 0.536 0.088 555 HD13 LEU 64 HD13 LEU 64 -3.458 1.692 1.411 556 HD21 LEU 64 HD21 LEU 64 -7.293 0.660 -0.132 557 HD22 LEU 64 HD22 LEU 64 -5.832 -0.153 -0.731 558 HD23 LEU 64 HD23 LEU 64 -6.408 -0.467 0.918 559 H ASN 65 H ASN 65 -6.904 5.311 2.924 560 HA ASN 65 HA ASN 65 -7.717 6.193 4.817 561 HB2 ASN 65 HB2 ASN 65 -10.133 5.055 3.580 562 HB3 ASN 65 HB3 ASN 65 -10.279 5.171 5.322 563 HD21 ASN 65 HD21 ASN 65 -9.952 8.740 5.414 564 HD22 ASN 65 HD22 ASN 65 -9.489 7.290 6.302 565 H ILE 66 H ILE 66 -5.894 4.694 5.316 566 HA ILE 66 HA ILE 66 -6.536 3.166 7.797 567 HB ILE 66 HB ILE 66 -4.493 1.808 7.385 568 HG12 ILE 66 HG12 ILE 66 -4.548 3.070 4.614 569 HG13 ILE 66 HG13 ILE 66 -3.283 3.251 5.838 570 HG21 ILE 66 HG21 ILE 66 -6.567 1.526 5.183 571 HG22 ILE 66 HG22 ILE 66 -5.576 0.235 5.917 572 HG23 ILE 66 HG23 ILE 66 -6.825 1.058 6.872 573 HD11 ILE 66 HD11 ILE 66 -3.985 0.712 4.318 574 HD12 ILE 66 HD12 ILE 66 -2.570 1.744 4.099 575 HD13 ILE 66 HD13 ILE 66 -2.767 0.826 5.619 576 H THR 67 H THR 67 -4.709 3.205 9.384 577 HA THR 67 HA THR 67 -3.433 5.854 9.533 578 HB THR 67 HB THR 67 -4.200 4.865 11.599 579 HG1 THR 67 HG1 THR 67 -2.337 5.283 12.717 580 HG21 THR 67 HG21 THR 67 -2.033 2.751 11.262 581 HG22 THR 67 HG22 THR 67 -3.098 2.975 12.658 582 HG23 THR 67 HG23 THR 67 -3.776 2.433 11.117 583 H VAL 68 H VAL 68 -1.259 6.272 9.408 584 HA VAL 68 HA VAL 68 0.305 5.040 7.394 585 HB VAL 68 HB VAL 68 1.309 6.690 9.746 586 HG11 VAL 68 HG11 VAL 68 2.406 6.392 6.919 587 HG12 VAL 68 HG12 VAL 68 3.075 7.422 8.198 588 HG13 VAL 68 HG13 VAL 68 3.129 5.668 8.376 589 HG21 VAL 68 HG21 VAL 68 -0.506 7.939 8.642 590 HG22 VAL 68 HG22 VAL 68 1.050 8.658 8.231 591 HG23 VAL 68 HG23 VAL 68 0.219 7.621 7.052 592 H ASP 69 H ASP 69 0.054 4.317 10.825 593 HA ASP 69 HA ASP 69 2.380 2.639 10.872 594 HB2 ASP 69 HB2 ASP 69 1.414 3.868 12.844 595 HB3 ASP 69 HB3 ASP 69 0.021 2.788 12.805 596 H LYS 70 H LYS 70 -0.945 1.896 9.959 597 HA LYS 70 HA LYS 70 -0.252 -1.000 9.872 598 HB2 LYS 70 HB2 LYS 70 -2.790 0.496 9.078 599 HB3 LYS 70 HB3 LYS 70 -2.484 -1.219 8.743 600 HG2 LYS 70 HG2 LYS 70 -1.984 -1.459 11.271 601 HG3 LYS 70 HG3 LYS 70 -2.771 0.105 11.459 602 HD2 LYS 70 HD2 LYS 70 -4.013 -2.432 10.282 603 HD3 LYS 70 HD3 LYS 70 -4.252 -1.810 11.908 604 HE2 LYS 70 HE2 LYS 70 -6.112 -0.891 11.096 605 HE3 LYS 70 HE3 LYS 70 -5.040 0.386 10.523 606 HZ1 LYS 70 HZ1 LYS 70 -5.973 -1.979 8.942 607 HZ2 LYS 70 HZ2 LYS 70 -6.514 -0.459 8.764 608 HZ3 LYS 70 HZ3 LYS 70 -4.965 -0.831 8.358 609 H ALA 71 H ALA 71 -0.294 1.829 7.791 610 HA ALA 71 HA ALA 71 -0.087 0.317 5.302 611 HB1 ALA 71 HB1 ALA 71 0.720 3.185 5.972 612 HB2 ALA 71 HB2 ALA 71 0.531 2.505 4.343 613 HB3 ALA 71 HB3 ALA 71 -0.872 2.689 5.412 614 H LYS 72 H LYS 72 2.376 1.840 7.403 615 HA LYS 72 HA LYS 72 4.556 1.036 5.712 616 HB2 LYS 72 HB2 LYS 72 5.997 1.937 7.331 617 HB3 LYS 72 HB3 LYS 72 4.546 2.936 7.338 618 HG2 LYS 72 HG2 LYS 72 3.761 1.526 9.351 619 HG3 LYS 72 HG3 LYS 72 5.402 0.858 9.387 620 HD2 LYS 72 HD2 LYS 72 6.286 3.225 9.555 621 HD3 LYS 72 HD3 LYS 72 4.602 3.789 9.661 622 HE2 LYS 72 HE2 LYS 72 4.298 2.238 11.644 623 HE3 LYS 72 HE3 LYS 72 6.014 1.846 11.563 624 HZ1 LYS 72 HZ1 LYS 72 4.926 4.573 12.038 625 HZ2 LYS 72 HZ2 LYS 72 5.529 3.590 13.188 626 HZ3 LYS 72 HZ3 LYS 72 6.515 4.177 12.023 627 H THR 73 H THR 73 2.917 -0.791 8.227 628 HA THR 73 HA THR 73 5.037 -2.876 8.106 629 HB THR 73 HB THR 73 4.062 -2.103 10.284 630 HG1 THR 73 HG1 THR 73 4.199 -4.183 11.077 631 HG21 THR 73 HG21 THR 73 1.773 -3.987 9.574 632 HG22 THR 73 HG22 THR 73 2.030 -3.102 11.093 633 HG23 THR 73 HG23 THR 73 1.634 -2.215 9.616 634 H TYR 74 H TYR 74 1.643 -2.427 7.055 635 HA TYR 74 HA TYR 74 1.107 -5.057 6.187 636 HB2 TYR 74 HB2 TYR 74 -0.667 -3.482 6.234 637 HB3 TYR 74 HB3 TYR 74 0.233 -2.314 5.261 638 HD1 TYR 74 HD1 TYR 74 -1.470 -5.647 5.050 639 HD2 TYR 74 HD2 TYR 74 0.114 -2.223 2.949 640 HE1 TYR 74 HE1 TYR 74 -2.341 -6.558 2.894 641 HE2 TYR 74 HE2 TYR 74 -0.734 -3.129 0.821 642 HH TYR 74 HH TYR 74 -2.393 -6.321 0.628 643 H ILE 75 H ILE 75 2.733 -2.399 4.408 644 HA ILE 75 HA ILE 75 3.208 -3.557 1.922 645 HB ILE 75 HB ILE 75 4.875 -1.741 3.685 646 HG12 ILE 75 HG12 ILE 75 3.506 -1.020 1.074 647 HG13 ILE 75 HG13 ILE 75 2.640 -1.001 2.602 648 HG21 ILE 75 HG21 ILE 75 5.482 -2.493 0.773 649 HG22 ILE 75 HG22 ILE 75 6.283 -1.194 1.668 650 HG23 ILE 75 HG23 ILE 75 6.518 -2.847 2.176 651 HD11 ILE 75 HD11 ILE 75 5.155 0.640 2.027 652 HD12 ILE 75 HD12 ILE 75 3.503 1.248 2.089 653 HD13 ILE 75 HD13 ILE 75 4.265 0.614 3.551 654 H LYS 76 H LYS 76 5.535 -3.805 4.662 655 HA LYS 76 HA LYS 76 7.041 -5.850 3.280 656 HB2 LYS 76 HB2 LYS 76 8.557 -5.733 5.161 657 HB3 LYS 76 HB3 LYS 76 8.035 -4.096 4.764 658 HG2 LYS 76 HG2 LYS 76 6.349 -4.244 6.654 659 HG3 LYS 76 HG3 LYS 76 6.991 -5.840 7.050 660 HD2 LYS 76 HD2 LYS 76 7.996 -4.367 8.575 661 HD3 LYS 76 HD3 LYS 76 9.261 -4.726 7.387 662 HE2 LYS 76 HE2 LYS 76 8.722 -2.567 6.220 663 HE3 LYS 76 HE3 LYS 76 7.465 -2.249 7.422 664 HZ1 LYS 76 HZ1 LYS 76 10.366 -2.505 8.024 665 HZ2 LYS 76 HZ2 LYS 76 9.534 -1.104 7.979 666 HZ3 LYS 76 HZ3 LYS 76 9.203 -2.208 9.134 667 H ASN 77 H ASN 77 4.349 -6.182 5.457 668 HA ASN 77 HA ASN 77 5.026 -8.988 6.088 669 HB2 ASN 77 HB2 ASN 77 2.700 -7.163 6.750 670 HB3 ASN 77 HB3 ASN 77 2.573 -8.904 6.963 671 HD21 ASN 77 HD21 ASN 77 4.921 -6.796 9.545 672 HD22 ASN 77 HD22 ASN 77 4.318 -6.027 8.087 673 H SER 78 H SER 78 2.897 -7.303 3.805 674 HA SER 78 HA SER 78 1.837 -9.857 2.777 675 HB2 SER 78 HB2 SER 78 1.202 -6.973 2.094 676 HB3 SER 78 HB3 SER 78 0.355 -8.394 1.448 677 HG SER 78 HG SER 78 -0.442 -7.265 3.484 678 H ASN 79 H ASN 79 4.305 -7.578 1.789 679 HA ASN 79 HA ASN 79 4.983 -9.417 -0.406 680 HB2 ASN 79 HB2 ASN 79 5.300 -7.542 -2.009 681 HB3 ASN 79 HB3 ASN 79 3.633 -7.927 -1.624 682 HD21 ASN 79 HD21 ASN 79 5.124 -4.272 -0.533 683 HD22 ASN 79 HD22 ASN 79 6.224 -5.644 -0.707 684 H ARG 80 H ARG 80 6.460 -9.852 1.517 685 HA ARG 80 HA ARG 80 8.559 -7.983 2.078 686 HB2 ARG 80 HB2 ARG 80 7.861 -9.929 3.563 687 HB3 ARG 80 HB3 ARG 80 8.628 -11.017 2.426 688 HG2 ARG 80 HG2 ARG 80 10.094 -10.600 4.323 689 HG3 ARG 80 HG3 ARG 80 10.825 -9.968 2.851 690 HD2 ARG 80 HD2 ARG 80 10.055 -7.665 3.489 691 HD3 ARG 80 HD3 ARG 80 9.369 -8.317 4.974 692 HE ARG 80 HE ARG 80 12.227 -7.943 4.269 693 HH11 ARG 80 HH11 ARG 80 13.726 -7.921 5.891 694 HH12 ARG 80 HH12 ARG 80 13.292 -8.450 7.490 695 HH21 ARG 80 HH21 ARG 80 10.033 -9.182 6.706 696 HH22 ARG 80 HH22 ARG 80 11.255 -9.144 7.948 697 H MET 81 H MET 81 8.518 -10.789 -0.052 698 HA MET 81 HA MET 81 11.140 -9.954 -1.268 699 HB2 MET 81 HB2 MET 81 9.896 -12.721 -1.014 700 HB3 MET 81 HB3 MET 81 11.408 -12.344 -1.853 701 HG2 MET 81 HG2 MET 81 12.355 -11.456 0.267 702 HG3 MET 81 HG3 MET 81 10.870 -11.914 1.110 703 HE1 MET 81 HE1 MET 81 12.263 -13.230 2.910 704 HE2 MET 81 HE2 MET 81 13.477 -14.467 2.513 705 HE3 MET 81 HE3 MET 81 13.766 -12.769 2.074 706 H GLY 82 H GLY 82 7.827 -10.992 -2.049 707 HA2 GLY 82 HA2 GLY 82 7.883 -9.499 -4.535 708 HA3 GLY 82 HA3 GLY 82 7.899 -11.257 -4.822 709 H ARG 83 H ARG 83 6.332 -12.508 -3.551 710 HA ARG 83 HA ARG 83 3.894 -11.041 -2.648 711 HB2 ARG 83 HB2 ARG 83 3.828 -13.695 -4.149 712 HB3 ARG 83 HB3 ARG 83 2.481 -12.938 -3.298 713 HG2 ARG 83 HG2 ARG 83 2.020 -12.269 -5.427 714 HG3 ARG 83 HG3 ARG 83 2.946 -10.879 -4.865 715 HD2 ARG 83 HD2 ARG 83 4.987 -11.884 -5.984 716 HD3 ARG 83 HD3 ARG 83 3.984 -13.197 -6.573 717 HE ARG 83 HE ARG 83 4.017 -10.374 -7.466 718 HH11 ARG 83 HH11 ARG 83 3.081 -9.851 -9.398 719 HH12 ARG 83 HH12 ARG 83 2.045 -10.991 -10.204 720 HH21 ARG 83 HH21 ARG 83 2.363 -13.448 -7.834 721 HH22 ARG 83 HH22 ARG 83 1.647 -12.974 -9.349 722 H THR 84 H THR 84 4.271 -14.443 -2.373 723 HA THR 84 HA THR 84 4.762 -14.230 0.574 724 HB THR 84 HB THR 84 2.798 -15.677 0.970 725 HG1 THR 84 HG1 THR 84 1.329 -15.924 -0.746 726 HG21 THR 84 HG21 THR 84 2.006 -13.236 -0.656 727 HG22 THR 84 HG22 THR 84 1.121 -13.999 0.686 728 HG23 THR 84 HG23 THR 84 2.657 -13.157 0.996 729 H ASN 85 H ASN 85 6.567 -15.233 -1.442 730 HA ASN 85 HA ASN 85 7.968 -16.963 -1.864 731 HB2 ASN 85 HB2 ASN 85 7.167 -17.743 0.958 732 HB3 ASN 85 HB3 ASN 85 8.539 -18.417 0.090 733 HD21 ASN 85 HD21 ASN 85 10.571 -15.522 0.467 734 HD22 ASN 85 HD22 ASN 85 10.356 -17.013 -0.438 735 H ASN 86 H ASN 86 4.966 -17.479 -2.497 736 HA ASN 86 HA ASN 86 4.800 -20.378 -2.557 737 HB2 ASN 86 HB2 ASN 86 2.706 -20.031 -3.732 738 HB3 ASN 86 HB3 ASN 86 2.813 -18.973 -2.330 739 HD21 ASN 86 HD21 ASN 86 2.528 -16.041 -4.266 740 HD22 ASN 86 HD22 ASN 86 2.658 -16.732 -2.653 741 H PHE 87 H PHE 87 6.565 -18.271 -4.518 742 HA PHE 87 HA PHE 87 6.411 -19.645 -7.032 743 HB2 PHE 87 HB2 PHE 87 8.195 -18.200 -7.711 744 HB3 PHE 87 HB3 PHE 87 7.044 -17.278 -6.765 745 HD1 PHE 87 HD1 PHE 87 10.464 -18.651 -6.892 746 HD2 PHE 87 HD2 PHE 87 7.665 -16.348 -4.554 747 HE1 PHE 87 HE1 PHE 87 12.302 -17.954 -5.374 748 HE2 PHE 87 HE2 PHE 87 9.519 -15.620 -3.062 749 HZ PHE 87 HZ PHE 87 11.831 -16.439 -3.455 750 H LYS 88 H LYS 88 7.165 -21.213 -4.503 751 HA LYS 88 HA LYS 88 9.796 -22.418 -5.095 752 HB2 LYS 88 HB2 LYS 88 9.460 -23.568 -2.962 753 HB3 LYS 88 HB3 LYS 88 9.252 -21.820 -2.795 754 HG2 LYS 88 HG2 LYS 88 6.730 -22.202 -2.983 755 HG3 LYS 88 HG3 LYS 88 7.059 -23.938 -2.899 756 HD2 LYS 88 HD2 LYS 88 7.932 -23.731 -0.647 757 HD3 LYS 88 HD3 LYS 88 8.000 -21.968 -0.780 758 HE2 LYS 88 HE2 LYS 88 6.066 -22.431 0.516 759 HE3 LYS 88 HE3 LYS 88 5.520 -21.895 -1.074 760 HZ1 LYS 88 HZ1 LYS 88 5.667 -24.735 -0.169 761 HZ2 LYS 88 HZ2 LYS 88 4.293 -23.868 -0.309 762 HZ3 LYS 88 HZ3 LYS 88 5.149 -24.261 -1.644 763 H THR 89 H THR 89 6.563 -22.877 -5.899 764 HA THR 89 HA THR 89 6.982 -25.696 -6.804 765 HB THR 89 HB THR 89 4.408 -24.466 -5.733 766 HG1 THR 89 HG1 THR 89 4.793 -25.938 -3.996 767 HG21 THR 89 HG21 THR 89 5.231 -27.290 -6.492 768 HG22 THR 89 HG22 THR 89 3.694 -26.847 -5.687 769 HG23 THR 89 HG23 THR 89 4.040 -26.266 -7.326 770 H ILE 90 H ILE 90 5.171 -22.645 -7.326 771 HA ILE 90 HA ILE 90 4.515 -23.234 -10.124 772 HB ILE 90 HB ILE 90 4.593 -20.568 -8.665 773 HG12 ILE 90 HG12 ILE 90 2.301 -22.567 -8.943 774 HG13 ILE 90 HG13 ILE 90 3.121 -22.130 -7.446 775 HG21 ILE 90 HG21 ILE 90 3.035 -21.381 -11.153 776 HG22 ILE 90 HG22 ILE 90 2.978 -19.794 -10.359 777 HG23 ILE 90 HG23 ILE 90 4.452 -20.306 -11.123 778 HD11 ILE 90 HD11 ILE 90 1.251 -20.365 -9.042 779 HD12 ILE 90 HD12 ILE 90 1.045 -21.009 -7.411 780 HD13 ILE 90 HD13 ILE 90 2.283 -19.773 -7.713 781 H LYS 91 H LYS 91 5.513 -22.059 -11.906 782 HA LYS 91 HA LYS 91 7.176 -21.385 -13.206 783 HB2 LYS 91 HB2 LYS 91 6.704 -19.502 -11.486 784 HB3 LYS 91 HB3 LYS 91 8.300 -19.845 -10.851 785 HG2 LYS 91 HG2 LYS 91 9.364 -18.903 -12.616 786 HG3 LYS 91 HG3 LYS 91 8.210 -19.528 -13.809 787 HD2 LYS 91 HD2 LYS 91 7.621 -17.179 -11.959 788 HD3 LYS 91 HD3 LYS 91 8.244 -17.019 -13.611 789 HE2 LYS 91 HE2 LYS 91 6.273 -18.195 -14.515 790 HE3 LYS 91 HE3 LYS 91 5.631 -18.431 -12.888 791 HZ1 LYS 91 HZ1 LYS 91 6.053 -15.789 -14.178 792 HZ2 LYS 91 HZ2 LYS 91 4.610 -16.518 -13.964 793 HZ3 LYS 91 HZ3 LYS 91 5.462 -16.010 -12.668 794 H MET 92 H MET 92 8.203 -23.456 -10.756 795 HA MET 92 HA MET 92 11.013 -23.540 -11.613 796 HB2 MET 92 HB2 MET 92 11.312 -25.313 -10.059 797 HB3 MET 92 HB3 MET 92 10.356 -24.051 -9.282 798 HG2 MET 92 HG2 MET 92 8.314 -25.363 -9.606 799 HG3 MET 92 HG3 MET 92 9.198 -26.589 -10.516 800 HE1 MET 92 HE1 MET 92 8.341 -28.589 -9.210 801 HE2 MET 92 HE2 MET 92 8.281 -28.674 -7.437 802 HE3 MET 92 HE3 MET 92 7.286 -27.483 -8.306 803 H PHE 93 H PHE 93 8.074 -25.249 -12.502 804 HA PHE 93 HA PHE 93 9.608 -27.164 -14.186 805 HB2 PHE 93 HB2 PHE 93 7.751 -28.625 -14.015 806 HB3 PHE 93 HB3 PHE 93 8.115 -28.052 -12.399 807 HD1 PHE 93 HD1 PHE 93 5.673 -27.918 -15.190 808 HD2 PHE 93 HD2 PHE 93 6.531 -26.669 -11.150 809 HE1 PHE 93 HE1 PHE 93 3.298 -27.248 -14.885 810 HE2 PHE 93 HE2 PHE 93 4.160 -26.003 -10.856 811 HZ PHE 93 HZ PHE 93 2.540 -26.294 -12.721 812 H GLU 94 H GLU 94 7.725 -24.364 -14.473 813 HA GLU 94 HA GLU 94 6.504 -24.961 -17.084 814 HB2 GLU 94 HB2 GLU 94 6.443 -22.484 -15.316 815 HB3 GLU 94 HB3 GLU 94 5.463 -22.736 -16.764 816 HG2 GLU 94 HG2 GLU 94 4.279 -24.595 -15.723 817 HG3 GLU 94 HG3 GLU 94 5.321 -24.519 -14.296 818 H ASP 95 H ASP 95 6.659 -23.378 -18.858 819 HA ASP 95 HA ASP 95 7.827 -22.348 -20.506 820 HB2 ASP 95 HB2 ASP 95 7.592 -20.580 -18.660 821 HB3 ASP 95 HB3 ASP 95 9.308 -20.824 -18.354 822 H ASP 96 H ASP 96 10.690 -21.364 -20.363 823 HA ASP 96 HA ASP 96 11.993 -23.896 -21.094 824 HB2 ASP 96 HB2 ASP 96 12.995 -21.031 -20.987 825 HB3 ASP 96 HB3 ASP 96 13.985 -22.410 -21.462 826 H VAL 97 H VAL 97 13.102 -25.173 -19.799 827 HA VAL 97 HA VAL 97 14.171 -24.157 -17.182 828 HB VAL 97 HB VAL 97 12.941 -26.885 -17.728 829 HG11 VAL 97 HG11 VAL 97 13.967 -25.641 -15.137 830 HG12 VAL 97 HG12 VAL 97 13.081 -27.175 -15.263 831 HG13 VAL 97 HG13 VAL 97 14.679 -27.030 -15.991 832 HG21 VAL 97 HG21 VAL 97 11.175 -25.179 -17.620 833 HG22 VAL 97 HG22 VAL 97 11.156 -26.162 -16.159 834 HG23 VAL 97 HG23 VAL 97 11.861 -24.532 -16.116 835 H SER 98 H SER 98 14.648 -26.580 -19.767 836 HA SER 98 HA SER 98 17.561 -26.578 -19.137 837 HB2 SER 98 HB2 SER 98 16.195 -28.615 -18.327 838 HB3 SER 98 HB3 SER 98 16.122 -29.080 -20.034 839 HG SER 98 HG SER 98 17.934 -29.987 -18.909 840 H SER 99 H SER 99 16.246 -24.942 -21.033 841 HA SER 99 HA SER 99 16.276 -24.239 -23.187 842 HB2 SER 99 HB2 SER 99 18.714 -24.299 -22.419 843 HB3 SER 99 HB3 SER 99 18.911 -25.685 -23.502 844 HG SER 99 HG SER 99 19.396 -23.668 -24.519 845 H ALA 100 H ALA 100 14.587 -26.294 -23.032 846 HA ALA 100 HA ALA 100 15.067 -28.315 -25.095 847 HB1 ALA 100 HB1 ALA 100 12.619 -27.752 -23.373 848 HB2 ALA 100 HB2 ALA 100 12.942 -29.220 -24.321 849 HB3 ALA 100 HB3 ALA 100 13.968 -28.831 -22.934 850 H SER 101 H SER 101 13.123 -28.814 -26.580 851 HA SER 101 HA SER 101 11.847 -26.470 -27.848 852 HB2 SER 101 HB2 SER 101 13.728 -28.334 -29.358 853 HB3 SER 101 HB3 SER 101 12.631 -27.154 -30.096 854 HG SER 101 HG SER 101 14.779 -26.350 -29.887 855 H ALA 102 H ALA 102 9.901 -27.042 -28.763 856 HA ALA 102 HA ALA 102 7.984 -28.228 -28.897 857 HB1 ALA 102 HB1 ALA 102 9.759 -30.353 -30.123 858 HB2 ALA 102 HB2 ALA 102 8.007 -30.166 -30.349 859 HB3 ALA 102 HB3 ALA 102 9.115 -28.921 -30.963 860 H GLN 103 H GLN 103 9.160 -28.337 -26.406 861 HA GLN 103 HA GLN 103 8.093 -30.900 -25.277 862 HB2 GLN 103 HB2 GLN 103 10.456 -29.277 -24.348 863 HB3 GLN 103 HB3 GLN 103 9.688 -30.533 -23.377 864 HG2 GLN 103 HG2 GLN 103 10.930 -31.012 -26.115 865 HG3 GLN 103 HG3 GLN 103 11.715 -31.322 -24.577 866 HE21 GLN 103 HE21 GLN 103 8.905 -33.982 -25.945 867 HE22 GLN 103 HE22 GLN 103 9.036 -32.405 -26.721 868 HA PRO 104 HA PRO 104 5.443 -27.555 -23.516 869 HB2 PRO 104 HB2 PRO 104 3.011 -28.732 -23.867 870 HB3 PRO 104 HB3 PRO 104 3.874 -27.866 -25.172 871 HG2 PRO 104 HG2 PRO 104 3.809 -30.858 -24.660 872 HG3 PRO 104 HG3 PRO 104 3.541 -29.990 -26.203 873 HD2 PRO 104 HD2 PRO 104 5.954 -31.075 -25.533 874 HD3 PRO 104 HD3 PRO 104 5.831 -29.556 -26.470 875 H ASN 105 H ASN 105 6.274 -27.836 -21.486 876 HA ASN 105 HA ASN 105 5.504 -30.196 -19.845 877 HB2 ASN 105 HB2 ASN 105 7.711 -28.124 -19.566 878 HB3 ASN 105 HB3 ASN 105 7.410 -29.422 -18.415 879 HD21 ASN 105 HD21 ASN 105 10.072 -30.475 -20.845 880 HD22 ASN 105 HD22 ASN 105 9.863 -29.022 -19.878 881 H LEU 106 H LEU 106 3.295 -28.980 -19.980 882 HA LEU 106 HA LEU 106 2.967 -27.473 -17.429 883 HB2 LEU 106 HB2 LEU 106 3.104 -26.062 -19.615 884 HB3 LEU 106 HB3 LEU 106 1.463 -26.606 -19.903 885 HG LEU 106 HG LEU 106 2.500 -25.097 -17.453 886 HD11 LEU 106 HD11 LEU 106 0.733 -24.173 -19.756 887 HD12 LEU 106 HD12 LEU 106 1.233 -23.196 -18.357 888 HD13 LEU 106 HD13 LEU 106 2.444 -23.752 -19.520 889 HD21 LEU 106 HD21 LEU 106 0.562 -26.421 -16.763 890 HD22 LEU 106 HD22 LEU 106 0.115 -24.720 -16.874 891 HD23 LEU 106 HD23 LEU 106 -0.367 -25.841 -18.166 892 HA PRO 107 HA PRO 107 -0.022 -31.050 -17.683 893 HB2 PRO 107 HB2 PRO 107 0.454 -32.078 -15.187 894 HB3 PRO 107 HB3 PRO 107 1.427 -32.493 -16.631 895 HG2 PRO 107 HG2 PRO 107 2.049 -30.416 -14.502 896 HG3 PRO 107 HG3 PRO 107 3.129 -31.689 -15.157 897 HD2 PRO 107 HD2 PRO 107 3.223 -29.152 -16.090 898 HD3 PRO 107 HD3 PRO 107 3.404 -30.537 -17.201 Start of MODEL 10 1 H1 GLY -5 H1 GLY -5 -18.916 -16.594 -35.782 2 H2 GLY -5 H2 GLY -5 -17.972 -17.449 -34.751 3 H3 GLY -5 H3 GLY -5 -18.095 -15.822 -34.594 4 HA2 GLY -5 HA2 GLY -5 -20.280 -17.761 -34.174 5 HA3 GLY -5 HA3 GLY -5 -19.401 -16.908 -32.892 6 H SER -4 H SER -4 -21.168 -15.819 -32.063 7 HA SER -4 HA SER -4 -22.374 -13.646 -33.739 8 HB2 SER -4 HB2 SER -4 -23.819 -15.409 -31.724 9 HB3 SER -4 HB3 SER -4 -24.508 -14.011 -32.568 10 HG SER -4 HG SER -4 -25.022 -16.028 -33.579 11 H HIS -3 H HIS -3 -22.650 -11.684 -32.742 12 HA HIS -3 HA HIS -3 -22.227 -11.399 -29.826 13 HB2 HIS -3 HB2 HIS -3 -20.010 -11.246 -31.245 14 HB3 HIS -3 HB3 HIS -3 -20.586 -9.651 -31.683 15 HD2 HIS -3 HD2 HIS -3 -21.768 -9.185 -28.477 16 HE1 HIS -3 HE1 HIS -3 -17.611 -9.341 -27.557 17 HE2 HIS -3 HE2 HIS -3 -19.913 -8.693 -26.686 18 H MET -2 H MET -2 -23.957 -10.278 -29.186 19 HA MET -2 HA MET -2 -24.884 -7.867 -30.687 20 HB2 MET -2 HB2 MET -2 -26.629 -10.180 -29.744 21 HB3 MET -2 HB3 MET -2 -27.237 -8.598 -30.259 22 HG2 MET -2 HG2 MET -2 -26.172 -8.913 -32.476 23 HG3 MET -2 HG3 MET -2 -25.670 -10.537 -31.990 24 HE1 MET -2 HE1 MET -2 -26.797 -11.404 -34.251 25 HE2 MET -2 HE2 MET -2 -28.501 -11.120 -34.673 26 HE3 MET -2 HE3 MET -2 -27.358 -9.759 -34.633 27 H ALA -1 H ALA -1 -23.437 -7.061 -28.931 28 HA ALA -1 HA ALA -1 -25.052 -6.395 -26.503 29 HB1 ALA -1 HB1 ALA -1 -22.126 -7.265 -26.480 30 HB2 ALA -1 HB2 ALA -1 -23.083 -6.724 -25.083 31 HB3 ALA -1 HB3 ALA -1 -23.506 -8.230 -25.912 32 H SER 0 H SER 0 -22.069 -5.582 -28.278 33 HA SER 0 HA SER 0 -21.045 -3.722 -28.932 34 HB2 SER 0 HB2 SER 0 -23.236 -3.162 -29.904 35 HB3 SER 0 HB3 SER 0 -23.635 -2.234 -28.446 36 HG SER 0 HG SER 0 -22.742 -0.931 -30.134 37 H MET 1 H MET 1 -22.945 -2.886 -26.046 38 HA MET 1 HA MET 1 -21.015 -0.817 -25.290 39 HB2 MET 1 HB2 MET 1 -23.552 -1.793 -23.924 40 HB3 MET 1 HB3 MET 1 -22.652 -0.330 -23.488 41 HG2 MET 1 HG2 MET 1 -23.090 0.595 -25.755 42 HG3 MET 1 HG3 MET 1 -24.025 -0.851 -26.157 43 HE1 MET 1 HE1 MET 1 -26.148 0.402 -26.886 44 HE2 MET 1 HE2 MET 1 -26.892 1.728 -25.967 45 HE3 MET 1 HE3 MET 1 -25.267 1.930 -26.658 46 H ASP 2 H ASP 2 -21.465 -4.040 -24.458 47 HA ASP 2 HA ASP 2 -20.156 -3.907 -21.806 48 HB2 ASP 2 HB2 ASP 2 -21.391 -6.203 -23.365 49 HB3 ASP 2 HB3 ASP 2 -20.736 -6.339 -21.736 50 H GLN 3 H GLN 3 -18.903 -3.915 -24.815 51 HA GLN 3 HA GLN 3 -16.554 -5.614 -24.138 52 HB2 GLN 3 HB2 GLN 3 -16.523 -6.494 -26.414 53 HB3 GLN 3 HB3 GLN 3 -17.976 -6.892 -25.525 54 HG2 GLN 3 HG2 GLN 3 -18.839 -6.423 -27.600 55 HG3 GLN 3 HG3 GLN 3 -19.124 -4.917 -26.765 56 HE21 GLN 3 HE21 GLN 3 -17.429 -3.192 -29.369 57 HE22 GLN 3 HE22 GLN 3 -18.638 -3.145 -28.090 58 H LEU 4 H LEU 4 -16.802 -2.785 -23.791 59 HA LEU 4 HA LEU 4 -14.918 -1.688 -25.826 60 HB2 LEU 4 HB2 LEU 4 -16.660 -0.220 -23.819 61 HB3 LEU 4 HB3 LEU 4 -15.677 0.499 -25.093 62 HG LEU 4 HG LEU 4 -18.121 -1.287 -25.482 63 HD11 LEU 4 HD11 LEU 4 -17.680 1.664 -26.066 64 HD12 LEU 4 HD12 LEU 4 -19.155 0.727 -26.400 65 HD13 LEU 4 HD13 LEU 4 -18.639 0.992 -24.725 66 HD21 LEU 4 HD21 LEU 4 -16.555 -1.693 -27.306 67 HD22 LEU 4 HD22 LEU 4 -17.903 -0.710 -27.889 68 HD23 LEU 4 HD23 LEU 4 -16.332 0.058 -27.552 69 H ASP 5 H ASP 5 -15.357 -1.188 -22.300 70 HA ASP 5 HA ASP 5 -12.380 -1.277 -21.942 71 HB2 ASP 5 HB2 ASP 5 -14.350 0.840 -20.999 72 HB3 ASP 5 HB3 ASP 5 -12.707 0.698 -20.387 73 H GLU 6 H GLU 6 -15.190 -2.740 -20.946 74 HA GLU 6 HA GLU 6 -14.387 -2.996 -18.084 75 HB2 GLU 6 HB2 GLU 6 -17.004 -3.307 -19.559 76 HB3 GLU 6 HB3 GLU 6 -16.740 -4.155 -18.015 77 HG2 GLU 6 HG2 GLU 6 -16.054 -2.140 -16.923 78 HG3 GLU 6 HG3 GLU 6 -16.223 -1.205 -18.416 79 H ILE 7 H ILE 7 -12.553 -4.228 -18.616 80 HA ILE 7 HA ILE 7 -13.273 -7.088 -18.798 81 HB ILE 7 HB ILE 7 -10.688 -6.046 -20.017 82 HG12 ILE 7 HG12 ILE 7 -12.118 -6.762 -22.225 83 HG13 ILE 7 HG13 ILE 7 -13.426 -6.089 -21.264 84 HG21 ILE 7 HG21 ILE 7 -12.257 -8.642 -20.359 85 HG22 ILE 7 HG22 ILE 7 -10.696 -8.246 -21.111 86 HG23 ILE 7 HG23 ILE 7 -10.800 -8.439 -19.360 87 HD11 ILE 7 HD11 ILE 7 -10.843 -4.707 -22.113 88 HD12 ILE 7 HD12 ILE 7 -12.488 -4.361 -22.685 89 HD13 ILE 7 HD13 ILE 7 -12.026 -3.977 -21.015 90 H ILE 8 H ILE 8 -13.386 -7.025 -16.564 91 HA ILE 8 HA ILE 8 -10.801 -7.225 -15.100 92 HB ILE 8 HB ILE 8 -13.255 -5.717 -14.103 93 HG12 ILE 8 HG12 ILE 8 -10.529 -4.639 -14.961 94 HG13 ILE 8 HG13 ILE 8 -12.056 -4.399 -15.811 95 HG21 ILE 8 HG21 ILE 8 -10.520 -6.135 -12.806 96 HG22 ILE 8 HG22 ILE 8 -11.844 -5.151 -12.143 97 HG23 ILE 8 HG23 ILE 8 -12.053 -6.875 -12.284 98 HD11 ILE 8 HD11 ILE 8 -11.295 -3.215 -13.131 99 HD12 ILE 8 HD12 ILE 8 -11.602 -2.387 -14.660 100 HD13 ILE 8 HD13 ILE 8 -12.946 -3.173 -13.808 101 H GLU 9 H GLU 9 -10.761 -8.843 -13.583 102 HA GLU 9 HA GLU 9 -11.155 -10.906 -12.751 103 HB2 GLU 9 HB2 GLU 9 -13.951 -9.789 -12.369 104 HB3 GLU 9 HB3 GLU 9 -13.454 -11.351 -11.751 105 HG2 GLU 9 HG2 GLU 9 -12.014 -8.777 -11.016 106 HG3 GLU 9 HG3 GLU 9 -13.365 -9.443 -10.114 107 H GLN 10 H GLN 10 -12.898 -12.897 -12.854 108 HA GLN 10 HA GLN 10 -13.068 -13.569 -15.758 109 HB2 GLN 10 HB2 GLN 10 -11.104 -14.530 -14.609 110 HB3 GLN 10 HB3 GLN 10 -12.178 -15.368 -13.480 111 HG2 GLN 10 HG2 GLN 10 -13.167 -16.648 -15.356 112 HG3 GLN 10 HG3 GLN 10 -12.198 -15.734 -16.512 113 HE21 GLN 10 HE21 GLN 10 -10.392 -18.911 -16.105 114 HE22 GLN 10 HE22 GLN 10 -11.872 -18.330 -16.855 115 H ILE 11 H ILE 11 -14.674 -14.899 -16.455 116 HA ILE 11 HA ILE 11 -17.141 -14.803 -14.799 117 HB ILE 11 HB ILE 11 -18.322 -14.318 -16.890 118 HG12 ILE 11 HG12 ILE 11 -15.571 -14.043 -18.206 119 HG13 ILE 11 HG13 ILE 11 -16.645 -15.416 -18.465 120 HG21 ILE 11 HG21 ILE 11 -16.000 -12.405 -16.386 121 HG22 ILE 11 HG22 ILE 11 -17.611 -11.998 -17.010 122 HG23 ILE 11 HG23 ILE 11 -17.429 -12.553 -15.344 123 HD11 ILE 11 HD11 ILE 11 -17.228 -12.523 -19.211 124 HD12 ILE 11 HD12 ILE 11 -16.891 -13.877 -20.302 125 HD13 ILE 11 HD13 ILE 11 -18.393 -13.865 -19.354 126 H GLN 12 H GLN 12 -15.785 -17.055 -14.447 127 HA GLN 12 HA GLN 12 -16.766 -19.217 -16.179 128 HB2 GLN 12 HB2 GLN 12 -15.403 -20.658 -14.912 129 HB3 GLN 12 HB3 GLN 12 -14.462 -19.207 -15.207 130 HG2 GLN 12 HG2 GLN 12 -15.872 -19.888 -12.576 131 HG3 GLN 12 HG3 GLN 12 -14.178 -20.172 -12.929 132 HE21 GLN 12 HE21 GLN 12 -15.352 -16.365 -11.982 133 HE22 GLN 12 HE22 GLN 12 -16.568 -17.615 -12.198 134 H LYS 13 H LYS 13 -17.715 -21.175 -15.030 135 HA LYS 13 HA LYS 13 -20.238 -20.455 -13.805 136 HB2 LYS 13 HB2 LYS 13 -19.757 -22.277 -15.550 137 HB3 LYS 13 HB3 LYS 13 -19.122 -23.249 -14.219 138 HG2 LYS 13 HG2 LYS 13 -21.475 -22.750 -13.097 139 HG3 LYS 13 HG3 LYS 13 -21.961 -22.272 -14.720 140 HD2 LYS 13 HD2 LYS 13 -20.853 -24.988 -13.874 141 HD3 LYS 13 HD3 LYS 13 -22.550 -24.615 -14.211 142 HE2 LYS 13 HE2 LYS 13 -21.994 -24.101 -16.567 143 HE3 LYS 13 HE3 LYS 13 -20.282 -24.428 -16.249 144 HZ1 LYS 13 HZ1 LYS 13 -22.464 -26.430 -15.999 145 HZ2 LYS 13 HZ2 LYS 13 -21.382 -26.363 -17.217 146 HZ3 LYS 13 HZ3 LYS 13 -20.884 -26.725 -15.708 147 H GLU 14 H GLU 14 -18.703 -19.433 -11.996 148 HA GLU 14 HA GLU 14 -19.041 -21.186 -9.607 149 HB2 GLU 14 HB2 GLU 14 -16.594 -19.525 -10.295 150 HB3 GLU 14 HB3 GLU 14 -17.022 -19.945 -8.631 151 HG2 GLU 14 HG2 GLU 14 -17.000 -22.323 -9.164 152 HG3 GLU 14 HG3 GLU 14 -16.592 -21.975 -10.849 153 H ALA 15 H ALA 15 -20.085 -20.320 -8.036 154 HA ALA 15 HA ALA 15 -20.068 -17.446 -7.506 155 HB1 ALA 15 HB1 ALA 15 -22.683 -18.913 -8.061 156 HB2 ALA 15 HB2 ALA 15 -22.548 -17.283 -7.358 157 HB3 ALA 15 HB3 ALA 15 -21.977 -17.590 -9.007 158 H ILE 16 H ILE 16 -22.291 -19.914 -6.305 159 HA ILE 16 HA ILE 16 -21.094 -19.705 -3.580 160 HB ILE 16 HB ILE 16 -23.950 -19.504 -4.533 161 HG12 ILE 16 HG12 ILE 16 -22.238 -17.573 -2.906 162 HG13 ILE 16 HG13 ILE 16 -22.573 -17.439 -4.629 163 HG21 ILE 16 HG21 ILE 16 -23.012 -19.764 -1.638 164 HG22 ILE 16 HG22 ILE 16 -24.644 -19.231 -2.105 165 HG23 ILE 16 HG23 ILE 16 -24.132 -20.845 -2.506 166 HD11 ILE 16 HD11 ILE 16 -24.565 -17.052 -2.389 167 HD12 ILE 16 HD12 ILE 16 -23.993 -15.891 -3.590 168 HD13 ILE 16 HD13 ILE 16 -25.028 -17.239 -4.102 169 H ASN 17 H ASN 17 -21.120 -21.753 -5.873 170 HA ASN 17 HA ASN 17 -22.122 -24.125 -4.426 171 HB2 ASN 17 HB2 ASN 17 -20.991 -23.864 -7.246 172 HB3 ASN 17 HB3 ASN 17 -21.714 -25.318 -6.566 173 HD21 ASN 17 HD21 ASN 17 -24.155 -22.724 -8.312 174 HD22 ASN 17 HD22 ASN 17 -22.418 -22.765 -8.565 175 H SER 18 H SER 18 -19.274 -22.466 -4.415 176 HA SER 18 HA SER 18 -17.515 -24.870 -4.094 177 HB2 SER 18 HB2 SER 18 -15.668 -23.264 -4.593 178 HB3 SER 18 HB3 SER 18 -16.808 -23.522 -5.925 179 HG SER 18 HG SER 18 -16.331 -21.300 -5.622 180 H ASN 19 H ASN 19 -17.720 -21.533 -2.847 181 HA ASN 19 HA ASN 19 -16.240 -21.892 -0.500 182 HB2 ASN 19 HB2 ASN 19 -17.266 -19.744 0.194 183 HB3 ASN 19 HB3 ASN 19 -16.721 -19.711 -1.476 184 HD21 ASN 19 HD21 ASN 19 -20.037 -18.114 -1.480 185 HD22 ASN 19 HD22 ASN 19 -18.470 -17.754 -0.757 186 H VAL 20 H VAL 20 -19.536 -22.727 -0.986 187 HA VAL 20 HA VAL 20 -20.119 -23.212 1.876 188 HB VAL 20 HB VAL 20 -21.756 -23.621 -0.648 189 HG11 VAL 20 HG11 VAL 20 -22.620 -24.005 2.249 190 HG12 VAL 20 HG12 VAL 20 -23.727 -23.880 0.863 191 HG13 VAL 20 HG13 VAL 20 -22.612 -25.237 0.964 192 HG21 VAL 20 HG21 VAL 20 -21.398 -21.250 -0.001 193 HG22 VAL 20 HG22 VAL 20 -23.076 -21.722 0.234 194 HG23 VAL 20 HG23 VAL 20 -21.987 -21.602 1.634 195 H VAL 21 H VAL 21 -18.778 -25.014 -0.753 196 HA VAL 21 HA VAL 21 -19.221 -27.625 0.629 197 HB VAL 21 HB VAL 21 -19.286 -27.304 -2.387 198 HG11 VAL 21 HG11 VAL 21 -20.206 -29.541 -0.511 199 HG12 VAL 21 HG12 VAL 21 -20.319 -29.549 -2.284 200 HG13 VAL 21 HG13 VAL 21 -18.737 -29.582 -1.506 201 HG21 VAL 21 HG21 VAL 21 -21.255 -26.110 -1.566 202 HG22 VAL 21 HG22 VAL 21 -21.748 -27.668 -2.217 203 HG23 VAL 21 HG23 VAL 21 -21.644 -27.447 -0.457 204 H LEU 22 H LEU 22 -17.137 -26.644 1.477 205 HA LEU 22 HA LEU 22 -14.786 -27.466 -0.168 206 HB2 LEU 22 HB2 LEU 22 -15.276 -25.282 1.821 207 HB3 LEU 22 HB3 LEU 22 -13.692 -26.038 1.883 208 HG LEU 22 HG LEU 22 -14.858 -24.932 -0.698 209 HD11 LEU 22 HD11 LEU 22 -12.956 -23.593 1.270 210 HD12 LEU 22 HD12 LEU 22 -13.448 -22.955 -0.316 211 HD13 LEU 22 HD13 LEU 22 -14.646 -23.126 0.978 212 HD21 LEU 22 HD21 LEU 22 -13.007 -26.538 -1.024 213 HD22 LEU 22 HD22 LEU 22 -12.488 -24.897 -1.408 214 HD23 LEU 22 HD23 LEU 22 -12.014 -25.629 0.138 215 H LYS 23 H LYS 23 -13.067 -28.555 0.794 216 HA LYS 23 HA LYS 23 -13.836 -30.414 3.015 217 HB2 LYS 23 HB2 LYS 23 -12.264 -31.049 0.490 218 HB3 LYS 23 HB3 LYS 23 -12.635 -32.172 1.806 219 HG2 LYS 23 HG2 LYS 23 -15.087 -31.833 1.367 220 HG3 LYS 23 HG3 LYS 23 -14.669 -30.807 -0.008 221 HD2 LYS 23 HD2 LYS 23 -15.200 -32.958 -0.868 222 HD3 LYS 23 HD3 LYS 23 -13.454 -32.736 -1.050 223 HE2 LYS 23 HE2 LYS 23 -13.064 -34.120 0.977 224 HE3 LYS 23 HE3 LYS 23 -14.809 -34.279 1.215 225 HZ1 LYS 23 HZ1 LYS 23 -13.313 -35.311 -1.138 226 HZ2 LYS 23 HZ2 LYS 23 -13.891 -36.221 0.086 227 HZ3 LYS 23 HZ3 LYS 23 -14.926 -35.456 -0.916 228 H ASN 24 H ASN 24 -12.490 -28.027 3.521 229 HA ASN 24 HA ASN 24 -10.693 -27.066 4.517 230 HB2 ASN 24 HB2 ASN 24 -11.698 -28.647 6.184 231 HB3 ASN 24 HB3 ASN 24 -10.402 -29.786 5.827 232 HD21 ASN 24 HD21 ASN 24 -7.922 -27.845 7.565 233 HD22 ASN 24 HD22 ASN 24 -8.134 -28.916 6.168 234 HA PRO 25 HA PRO 25 -7.518 -28.872 1.636 235 HB2 PRO 25 HB2 PRO 25 -7.158 -26.811 -0.094 236 HB3 PRO 25 HB3 PRO 25 -8.577 -27.893 -0.173 237 HG2 PRO 25 HG2 PRO 25 -8.413 -25.174 1.183 238 HG3 PRO 25 HG3 PRO 25 -9.623 -25.741 -0.009 239 HD2 PRO 25 HD2 PRO 25 -10.082 -25.860 2.676 240 HD3 PRO 25 HD3 PRO 25 -10.663 -27.145 1.573 241 H ARG 26 H ARG 26 -6.282 -28.841 3.615 242 HA ARG 26 HA ARG 26 -4.506 -28.255 4.988 243 HB2 ARG 26 HB2 ARG 26 -3.581 -27.802 2.160 244 HB3 ARG 26 HB3 ARG 26 -2.506 -27.328 3.464 245 HG2 ARG 26 HG2 ARG 26 -1.934 -29.520 2.773 246 HG3 ARG 26 HG3 ARG 26 -2.528 -29.536 4.436 247 HD2 ARG 26 HD2 ARG 26 -4.634 -30.551 3.742 248 HD3 ARG 26 HD3 ARG 26 -4.247 -30.283 2.040 249 HE ARG 26 HE ARG 26 -2.950 -32.177 2.006 250 HH11 ARG 26 HH11 ARG 26 -1.949 -34.007 2.728 251 HH12 ARG 26 HH12 ARG 26 -1.836 -34.326 4.434 252 HH21 ARG 26 HH21 ARG 26 -3.460 -31.473 5.411 253 HH22 ARG 26 HH22 ARG 26 -2.655 -32.933 5.912 254 H VAL 27 H VAL 27 -6.231 -26.652 5.634 255 HA VAL 27 HA VAL 27 -6.917 -24.674 6.513 256 HB VAL 27 HB VAL 27 -3.965 -24.461 7.018 257 HG11 VAL 27 HG11 VAL 27 -6.318 -23.107 8.437 258 HG12 VAL 27 HG12 VAL 27 -4.634 -23.091 9.003 259 HG13 VAL 27 HG13 VAL 27 -5.058 -22.272 7.503 260 HG21 VAL 27 HG21 VAL 27 -4.914 -26.547 7.889 261 HG22 VAL 27 HG22 VAL 27 -4.548 -25.447 9.215 262 HG23 VAL 27 HG23 VAL 27 -6.230 -25.642 8.677 263 HA PRO 28 HA PRO 28 -6.267 -22.109 2.774 264 HB2 PRO 28 HB2 PRO 28 -8.789 -21.077 2.547 265 HB3 PRO 28 HB3 PRO 28 -8.298 -22.687 1.931 266 HG2 PRO 28 HG2 PRO 28 -9.664 -22.041 4.568 267 HG3 PRO 28 HG3 PRO 28 -10.097 -23.321 3.390 268 HD2 PRO 28 HD2 PRO 28 -8.622 -23.844 5.601 269 HD3 PRO 28 HD3 PRO 28 -8.253 -24.662 4.051 270 H THR 29 H THR 29 -6.478 -19.881 2.273 271 HA THR 29 HA THR 29 -5.749 -18.229 4.612 272 HB THR 29 HB THR 29 -4.275 -17.177 2.798 273 HG1 THR 29 HG1 THR 29 -3.842 -18.494 1.035 274 HG21 THR 29 HG21 THR 29 -3.800 -20.099 3.525 275 HG22 THR 29 HG22 THR 29 -2.563 -18.932 3.004 276 HG23 THR 29 HG23 THR 29 -3.404 -18.701 4.547 277 H GLN 30 H GLN 30 -8.115 -17.750 4.683 278 HA GLN 30 HA GLN 30 -9.053 -15.819 2.707 279 HB2 GLN 30 HB2 GLN 30 -10.358 -17.008 5.166 280 HB3 GLN 30 HB3 GLN 30 -11.177 -15.873 4.091 281 HG2 GLN 30 HG2 GLN 30 -11.370 -17.348 2.341 282 HG3 GLN 30 HG3 GLN 30 -9.936 -18.276 2.774 283 HE21 GLN 30 HE21 GLN 30 -11.615 -20.269 5.274 284 HE22 GLN 30 HE22 GLN 30 -10.092 -19.425 4.996 285 H LYS 31 H LYS 31 -6.925 -14.768 3.679 286 HA LYS 31 HA LYS 31 -7.396 -12.708 5.724 287 HB2 LYS 31 HB2 LYS 31 -5.137 -13.226 3.762 288 HB3 LYS 31 HB3 LYS 31 -5.088 -11.923 4.945 289 HG2 LYS 31 HG2 LYS 31 -5.478 -14.797 5.861 290 HG3 LYS 31 HG3 LYS 31 -3.892 -14.190 5.416 291 HD2 LYS 31 HD2 LYS 31 -4.121 -14.046 7.787 292 HD3 LYS 31 HD3 LYS 31 -4.022 -12.417 7.114 293 HE2 LYS 31 HE2 LYS 31 -6.446 -12.119 7.384 294 HE3 LYS 31 HE3 LYS 31 -6.622 -13.800 7.919 295 HZ1 LYS 31 HZ1 LYS 31 -5.087 -11.697 9.359 296 HZ2 LYS 31 HZ2 LYS 31 -6.552 -12.263 9.800 297 HZ3 LYS 31 HZ3 LYS 31 -5.251 -13.245 9.859 298 H THR 32 H THR 32 -9.430 -12.385 4.274 299 HA THR 32 HA THR 32 -8.992 -10.211 2.275 300 HB THR 32 HB THR 32 -9.892 -12.479 1.607 301 HG1 THR 32 HG1 THR 32 -11.364 -11.588 0.181 302 HG21 THR 32 HG21 THR 32 -12.495 -11.477 2.831 303 HG22 THR 32 HG22 THR 32 -12.247 -12.959 1.886 304 HG23 THR 32 HG23 THR 32 -11.507 -12.802 3.483 305 H GLY 33 H GLY 33 -9.719 -10.283 5.377 306 HA2 GLY 33 HA2 GLY 33 -12.302 -9.222 5.712 307 HA3 GLY 33 HA3 GLY 33 -10.999 -9.132 6.896 308 H GLU 34 H GLU 34 -9.343 -7.419 5.025 309 HA GLU 34 HA GLU 34 -10.930 -4.871 5.057 310 HB2 GLU 34 HB2 GLU 34 -8.008 -5.198 5.839 311 HB3 GLU 34 HB3 GLU 34 -8.863 -3.664 5.656 312 HG2 GLU 34 HG2 GLU 34 -10.502 -4.467 7.428 313 HG3 GLU 34 HG3 GLU 34 -9.389 -5.797 7.750 314 H LEU 35 H LEU 35 -9.848 -6.990 2.875 315 HA LEU 35 HA LEU 35 -9.026 -4.910 0.912 316 HB2 LEU 35 HB2 LEU 35 -7.406 -7.299 1.805 317 HB3 LEU 35 HB3 LEU 35 -7.321 -6.771 0.140 318 HG LEU 35 HG LEU 35 -7.098 -4.373 1.663 319 HD11 LEU 35 HD11 LEU 35 -5.194 -6.514 2.685 320 HD12 LEU 35 HD12 LEU 35 -5.131 -4.774 3.048 321 HD13 LEU 35 HD13 LEU 35 -6.495 -5.746 3.628 322 HD21 LEU 35 HD21 LEU 35 -6.093 -4.840 -0.527 323 HD22 LEU 35 HD22 LEU 35 -4.885 -4.268 0.641 324 HD23 LEU 35 HD23 LEU 35 -4.980 -5.997 0.224 325 H SER 36 H SER 36 -10.608 -4.880 -0.330 326 HA SER 36 HA SER 36 -11.563 -7.232 -1.891 327 HB2 SER 36 HB2 SER 36 -13.341 -5.517 -0.113 328 HB3 SER 36 HB3 SER 36 -13.925 -6.619 -1.375 329 HG SER 36 HG SER 36 -13.928 -7.597 0.698 330 H GLU 37 H GLU 37 -10.555 -6.170 -3.608 331 HA GLU 37 HA GLU 37 -10.737 -5.265 -5.661 332 HB2 GLU 37 HB2 GLU 37 -13.639 -5.056 -4.774 333 HB3 GLU 37 HB3 GLU 37 -13.112 -4.842 -6.446 334 HG2 GLU 37 HG2 GLU 37 -12.201 -7.141 -6.486 335 HG3 GLU 37 HG3 GLU 37 -12.721 -7.390 -4.819 336 H GLU 38 H GLU 38 -10.824 -3.212 -3.222 337 HA GLU 38 HA GLU 38 -10.503 -0.877 -5.110 338 HB2 GLU 38 HB2 GLU 38 -11.630 -0.846 -2.287 339 HB3 GLU 38 HB3 GLU 38 -11.214 0.587 -3.231 340 HG2 GLU 38 HG2 GLU 38 -12.876 -0.077 -4.960 341 HG3 GLU 38 HG3 GLU 38 -13.328 -1.480 -3.989 342 H GLN 39 H GLN 39 -9.446 -2.451 -2.110 343 HA GLN 39 HA GLN 39 -7.325 -0.610 -1.530 344 HB2 GLN 39 HB2 GLN 39 -7.871 -3.402 -0.486 345 HB3 GLN 39 HB3 GLN 39 -6.736 -2.241 0.197 346 HG2 GLN 39 HG2 GLN 39 -8.668 -2.026 1.541 347 HG3 GLN 39 HG3 GLN 39 -8.708 -0.626 0.480 348 HE21 GLN 39 HE21 GLN 39 -12.108 -1.549 -0.022 349 HE22 GLN 39 HE22 GLN 39 -11.043 -0.455 0.881 350 H LYS 40 H LYS 40 -7.401 -3.687 -3.280 351 HA LYS 40 HA LYS 40 -4.537 -3.854 -3.695 352 HB2 LYS 40 HB2 LYS 40 -6.956 -5.017 -5.142 353 HB3 LYS 40 HB3 LYS 40 -5.304 -5.388 -5.655 354 HG2 LYS 40 HG2 LYS 40 -4.779 -6.595 -3.766 355 HG3 LYS 40 HG3 LYS 40 -5.941 -5.771 -2.743 356 HD2 LYS 40 HD2 LYS 40 -7.435 -7.148 -4.808 357 HD3 LYS 40 HD3 LYS 40 -6.246 -8.276 -4.120 358 HE2 LYS 40 HE2 LYS 40 -7.026 -7.492 -1.816 359 HE3 LYS 40 HE3 LYS 40 -8.333 -6.621 -2.635 360 HZ1 LYS 40 HZ1 LYS 40 -7.889 -9.568 -2.691 361 HZ2 LYS 40 HZ2 LYS 40 -9.058 -8.802 -1.847 362 HZ3 LYS 40 HZ3 LYS 40 -9.094 -8.815 -3.493 363 H LYS 41 H LYS 41 -7.151 -2.364 -5.534 364 HA LYS 41 HA LYS 41 -5.487 -1.291 -7.621 365 HB2 LYS 41 HB2 LYS 41 -8.081 -0.148 -6.521 366 HB3 LYS 41 HB3 LYS 41 -7.320 0.328 -8.032 367 HG2 LYS 41 HG2 LYS 41 -7.663 -1.866 -9.008 368 HG3 LYS 41 HG3 LYS 41 -8.269 -2.512 -7.470 369 HD2 LYS 41 HD2 LYS 41 -10.141 -0.905 -7.510 370 HD3 LYS 41 HD3 LYS 41 -9.595 -0.280 -9.077 371 HE2 LYS 41 HE2 LYS 41 -10.124 -2.284 -10.213 372 HE3 LYS 41 HE3 LYS 41 -10.092 -3.247 -8.726 373 HZ1 LYS 41 HZ1 LYS 41 -12.176 -1.217 -9.306 374 HZ2 LYS 41 HZ2 LYS 41 -12.373 -2.833 -9.484 375 HZ3 LYS 41 HZ3 LYS 41 -12.098 -2.211 -7.995 376 H ILE 42 H ILE 42 -5.281 -0.508 -4.377 377 HA ILE 42 HA ILE 42 -3.926 2.096 -4.938 378 HB ILE 42 HB ILE 42 -5.128 0.894 -2.438 379 HG12 ILE 42 HG12 ILE 42 -5.876 3.598 -3.561 380 HG13 ILE 42 HG13 ILE 42 -6.478 2.183 -4.403 381 HG21 ILE 42 HG21 ILE 42 -3.568 3.492 -2.635 382 HG22 ILE 42 HG22 ILE 42 -4.613 3.034 -1.269 383 HG23 ILE 42 HG23 ILE 42 -3.189 2.076 -1.631 384 HD11 ILE 42 HD11 ILE 42 -6.912 2.706 -1.449 385 HD12 ILE 42 HD12 ILE 42 -8.113 2.858 -2.763 386 HD13 ILE 42 HD13 ILE 42 -7.425 1.277 -2.359 387 H VAL 43 H VAL 43 -3.224 -1.217 -4.232 388 HA VAL 43 HA VAL 43 -0.442 -0.481 -3.382 389 HB VAL 43 HB VAL 43 -2.040 -2.793 -2.232 390 HG11 VAL 43 HG11 VAL 43 0.712 -1.605 -1.584 391 HG12 VAL 43 HG12 VAL 43 -0.094 -2.868 -0.639 392 HG13 VAL 43 HG13 VAL 43 0.410 -3.207 -2.290 393 HG21 VAL 43 HG21 VAL 43 -2.959 -0.730 -1.357 394 HG22 VAL 43 HG22 VAL 43 -1.885 -1.375 -0.117 395 HG23 VAL 43 HG23 VAL 43 -1.337 -0.045 -1.154 396 H ALA 44 H ALA 44 -2.312 -3.312 -4.699 397 HA ALA 44 HA ALA 44 0.039 -4.550 -5.826 398 HB1 ALA 44 HB1 ALA 44 -2.897 -4.768 -6.635 399 HB2 ALA 44 HB2 ALA 44 -1.585 -5.889 -7.070 400 HB3 ALA 44 HB3 ALA 44 -2.091 -5.741 -5.374 401 H ASP 45 H ASP 45 -2.413 -2.286 -7.106 402 HA ASP 45 HA ASP 45 -1.231 -1.945 -9.714 403 HB2 ASP 45 HB2 ASP 45 -3.561 -1.338 -9.052 404 HB3 ASP 45 HB3 ASP 45 -2.913 -0.005 -8.091 405 H TYR 46 H TYR 46 -0.404 -0.527 -6.581 406 HA TYR 46 HA TYR 46 1.287 1.579 -7.663 407 HB2 TYR 46 HB2 TYR 46 0.021 1.364 -5.393 408 HB3 TYR 46 HB3 TYR 46 1.440 0.488 -4.841 409 HD1 TYR 46 HD1 TYR 46 0.495 2.814 -3.445 410 HD2 TYR 46 HD2 TYR 46 3.148 2.598 -6.809 411 HE1 TYR 46 HE1 TYR 46 1.438 5.045 -2.835 412 HE2 TYR 46 HE2 TYR 46 4.084 4.776 -6.272 413 HH TYR 46 HH TYR 46 2.917 6.720 -3.450 414 H ILE 47 H ILE 47 1.806 -1.692 -6.329 415 HA ILE 47 HA ILE 47 4.648 -1.844 -6.690 416 HB ILE 47 HB ILE 47 2.347 -3.711 -6.269 417 HG12 ILE 47 HG12 ILE 47 3.663 -4.527 -4.433 418 HG13 ILE 47 HG13 ILE 47 5.124 -3.763 -5.044 419 HG21 ILE 47 HG21 ILE 47 5.019 -4.723 -7.261 420 HG22 ILE 47 HG22 ILE 47 3.745 -5.712 -6.511 421 HG23 ILE 47 HG23 ILE 47 3.432 -4.927 -8.063 422 HD11 ILE 47 HD11 ILE 47 2.718 -2.326 -3.855 423 HD12 ILE 47 HD12 ILE 47 4.328 -2.541 -3.138 424 HD13 ILE 47 HD13 ILE 47 4.125 -1.520 -4.573 425 H SER 48 H SER 48 1.974 -2.327 -9.011 426 HA SER 48 HA SER 48 3.714 -2.884 -11.250 427 HB2 SER 48 HB2 SER 48 0.887 -1.781 -11.182 428 HB3 SER 48 HB3 SER 48 1.735 -2.341 -12.628 429 HG SER 48 HG SER 48 0.411 -3.987 -11.729 430 H GLU 49 H GLU 49 3.332 0.147 -9.565 431 HA GLU 49 HA GLU 49 3.792 1.709 -12.057 432 HB2 GLU 49 HB2 GLU 49 1.807 2.149 -10.561 433 HB3 GLU 49 HB3 GLU 49 2.937 2.623 -9.295 434 HG2 GLU 49 HG2 GLU 49 2.142 4.601 -10.313 435 HG3 GLU 49 HG3 GLU 49 3.811 4.416 -10.833 436 H VAL 50 H VAL 50 5.127 1.273 -8.742 437 HA VAL 50 HA VAL 50 7.602 2.722 -9.632 438 HB VAL 50 HB VAL 50 7.772 3.806 -7.522 439 HG11 VAL 50 HG11 VAL 50 4.902 4.126 -8.409 440 HG12 VAL 50 HG12 VAL 50 5.941 5.303 -7.575 441 HG13 VAL 50 HG13 VAL 50 6.307 4.830 -9.239 442 HG21 VAL 50 HG21 VAL 50 6.985 2.111 -5.985 443 HG22 VAL 50 HG22 VAL 50 6.070 3.606 -5.771 444 HG23 VAL 50 HG23 VAL 50 5.342 2.232 -6.634 445 H GLY 51 H GLY 51 6.481 -0.197 -8.142 446 HA2 GLY 51 HA2 GLY 51 8.191 -1.926 -8.795 447 HA3 GLY 51 HA3 GLY 51 9.329 -1.063 -7.761 448 H LEU 52 H LEU 52 8.741 -0.831 -5.503 449 HA LEU 52 HA LEU 52 6.738 -2.474 -4.226 450 HB2 LEU 52 HB2 LEU 52 8.399 -4.219 -4.948 451 HB3 LEU 52 HB3 LEU 52 9.652 -3.436 -4.008 452 HG LEU 52 HG LEU 52 7.163 -4.010 -2.513 453 HD11 LEU 52 HD11 LEU 52 8.921 -6.281 -3.566 454 HD12 LEU 52 HD12 LEU 52 7.702 -6.467 -2.294 455 HD13 LEU 52 HD13 LEU 52 7.198 -6.021 -3.933 456 HD21 LEU 52 HD21 LEU 52 9.160 -3.272 -1.327 457 HD22 LEU 52 HD22 LEU 52 8.680 -4.883 -0.801 458 HD23 LEU 52 HD23 LEU 52 10.053 -4.701 -1.911 459 H ASN 53 H ASN 53 9.890 -1.112 -3.816 460 HA ASN 53 HA ASN 53 9.399 -0.182 -1.054 461 HB2 ASN 53 HB2 ASN 53 11.890 -0.377 -2.794 462 HB3 ASN 53 HB3 ASN 53 11.898 0.308 -1.175 463 HD21 ASN 53 HD21 ASN 53 12.249 -3.627 -1.475 464 HD22 ASN 53 HD22 ASN 53 12.433 -2.547 -2.847 465 H ASN 54 H ASN 54 9.397 1.301 -4.168 466 HA ASN 54 HA ASN 54 10.440 3.859 -3.225 467 HB2 ASN 54 HB2 ASN 54 9.330 3.096 -5.944 468 HB3 ASN 54 HB3 ASN 54 10.288 4.528 -5.567 469 HD21 ASN 54 HD21 ASN 54 12.182 1.097 -6.410 470 HD22 ASN 54 HD22 ASN 54 10.503 1.442 -6.825 471 H LEU 55 H LEU 55 7.320 2.512 -3.365 472 HA LEU 55 HA LEU 55 5.752 4.964 -3.312 473 HB2 LEU 55 HB2 LEU 55 3.956 3.476 -2.575 474 HB3 LEU 55 HB3 LEU 55 4.787 2.865 -3.989 475 HG LEU 55 HG LEU 55 6.156 1.476 -2.099 476 HD11 LEU 55 HD11 LEU 55 3.350 1.801 -0.949 477 HD12 LEU 55 HD12 LEU 55 4.598 0.656 -0.414 478 HD13 LEU 55 HD13 LEU 55 4.846 2.391 -0.193 479 HD21 LEU 55 HD21 LEU 55 4.990 0.515 -4.036 480 HD22 LEU 55 HD22 LEU 55 4.629 -0.375 -2.555 481 HD23 LEU 55 HD23 LEU 55 3.423 0.741 -3.228 482 H ASN 56 H ASN 56 4.435 5.520 -1.312 483 HA ASN 56 HA ASN 56 5.994 5.160 1.191 484 HB2 ASN 56 HB2 ASN 56 5.696 7.411 1.833 485 HB3 ASN 56 HB3 ASN 56 6.352 7.424 0.209 486 HD21 ASN 56 HD21 ASN 56 3.872 9.954 -0.187 487 HD22 ASN 56 HD22 ASN 56 5.573 9.678 0.177 488 H ALA 57 H ALA 57 4.663 5.715 3.116 489 HA ALA 57 HA ALA 57 2.335 3.954 3.136 490 HB1 ALA 57 HB1 ALA 57 3.817 5.571 5.249 491 HB2 ALA 57 HB2 ALA 57 2.546 4.379 5.594 492 HB3 ALA 57 HB3 ALA 57 4.067 3.856 4.846 493 H THR 58 H THR 58 2.874 7.415 3.032 494 HA THR 58 HA THR 58 0.433 8.364 4.129 495 HB THR 58 HB THR 58 2.186 9.680 2.026 496 HG1 THR 58 HG1 THR 58 3.283 10.532 3.813 497 HG21 THR 58 HG21 THR 58 0.350 10.831 4.170 498 HG22 THR 58 HG22 THR 58 1.472 11.780 3.163 499 HG23 THR 58 HG23 THR 58 0.129 10.919 2.407 500 H GLU 59 H GLU 59 1.359 7.769 0.709 501 HA GLU 59 HA GLU 59 -1.207 8.503 -0.384 502 HB2 GLU 59 HB2 GLU 59 1.100 6.774 -1.388 503 HB3 GLU 59 HB3 GLU 59 -0.295 7.143 -2.391 504 HG2 GLU 59 HG2 GLU 59 1.581 9.238 -1.198 505 HG3 GLU 59 HG3 GLU 59 1.682 8.597 -2.834 506 H LEU 60 H LEU 60 -0.006 5.450 0.870 507 HA LEU 60 HA LEU 60 -2.357 3.875 0.218 508 HB2 LEU 60 HB2 LEU 60 0.068 3.592 1.971 509 HB3 LEU 60 HB3 LEU 60 -1.364 2.692 2.455 510 HG LEU 60 HG LEU 60 -1.515 1.628 0.272 511 HD11 LEU 60 HD11 LEU 60 1.113 3.053 -0.336 512 HD12 LEU 60 HD12 LEU 60 0.426 1.725 -1.294 513 HD13 LEU 60 HD13 LEU 60 -0.431 3.266 -1.193 514 HD21 LEU 60 HD21 LEU 60 -0.280 0.543 2.100 515 HD22 LEU 60 HD22 LEU 60 0.480 0.168 0.543 516 HD23 LEU 60 HD23 LEU 60 1.206 1.386 1.610 517 H SER 61 H SER 61 -1.402 5.562 3.294 518 HA SER 61 HA SER 61 -3.745 4.871 4.694 519 HB2 SER 61 HB2 SER 61 -3.127 6.629 6.269 520 HB3 SER 61 HB3 SER 61 -1.732 5.639 5.801 521 HG SER 61 HG SER 61 -1.184 7.822 5.749 522 H LYS 62 H LYS 62 -3.162 7.524 2.485 523 HA LYS 62 HA LYS 62 -5.536 9.082 3.031 524 HB2 LYS 62 HB2 LYS 62 -3.616 8.899 0.684 525 HB3 LYS 62 HB3 LYS 62 -5.024 9.966 0.646 526 HG2 LYS 62 HG2 LYS 62 -4.262 11.279 2.479 527 HG3 LYS 62 HG3 LYS 62 -3.041 10.100 2.943 528 HD2 LYS 62 HD2 LYS 62 -1.964 11.981 1.871 529 HD3 LYS 62 HD3 LYS 62 -1.776 10.545 0.853 530 HE2 LYS 62 HE2 LYS 62 -3.685 11.341 -0.564 531 HE3 LYS 62 HE3 LYS 62 -3.827 12.781 0.456 532 HZ1 LYS 62 HZ1 LYS 62 -1.425 12.031 -1.139 533 HZ2 LYS 62 HZ2 LYS 62 -2.492 13.207 -1.540 534 HZ3 LYS 62 HZ3 LYS 62 -1.554 13.379 -0.214 535 H ARG 63 H ARG 63 -4.946 6.553 0.566 536 HA ARG 63 HA ARG 63 -7.756 6.821 -0.406 537 HB2 ARG 63 HB2 ARG 63 -5.409 5.209 -1.469 538 HB3 ARG 63 HB3 ARG 63 -7.016 5.308 -2.210 539 HG2 ARG 63 HG2 ARG 63 -6.718 7.778 -2.478 540 HG3 ARG 63 HG3 ARG 63 -5.074 7.619 -1.827 541 HD2 ARG 63 HD2 ARG 63 -4.615 5.920 -3.684 542 HD3 ARG 63 HD3 ARG 63 -6.195 6.328 -4.356 543 HE ARG 63 HE ARG 63 -5.331 8.325 -5.176 544 HH11 ARG 63 HH11 ARG 63 -3.661 9.822 -5.661 545 HH12 ARG 63 HH12 ARG 63 -2.168 9.705 -4.726 546 HH21 ARG 63 HH21 ARG 63 -2.990 7.116 -2.799 547 HH22 ARG 63 HH22 ARG 63 -1.817 8.320 -3.358 548 H LEU 64 H LEU 64 -5.742 4.395 1.195 549 HA LEU 64 HA LEU 64 -7.838 2.340 1.112 550 HB2 LEU 64 HB2 LEU 64 -5.174 2.271 0.983 551 HB3 LEU 64 HB3 LEU 64 -5.310 2.117 2.728 552 HG LEU 64 HG LEU 64 -6.615 0.275 0.690 553 HD11 LEU 64 HD11 LEU 64 -3.975 -0.042 2.173 554 HD12 LEU 64 HD12 LEU 64 -4.732 -1.262 1.128 555 HD13 LEU 64 HD13 LEU 64 -4.180 0.267 0.436 556 HD21 LEU 64 HD21 LEU 64 -7.667 -0.010 2.874 557 HD22 LEU 64 HD22 LEU 64 -6.581 -1.373 2.609 558 HD23 LEU 64 HD23 LEU 64 -6.081 -0.052 3.675 559 H ASN 65 H ASN 65 -6.946 4.941 3.194 560 HA ASN 65 HA ASN 65 -7.763 5.781 5.088 561 HB2 ASN 65 HB2 ASN 65 -9.871 5.484 3.725 562 HB3 ASN 65 HB3 ASN 65 -10.228 4.054 4.694 563 HD21 ASN 65 HD21 ASN 65 -10.939 6.013 7.665 564 HD22 ASN 65 HD22 ASN 65 -10.190 4.490 7.167 565 H ILE 66 H ILE 66 -5.916 4.496 5.782 566 HA ILE 66 HA ILE 66 -6.493 2.813 8.170 567 HB ILE 66 HB ILE 66 -4.323 1.602 7.645 568 HG12 ILE 66 HG12 ILE 66 -4.718 2.844 4.888 569 HG13 ILE 66 HG13 ILE 66 -3.384 3.144 6.009 570 HG21 ILE 66 HG21 ILE 66 -6.596 1.131 5.687 571 HG22 ILE 66 HG22 ILE 66 -5.392 -0.059 6.246 572 HG23 ILE 66 HG23 ILE 66 -6.566 0.602 7.382 573 HD11 ILE 66 HD11 ILE 66 -3.955 0.538 4.560 574 HD12 ILE 66 HD12 ILE 66 -2.718 1.735 4.172 575 HD13 ILE 66 HD13 ILE 66 -2.619 0.823 5.704 576 H THR 67 H THR 67 -4.694 2.933 9.778 577 HA THR 67 HA THR 67 -3.507 5.603 9.964 578 HB THR 67 HB THR 67 -4.136 4.435 11.998 579 HG1 THR 67 HG1 THR 67 -2.271 4.967 13.078 580 HG21 THR 67 HG21 THR 67 -1.785 2.563 11.491 581 HG22 THR 67 HG22 THR 67 -2.820 2.617 12.926 582 HG23 THR 67 HG23 THR 67 -3.497 2.085 11.382 583 H VAL 68 H VAL 68 -1.251 6.083 9.908 584 HA VAL 68 HA VAL 68 0.023 5.134 7.547 585 HB VAL 68 HB VAL 68 1.407 6.557 9.854 586 HG11 VAL 68 HG11 VAL 68 1.917 6.585 6.842 587 HG12 VAL 68 HG12 VAL 68 2.816 7.513 8.063 588 HG13 VAL 68 HG13 VAL 68 2.918 5.750 8.050 589 HG21 VAL 68 HG21 VAL 68 -0.603 7.863 9.291 590 HG22 VAL 68 HG22 VAL 68 0.834 8.675 8.671 591 HG23 VAL 68 HG23 VAL 68 -0.207 7.758 7.561 592 H ASP 69 H ASP 69 0.488 4.186 10.936 593 HA ASP 69 HA ASP 69 2.709 2.468 10.465 594 HB2 ASP 69 HB2 ASP 69 2.043 3.413 12.672 595 HB3 ASP 69 HB3 ASP 69 0.621 2.367 12.676 596 H LYS 70 H LYS 70 -0.754 1.832 10.104 597 HA LYS 70 HA LYS 70 -0.410 -1.056 9.735 598 HB2 LYS 70 HB2 LYS 70 -2.682 0.893 9.287 599 HB3 LYS 70 HB3 LYS 70 -2.665 -0.610 8.368 600 HG2 LYS 70 HG2 LYS 70 -2.405 -1.881 10.536 601 HG3 LYS 70 HG3 LYS 70 -2.716 -0.361 11.397 602 HD2 LYS 70 HD2 LYS 70 -4.924 -0.175 10.291 603 HD3 LYS 70 HD3 LYS 70 -4.570 -1.608 9.304 604 HE2 LYS 70 HE2 LYS 70 -4.357 -2.950 11.430 605 HE3 LYS 70 HE3 LYS 70 -4.911 -1.532 12.329 606 HZ1 LYS 70 HZ1 LYS 70 -6.481 -2.969 10.226 607 HZ2 LYS 70 HZ2 LYS 70 -6.758 -3.012 11.829 608 HZ3 LYS 70 HZ3 LYS 70 -6.985 -1.625 11.007 609 H ALA 71 H ALA 71 -0.225 1.785 7.646 610 HA ALA 71 HA ALA 71 -0.054 0.205 5.171 611 HB1 ALA 71 HB1 ALA 71 0.740 3.094 5.778 612 HB2 ALA 71 HB2 ALA 71 0.617 2.363 4.168 613 HB3 ALA 71 HB3 ALA 71 -0.829 2.578 5.177 614 H LYS 72 H LYS 72 2.313 1.852 7.271 615 HA LYS 72 HA LYS 72 4.733 1.119 5.982 616 HB2 LYS 72 HB2 LYS 72 4.017 1.707 8.871 617 HB3 LYS 72 HB3 LYS 72 5.677 1.351 8.375 618 HG2 LYS 72 HG2 LYS 72 5.761 3.280 6.942 619 HG3 LYS 72 HG3 LYS 72 4.038 3.588 7.181 620 HD2 LYS 72 HD2 LYS 72 5.460 5.129 8.468 621 HD3 LYS 72 HD3 LYS 72 4.335 4.200 9.474 622 HE2 LYS 72 HE2 LYS 72 6.062 2.745 10.259 623 HE3 LYS 72 HE3 LYS 72 7.226 3.354 9.063 624 HZ1 LYS 72 HZ1 LYS 72 6.106 4.949 11.310 625 HZ2 LYS 72 HZ2 LYS 72 7.613 4.327 11.255 626 HZ3 LYS 72 HZ3 LYS 72 7.184 5.499 10.209 627 H THR 73 H THR 73 2.851 -0.814 8.352 628 HA THR 73 HA THR 73 4.882 -2.975 8.116 629 HB THR 73 HB THR 73 3.741 -2.408 10.291 630 HG1 THR 73 HG1 THR 73 3.809 -4.580 10.847 631 HG21 THR 73 HG21 THR 73 1.513 -4.202 9.231 632 HG22 THR 73 HG22 THR 73 1.664 -3.482 10.846 633 HG23 THR 73 HG23 THR 73 1.357 -2.443 9.450 634 H TYR 74 H TYR 74 1.484 -2.512 6.989 635 HA TYR 74 HA TYR 74 1.176 -5.096 5.927 636 HB2 TYR 74 HB2 TYR 74 -0.698 -3.629 6.189 637 HB3 TYR 74 HB3 TYR 74 0.025 -2.420 5.119 638 HD1 TYR 74 HD1 TYR 74 -0.601 -2.302 2.912 639 HD2 TYR 74 HD2 TYR 74 -1.075 -6.031 5.040 640 HE1 TYR 74 HE1 TYR 74 -1.635 -3.307 0.919 641 HE2 TYR 74 HE2 TYR 74 -2.048 -7.069 2.988 642 HH TYR 74 HH TYR 74 -2.389 -5.251 -0.078 643 H ILE 75 H ILE 75 2.679 -2.244 4.364 644 HA ILE 75 HA ILE 75 3.121 -3.165 1.763 645 HB ILE 75 HB ILE 75 4.803 -1.503 3.664 646 HG12 ILE 75 HG12 ILE 75 3.420 -0.682 1.073 647 HG13 ILE 75 HG13 ILE 75 2.575 -0.691 2.603 648 HG21 ILE 75 HG21 ILE 75 5.467 -2.142 0.758 649 HG22 ILE 75 HG22 ILE 75 6.218 -0.835 1.697 650 HG23 ILE 75 HG23 ILE 75 6.465 -2.490 2.195 651 HD11 ILE 75 HD11 ILE 75 5.046 0.990 1.978 652 HD12 ILE 75 HD12 ILE 75 3.391 1.564 2.169 653 HD13 ILE 75 HD13 ILE 75 4.256 0.896 3.563 654 H LYS 76 H LYS 76 5.349 -3.759 4.536 655 HA LYS 76 HA LYS 76 6.822 -5.766 2.989 656 HB2 LYS 76 HB2 LYS 76 8.194 -6.011 5.034 657 HB3 LYS 76 HB3 LYS 76 8.129 -4.378 4.376 658 HG2 LYS 76 HG2 LYS 76 6.585 -3.660 6.120 659 HG3 LYS 76 HG3 LYS 76 6.486 -5.310 6.770 660 HD2 LYS 76 HD2 LYS 76 8.798 -5.298 7.413 661 HD3 LYS 76 HD3 LYS 76 9.121 -3.784 6.565 662 HE2 LYS 76 HE2 LYS 76 7.115 -3.983 8.853 663 HE3 LYS 76 HE3 LYS 76 8.838 -3.713 9.130 664 HZ1 LYS 76 HZ1 LYS 76 7.103 -1.906 7.510 665 HZ2 LYS 76 HZ2 LYS 76 7.667 -1.609 9.020 666 HZ3 LYS 76 HZ3 LYS 76 8.708 -1.705 7.772 667 H ASN 77 H ASN 77 4.367 -5.919 5.539 668 HA ASN 77 HA ASN 77 4.723 -8.691 6.088 669 HB2 ASN 77 HB2 ASN 77 3.455 -6.883 7.434 670 HB3 ASN 77 HB3 ASN 77 2.090 -7.190 6.353 671 HD21 ASN 77 HD21 ASN 77 3.268 -9.979 9.141 672 HD22 ASN 77 HD22 ASN 77 4.336 -8.655 8.689 673 H SER 78 H SER 78 2.863 -7.096 3.549 674 HA SER 78 HA SER 78 1.681 -9.552 2.505 675 HB2 SER 78 HB2 SER 78 0.762 -7.212 2.233 676 HB3 SER 78 HB3 SER 78 2.097 -6.898 1.103 677 HG SER 78 HG SER 78 0.119 -7.616 0.084 678 H ASN 79 H ASN 79 4.497 -7.543 1.651 679 HA ASN 79 HA ASN 79 5.728 -9.786 0.172 680 HB2 ASN 79 HB2 ASN 79 6.081 -8.237 -1.832 681 HB3 ASN 79 HB3 ASN 79 4.494 -8.944 -1.606 682 HD21 ASN 79 HD21 ASN 79 4.835 -4.898 -0.984 683 HD22 ASN 79 HD22 ASN 79 6.223 -5.929 -0.664 684 H ARG 80 H ARG 80 7.167 -9.696 1.990 685 HA ARG 80 HA ARG 80 8.993 -7.565 2.508 686 HB2 ARG 80 HB2 ARG 80 9.435 -10.581 2.794 687 HB3 ARG 80 HB3 ARG 80 10.518 -9.330 3.413 688 HG2 ARG 80 HG2 ARG 80 8.580 -8.414 4.745 689 HG3 ARG 80 HG3 ARG 80 7.667 -9.876 4.283 690 HD2 ARG 80 HD2 ARG 80 9.237 -11.300 5.426 691 HD3 ARG 80 HD3 ARG 80 10.353 -9.939 5.689 692 HE ARG 80 HE ARG 80 7.695 -9.564 6.858 693 HH11 ARG 80 HH11 ARG 80 7.537 -9.346 9.076 694 HH12 ARG 80 HH12 ARG 80 8.853 -9.851 10.092 695 HH21 ARG 80 HH21 ARG 80 10.880 -10.869 7.527 696 HH22 ARG 80 HH22 ARG 80 10.698 -10.677 9.250 697 H MET 81 H MET 81 9.385 -10.293 0.328 698 HA MET 81 HA MET 81 11.729 -8.982 -1.015 699 HB2 MET 81 HB2 MET 81 10.994 -11.864 -0.432 700 HB3 MET 81 HB3 MET 81 12.170 -11.463 -1.691 701 HG2 MET 81 HG2 MET 81 12.420 -10.580 1.207 702 HG3 MET 81 HG3 MET 81 13.176 -12.016 0.517 703 HE1 MET 81 HE1 MET 81 15.602 -11.417 1.209 704 HE2 MET 81 HE2 MET 81 16.325 -9.811 0.990 705 HE3 MET 81 HE3 MET 81 14.937 -10.017 2.081 706 H GLY 82 H GLY 82 8.492 -9.969 -1.580 707 HA2 GLY 82 HA2 GLY 82 7.385 -8.999 -3.537 708 HA3 GLY 82 HA3 GLY 82 8.785 -9.416 -4.513 709 H ARG 83 H ARG 83 9.324 -11.976 -4.010 710 HA ARG 83 HA ARG 83 6.847 -13.522 -4.681 711 HB2 ARG 83 HB2 ARG 83 9.677 -14.237 -5.433 712 HB3 ARG 83 HB3 ARG 83 8.166 -14.991 -5.959 713 HG2 ARG 83 HG2 ARG 83 7.666 -12.412 -6.734 714 HG3 ARG 83 HG3 ARG 83 9.434 -12.404 -6.796 715 HD2 ARG 83 HD2 ARG 83 8.891 -13.088 -8.943 716 HD3 ARG 83 HD3 ARG 83 9.147 -14.632 -8.124 717 HE ARG 83 HE ARG 83 6.858 -15.117 -8.292 718 HH11 ARG 83 HH11 ARG 83 4.761 -14.840 -8.995 719 HH12 ARG 83 HH12 ARG 83 4.263 -13.312 -9.655 720 HH21 ARG 83 HH21 ARG 83 7.295 -11.773 -9.259 721 HH22 ARG 83 HH22 ARG 83 5.648 -11.622 -9.803 722 H THR 84 H THR 84 7.496 -12.995 -1.989 723 HA THR 84 HA THR 84 7.986 -13.852 0.060 724 HB THR 84 HB THR 84 6.712 -16.432 -0.835 725 HG1 THR 84 HG1 THR 84 4.731 -15.370 -0.753 726 HG21 THR 84 HG21 THR 84 6.282 -14.581 1.568 727 HG22 THR 84 HG22 THR 84 5.477 -16.144 1.296 728 HG23 THR 84 HG23 THR 84 7.217 -16.091 1.604 729 H ASN 85 H ASN 85 10.225 -14.068 -1.573 730 HA ASN 85 HA ASN 85 12.214 -15.044 -1.944 731 HB2 ASN 85 HB2 ASN 85 12.215 -14.588 0.543 732 HB3 ASN 85 HB3 ASN 85 11.824 -16.284 0.807 733 HD21 ASN 85 HD21 ASN 85 15.621 -15.259 -0.367 734 HD22 ASN 85 HD22 ASN 85 14.309 -14.140 -0.691 735 H ASN 86 H ASN 86 9.698 -16.825 -2.541 736 HA ASN 86 HA ASN 86 10.928 -19.487 -2.465 737 HB2 ASN 86 HB2 ASN 86 8.909 -20.287 -2.082 738 HB3 ASN 86 HB3 ASN 86 8.475 -18.622 -1.707 739 HD21 ASN 86 HD21 ASN 86 6.761 -18.223 -4.908 740 HD22 ASN 86 HD22 ASN 86 7.934 -17.352 -3.917 741 H PHE 87 H PHE 87 11.423 -17.274 -4.600 742 HA PHE 87 HA PHE 87 10.756 -18.419 -7.159 743 HB2 PHE 87 HB2 PHE 87 12.191 -16.624 -8.024 744 HB3 PHE 87 HB3 PHE 87 11.055 -16.040 -6.825 745 HD1 PHE 87 HD1 PHE 87 14.647 -16.866 -7.426 746 HD2 PHE 87 HD2 PHE 87 11.806 -15.028 -4.746 747 HE1 PHE 87 HE1 PHE 87 16.507 -15.975 -6.069 748 HE2 PHE 87 HE2 PHE 87 13.686 -14.088 -3.421 749 HZ PHE 87 HZ PHE 87 16.036 -14.574 -4.063 750 H LYS 88 H LYS 88 12.284 -20.170 -5.266 751 HA LYS 88 HA LYS 88 14.958 -20.668 -6.372 752 HB2 LYS 88 HB2 LYS 88 13.290 -22.388 -4.483 753 HB3 LYS 88 HB3 LYS 88 15.045 -22.399 -4.661 754 HG2 LYS 88 HG2 LYS 88 15.207 -20.188 -3.602 755 HG3 LYS 88 HG3 LYS 88 13.442 -20.037 -3.562 756 HD2 LYS 88 HD2 LYS 88 13.443 -22.223 -2.174 757 HD3 LYS 88 HD3 LYS 88 15.162 -21.895 -1.902 758 HE2 LYS 88 HE2 LYS 88 12.852 -19.957 -1.371 759 HE3 LYS 88 HE3 LYS 88 13.581 -20.987 -0.131 760 HZ1 LYS 88 HZ1 LYS 88 15.031 -18.893 -1.655 761 HZ2 LYS 88 HZ2 LYS 88 14.523 -18.724 -0.131 762 HZ3 LYS 88 HZ3 LYS 88 15.693 -19.825 -0.473 763 H THR 89 H THR 89 11.755 -21.771 -6.760 764 HA THR 89 HA THR 89 12.461 -24.055 -8.568 765 HB THR 89 HB THR 89 10.309 -23.805 -6.431 766 HG1 THR 89 HG1 THR 89 11.496 -25.470 -5.474 767 HG21 THR 89 HG21 THR 89 10.928 -26.071 -8.357 768 HG22 THR 89 HG22 THR 89 9.875 -26.206 -6.918 769 HG23 THR 89 HG23 THR 89 9.420 -25.127 -8.243 770 H ILE 90 H ILE 90 9.950 -21.614 -7.751 771 HA ILE 90 HA ILE 90 8.634 -21.841 -10.374 772 HB ILE 90 HB ILE 90 8.299 -19.584 -8.366 773 HG12 ILE 90 HG12 ILE 90 6.925 -22.306 -8.271 774 HG13 ILE 90 HG13 ILE 90 8.029 -21.642 -7.061 775 HG21 ILE 90 HG21 ILE 90 6.353 -20.853 -10.358 776 HG22 ILE 90 HG22 ILE 90 6.020 -19.446 -9.326 777 HG23 ILE 90 HG23 ILE 90 7.191 -19.309 -10.600 778 HD11 ILE 90 HD11 ILE 90 5.225 -20.669 -7.640 779 HD12 ILE 90 HD12 ILE 90 5.859 -21.419 -6.171 780 HD13 ILE 90 HD13 ILE 90 6.401 -19.790 -6.626 781 H LYS 91 H LYS 91 8.599 -20.016 -11.871 782 HA LYS 91 HA LYS 91 9.485 -18.494 -13.273 783 HB2 LYS 91 HB2 LYS 91 11.224 -17.531 -10.975 784 HB3 LYS 91 HB3 LYS 91 10.874 -16.644 -12.429 785 HG2 LYS 91 HG2 LYS 91 8.569 -17.421 -10.611 786 HG3 LYS 91 HG3 LYS 91 9.671 -16.148 -10.134 787 HD2 LYS 91 HD2 LYS 91 7.747 -15.180 -11.202 788 HD3 LYS 91 HD3 LYS 91 9.199 -14.866 -12.158 789 HE2 LYS 91 HE2 LYS 91 8.575 -16.691 -13.715 790 HE3 LYS 91 HE3 LYS 91 7.144 -17.051 -12.735 791 HZ1 LYS 91 HZ1 LYS 91 7.652 -14.476 -14.141 792 HZ2 LYS 91 HZ2 LYS 91 6.604 -15.623 -14.636 793 HZ3 LYS 91 HZ3 LYS 91 6.323 -14.810 -13.251 794 H MET 92 H MET 92 11.812 -20.606 -11.766 795 HA MET 92 HA MET 92 14.009 -19.641 -13.393 796 HB2 MET 92 HB2 MET 92 15.393 -21.118 -12.139 797 HB3 MET 92 HB3 MET 92 14.276 -20.291 -11.064 798 HG2 MET 92 HG2 MET 92 14.313 -22.442 -10.234 799 HG3 MET 92 HG3 MET 92 12.827 -22.418 -11.175 800 HE1 MET 92 HE1 MET 92 12.775 -25.090 -10.950 801 HE2 MET 92 HE2 MET 92 14.128 -26.139 -11.418 802 HE3 MET 92 HE3 MET 92 14.299 -25.039 -10.032 803 H PHE 93 H PHE 93 11.736 -22.271 -13.804 804 HA PHE 93 HA PHE 93 13.333 -23.262 -16.105 805 HB2 PHE 93 HB2 PHE 93 12.197 -25.323 -15.953 806 HB3 PHE 93 HB3 PHE 93 12.760 -24.904 -14.352 807 HD1 PHE 93 HD1 PHE 93 9.801 -25.415 -16.501 808 HD2 PHE 93 HD2 PHE 93 11.155 -24.328 -12.557 809 HE1 PHE 93 HE1 PHE 93 7.510 -25.775 -15.615 810 HE2 PHE 93 HE2 PHE 93 8.860 -24.683 -11.672 811 HZ PHE 93 HZ PHE 93 7.035 -25.408 -13.199 812 H GLU 94 H GLU 94 10.641 -21.294 -15.522 813 HA GLU 94 HA GLU 94 9.108 -22.121 -17.885 814 HB2 GLU 94 HB2 GLU 94 8.589 -19.972 -15.799 815 HB3 GLU 94 HB3 GLU 94 7.436 -20.515 -17.025 816 HG2 GLU 94 HG2 GLU 94 7.396 -22.769 -16.058 817 HG3 GLU 94 HG3 GLU 94 8.587 -22.301 -14.838 818 H ASP 95 H ASP 95 11.745 -20.366 -17.840 819 HA ASP 95 HA ASP 95 10.869 -17.926 -19.161 820 HB2 ASP 95 HB2 ASP 95 12.618 -18.006 -17.398 821 HB3 ASP 95 HB3 ASP 95 13.675 -18.876 -18.510 822 H ASP 96 H ASP 96 10.035 -19.839 -20.811 823 HA ASP 96 HA ASP 96 11.881 -20.406 -23.011 824 HB2 ASP 96 HB2 ASP 96 8.856 -20.642 -22.785 825 HB3 ASP 96 HB3 ASP 96 9.802 -21.159 -24.178 826 H VAL 97 H VAL 97 12.147 -19.376 -24.911 827 HA VAL 97 HA VAL 97 10.426 -17.041 -25.643 828 HB VAL 97 HB VAL 97 13.470 -17.017 -25.746 829 HG11 VAL 97 HG11 VAL 97 11.428 -14.869 -26.472 830 HG12 VAL 97 HG12 VAL 97 13.190 -14.638 -26.402 831 HG13 VAL 97 HG13 VAL 97 12.500 -15.724 -27.605 832 HG21 VAL 97 HG21 VAL 97 12.726 -16.682 -23.434 833 HG22 VAL 97 HG22 VAL 97 13.310 -15.160 -24.106 834 HG23 VAL 97 HG23 VAL 97 11.561 -15.447 -23.963 835 H SER 98 H SER 98 13.078 -19.133 -26.848 836 HA SER 98 HA SER 98 11.886 -19.071 -29.578 837 HB2 SER 98 HB2 SER 98 14.224 -19.425 -30.338 838 HB3 SER 98 HB3 SER 98 13.983 -17.923 -29.434 839 HG SER 98 HG SER 98 15.861 -19.062 -28.747 840 H SER 99 H SER 99 11.299 -21.042 -27.345 841 HA SER 99 HA SER 99 11.127 -23.251 -26.907 842 HB2 SER 99 HB2 SER 99 9.914 -23.019 -29.146 843 HB3 SER 99 HB3 SER 99 11.307 -23.847 -29.863 844 HG SER 99 HG SER 99 9.635 -25.304 -29.227 845 H ALA 100 H ALA 100 13.571 -22.333 -26.432 846 HA ALA 100 HA ALA 100 15.384 -24.639 -26.926 847 HB1 ALA 100 HB1 ALA 100 16.144 -21.692 -27.104 848 HB2 ALA 100 HB2 ALA 100 17.251 -23.071 -27.264 849 HB3 ALA 100 HB3 ALA 100 15.988 -22.804 -28.482 850 H SER 101 H SER 101 17.167 -24.736 -25.357 851 HA SER 101 HA SER 101 16.478 -23.667 -22.649 852 HB2 SER 101 HB2 SER 101 15.641 -26.000 -22.997 853 HB3 SER 101 HB3 SER 101 17.319 -26.525 -23.244 854 HG SER 101 HG SER 101 16.493 -26.728 -21.044 855 H ALA 102 H ALA 102 18.292 -24.095 -21.085 856 HA ALA 102 HA ALA 102 20.654 -22.728 -22.097 857 HB1 ALA 102 HB1 ALA 102 19.869 -23.593 -19.292 858 HB2 ALA 102 HB2 ALA 102 21.151 -22.436 -19.719 859 HB3 ALA 102 HB3 ALA 102 19.455 -22.036 -20.053 860 H GLN 103 H GLN 103 20.399 -25.422 -23.014 861 HA GLN 103 HA GLN 103 21.484 -27.428 -23.295 862 HB2 GLN 103 HB2 GLN 103 23.657 -25.374 -22.994 863 HB3 GLN 103 HB3 GLN 103 24.024 -27.044 -23.458 864 HG2 GLN 103 HG2 GLN 103 22.826 -26.916 -25.479 865 HG3 GLN 103 HG3 GLN 103 21.890 -25.511 -24.969 866 HE21 GLN 103 HE21 GLN 103 24.353 -23.112 -25.864 867 HE22 GLN 103 HE22 GLN 103 22.904 -23.413 -24.908 868 HA PRO 104 HA PRO 104 21.970 -28.306 -18.734 869 HB2 PRO 104 HB2 PRO 104 20.066 -30.279 -18.535 870 HB3 PRO 104 HB3 PRO 104 19.711 -28.531 -18.423 871 HG2 PRO 104 HG2 PRO 104 19.465 -30.318 -20.865 872 HG3 PRO 104 HG3 PRO 104 18.259 -29.163 -20.210 873 HD2 PRO 104 HD2 PRO 104 19.907 -28.477 -22.251 874 HD3 PRO 104 HD3 PRO 104 19.501 -27.293 -20.976 875 H ASN 105 H ASN 105 23.967 -29.130 -18.892 876 HA ASN 105 HA ASN 105 24.340 -32.020 -19.444 877 HB2 ASN 105 HB2 ASN 105 24.745 -30.700 -21.560 878 HB3 ASN 105 HB3 ASN 105 26.013 -29.808 -20.721 879 HD21 ASN 105 HD21 ASN 105 28.063 -32.275 -22.306 880 HD22 ASN 105 HD22 ASN 105 27.462 -30.626 -22.419 881 H LEU 106 H LEU 106 24.155 -31.050 -16.958 882 HA LEU 106 HA LEU 106 26.946 -31.072 -15.891 883 HB2 LEU 106 HB2 LEU 106 25.672 -28.810 -15.974 884 HB3 LEU 106 HB3 LEU 106 24.748 -29.424 -14.616 885 HG LEU 106 HG LEU 106 27.787 -29.090 -14.763 886 HD11 LEU 106 HD11 LEU 106 25.681 -27.473 -13.267 887 HD12 LEU 106 HD12 LEU 106 27.440 -27.209 -13.218 888 HD13 LEU 106 HD13 LEU 106 26.552 -26.955 -14.728 889 HD21 LEU 106 HD21 LEU 106 27.280 -30.862 -13.152 890 HD22 LEU 106 HD22 LEU 106 27.770 -29.398 -12.299 891 HD23 LEU 106 HD23 LEU 106 26.049 -29.837 -12.375 892 HA PRO 107 HA PRO 107 24.396 -34.538 -14.089 893 HB2 PRO 107 HB2 PRO 107 26.092 -36.614 -14.595 894 HB3 PRO 107 HB3 PRO 107 24.950 -35.965 -15.812 895 HG2 PRO 107 HG2 PRO 107 27.898 -35.307 -15.490 896 HG3 PRO 107 HG3 PRO 107 27.020 -35.759 -16.988 897 HD2 PRO 107 HD2 PRO 107 27.517 -33.162 -16.335 898 HD3 PRO 107 HD3 PRO 107 25.997 -33.652 -17.143 Start of MODEL 11 1 H1 GLY -5 H1 GLY -5 -44.982 -28.785 71.769 2 H2 GLY -5 H2 GLY -5 -45.800 -28.721 73.186 3 H3 GLY -5 H3 GLY -5 -44.458 -27.803 72.971 4 HA2 GLY -5 HA2 GLY -5 -46.411 -26.420 72.804 5 HA3 GLY -5 HA3 GLY -5 -45.541 -26.503 71.262 6 H SER -4 H SER -4 -47.374 -26.060 70.011 7 HA SER -4 HA SER -4 -49.220 -28.328 69.544 8 HB2 SER -4 HB2 SER -4 -51.184 -26.843 69.544 9 HB3 SER -4 HB3 SER -4 -50.427 -26.937 71.140 10 HG SER -4 HG SER -4 -50.948 -24.778 70.576 11 H HIS -3 H HIS -3 -50.409 -28.141 67.513 12 HA HIS -3 HA HIS -3 -49.350 -26.224 65.499 13 HB2 HIS -3 HB2 HIS -3 -47.913 -28.284 65.512 14 HB3 HIS -3 HB3 HIS -3 -49.324 -29.241 65.086 15 HD2 HIS -3 HD2 HIS -3 -50.591 -28.180 62.621 16 HE1 HIS -3 HE1 HIS -3 -46.774 -27.302 60.946 17 HE2 HIS -3 HE2 HIS -3 -49.254 -27.642 60.435 18 H MET -2 H MET -2 -51.157 -25.249 64.858 19 HA MET -2 HA MET -2 -53.397 -26.824 63.722 20 HB2 MET -2 HB2 MET -2 -53.750 -24.684 65.865 21 HB3 MET -2 HB3 MET -2 -55.052 -25.303 64.837 22 HG2 MET -2 HG2 MET -2 -54.594 -27.603 65.673 23 HG3 MET -2 HG3 MET -2 -53.426 -26.926 66.815 24 HE1 MET -2 HE1 MET -2 -54.741 -28.278 68.718 25 HE2 MET -2 HE2 MET -2 -56.479 -28.077 69.036 26 HE3 MET -2 HE3 MET -2 -55.936 -28.837 67.525 27 H ALA -1 H ALA -1 -51.732 -25.943 62.036 28 HA ALA -1 HA ALA -1 -52.697 -23.324 60.984 29 HB1 ALA -1 HB1 ALA -1 -49.852 -24.379 61.026 30 HB2 ALA -1 HB2 ALA -1 -50.385 -22.808 60.383 31 HB3 ALA -1 HB3 ALA -1 -50.501 -23.132 62.124 32 H SER 0 H SER 0 -53.492 -26.007 60.309 33 HA SER 0 HA SER 0 -52.198 -26.598 57.723 34 HB2 SER 0 HB2 SER 0 -53.727 -28.368 59.639 35 HB3 SER 0 HB3 SER 0 -52.837 -28.915 58.198 36 HG SER 0 HG SER 0 -51.590 -29.139 60.093 37 H MET 1 H MET 1 -54.710 -24.853 58.060 38 HA MET 1 HA MET 1 -56.168 -25.990 55.767 39 HB2 MET 1 HB2 MET 1 -58.367 -25.996 56.862 40 HB3 MET 1 HB3 MET 1 -57.270 -27.113 57.664 41 HG2 MET 1 HG2 MET 1 -56.862 -25.513 59.463 42 HG3 MET 1 HG3 MET 1 -57.842 -24.287 58.660 43 HE1 MET 1 HE1 MET 1 -60.500 -25.558 57.722 44 HE2 MET 1 HE2 MET 1 -61.480 -25.391 59.193 45 HE3 MET 1 HE3 MET 1 -60.369 -24.090 58.719 46 H ASP 2 H ASP 2 -55.284 -23.272 57.497 47 HA ASP 2 HA ASP 2 -56.920 -21.466 55.747 48 HB2 ASP 2 HB2 ASP 2 -57.808 -21.753 58.096 49 HB3 ASP 2 HB3 ASP 2 -56.310 -21.043 58.695 50 H GLN 3 H GLN 3 -53.940 -22.455 56.143 51 HA GLN 3 HA GLN 3 -52.584 -19.874 55.579 52 HB2 GLN 3 HB2 GLN 3 -52.574 -20.392 58.039 53 HB3 GLN 3 HB3 GLN 3 -51.756 -21.897 57.695 54 HG2 GLN 3 HG2 GLN 3 -50.199 -19.781 56.479 55 HG3 GLN 3 HG3 GLN 3 -50.686 -19.219 58.070 56 HE21 GLN 3 HE21 GLN 3 -48.401 -22.679 57.908 57 HE22 GLN 3 HE22 GLN 3 -49.525 -22.304 56.596 58 H LEU 4 H LEU 4 -53.402 -22.117 53.878 59 HA LEU 4 HA LEU 4 -50.815 -23.382 53.065 60 HB2 LEU 4 HB2 LEU 4 -53.714 -24.171 52.829 61 HB3 LEU 4 HB3 LEU 4 -52.580 -24.697 51.593 62 HG LEU 4 HG LEU 4 -51.188 -25.850 53.187 63 HD11 LEU 4 HD11 LEU 4 -53.149 -24.925 55.325 64 HD12 LEU 4 HD12 LEU 4 -51.908 -26.189 55.533 65 HD13 LEU 4 HD13 LEU 4 -51.414 -24.531 55.223 66 HD21 LEU 4 HD21 LEU 4 -53.142 -27.015 52.208 67 HD22 LEU 4 HD22 LEU 4 -52.757 -27.625 53.825 68 HD23 LEU 4 HD23 LEU 4 -54.132 -26.521 53.600 69 H ASP 5 H ASP 5 -49.839 -21.744 51.977 70 HA ASP 5 HA ASP 5 -50.783 -21.148 49.252 71 HB2 ASP 5 HB2 ASP 5 -50.101 -19.032 51.340 72 HB3 ASP 5 HB3 ASP 5 -50.002 -18.753 49.604 73 H GLU 6 H GLU 6 -49.178 -22.363 48.396 74 HA GLU 6 HA GLU 6 -46.380 -22.094 49.226 75 HB2 GLU 6 HB2 GLU 6 -45.833 -23.555 47.405 76 HB3 GLU 6 HB3 GLU 6 -47.179 -24.214 48.335 77 HG2 GLU 6 HG2 GLU 6 -48.759 -23.328 46.578 78 HG3 GLU 6 HG3 GLU 6 -47.358 -22.806 45.638 79 H ILE 7 H ILE 7 -44.713 -21.059 48.121 80 HA ILE 7 HA ILE 7 -45.511 -18.907 46.233 81 HB ILE 7 HB ILE 7 -43.672 -18.169 48.489 82 HG12 ILE 7 HG12 ILE 7 -45.816 -17.150 49.617 83 HG13 ILE 7 HG13 ILE 7 -46.671 -18.501 48.888 84 HG21 ILE 7 HG21 ILE 7 -45.820 -16.657 46.942 85 HG22 ILE 7 HG22 ILE 7 -44.610 -15.959 48.041 86 HG23 ILE 7 HG23 ILE 7 -44.096 -16.693 46.520 87 HD11 ILE 7 HD11 ILE 7 -44.229 -18.691 50.734 88 HD12 ILE 7 HD12 ILE 7 -45.915 -18.929 51.224 89 HD13 ILE 7 HD13 ILE 7 -45.156 -20.074 50.108 90 H ILE 8 H ILE 8 -44.363 -21.081 45.274 91 HA ILE 8 HA ILE 8 -41.428 -20.560 44.972 92 HB ILE 8 HB ILE 8 -42.889 -23.205 44.690 93 HG12 ILE 8 HG12 ILE 8 -41.100 -22.190 46.949 94 HG13 ILE 8 HG13 ILE 8 -42.842 -22.436 47.054 95 HG21 ILE 8 HG21 ILE 8 -39.900 -22.541 44.708 96 HG22 ILE 8 HG22 ILE 8 -40.616 -24.157 44.522 97 HG23 ILE 8 HG23 ILE 8 -40.840 -22.964 43.260 98 HD11 ILE 8 HD11 ILE 8 -40.752 -24.609 46.734 99 HD12 ILE 8 HD12 ILE 8 -41.808 -24.291 48.115 100 HD13 ILE 8 HD13 ILE 8 -42.510 -24.875 46.594 101 H GLU 9 H GLU 9 -41.474 -19.167 43.287 102 HA GLU 9 HA GLU 9 -42.434 -20.196 40.634 103 HB2 GLU 9 HB2 GLU 9 -42.457 -17.323 41.646 104 HB3 GLU 9 HB3 GLU 9 -42.728 -17.831 39.983 105 HG2 GLU 9 HG2 GLU 9 -44.868 -17.497 40.791 106 HG3 GLU 9 HG3 GLU 9 -44.669 -19.242 40.773 107 H GLN 10 H GLN 10 -40.319 -21.220 40.570 108 HA GLN 10 HA GLN 10 -38.234 -19.371 39.511 109 HB2 GLN 10 HB2 GLN 10 -36.495 -20.524 40.697 110 HB3 GLN 10 HB3 GLN 10 -37.688 -19.897 41.828 111 HG2 GLN 10 HG2 GLN 10 -38.666 -22.151 42.102 112 HG3 GLN 10 HG3 GLN 10 -37.542 -22.803 40.904 113 HE21 GLN 10 HE21 GLN 10 -34.733 -22.805 43.148 114 HE22 GLN 10 HE22 GLN 10 -35.179 -22.773 41.447 115 H ILE 11 H ILE 11 -40.201 -21.520 38.384 116 HA ILE 11 HA ILE 11 -38.216 -23.102 36.798 117 HB ILE 11 HB ILE 11 -39.984 -24.864 36.685 118 HG12 ILE 11 HG12 ILE 11 -41.195 -23.478 39.128 119 HG13 ILE 11 HG13 ILE 11 -41.919 -23.396 37.527 120 HG21 ILE 11 HG21 ILE 11 -38.847 -24.208 39.438 121 HG22 ILE 11 HG22 ILE 11 -39.260 -25.822 38.819 122 HG23 ILE 11 HG23 ILE 11 -37.929 -24.920 38.098 123 HD11 ILE 11 HD11 ILE 11 -41.505 -25.923 39.167 124 HD12 ILE 11 HD12 ILE 11 -43.033 -25.113 38.792 125 HD13 ILE 11 HD13 ILE 11 -42.106 -25.886 37.491 126 H GLN 12 H GLN 12 -38.103 -21.405 35.341 127 HA GLN 12 HA GLN 12 -40.292 -21.353 33.324 128 HB2 GLN 12 HB2 GLN 12 -40.191 -18.973 33.125 129 HB3 GLN 12 HB3 GLN 12 -40.584 -19.427 34.769 130 HG2 GLN 12 HG2 GLN 12 -37.838 -18.473 33.828 131 HG3 GLN 12 HG3 GLN 12 -39.057 -17.480 34.611 132 HE21 GLN 12 HE21 GLN 12 -36.621 -19.729 36.928 133 HE22 GLN 12 HE22 GLN 12 -36.322 -19.463 35.218 134 H LYS 13 H LYS 13 -37.910 -22.898 33.177 135 HA LYS 13 HA LYS 13 -36.245 -23.485 31.716 136 HB2 LYS 13 HB2 LYS 13 -38.197 -22.151 29.813 137 HB3 LYS 13 HB3 LYS 13 -36.855 -23.186 29.306 138 HG2 LYS 13 HG2 LYS 13 -37.733 -25.068 30.604 139 HG3 LYS 13 HG3 LYS 13 -39.095 -24.098 31.166 140 HD2 LYS 13 HD2 LYS 13 -38.540 -24.732 28.236 141 HD3 LYS 13 HD3 LYS 13 -39.622 -25.663 29.283 142 HE2 LYS 13 HE2 LYS 13 -40.969 -23.605 29.710 143 HE3 LYS 13 HE3 LYS 13 -39.936 -22.707 28.590 144 HZ1 LYS 13 HZ1 LYS 13 -41.590 -25.067 27.860 145 HZ2 LYS 13 HZ2 LYS 13 -41.947 -23.520 27.493 146 HZ3 LYS 13 HZ3 LYS 13 -40.642 -24.233 26.824 147 H GLU 14 H GLU 14 -35.448 -21.429 33.129 148 HA GLU 14 HA GLU 14 -33.916 -19.821 33.362 149 HB2 GLU 14 HB2 GLU 14 -32.860 -21.961 31.741 150 HB3 GLU 14 HB3 GLU 14 -32.052 -20.479 31.251 151 HG2 GLU 14 HG2 GLU 14 -31.543 -19.973 33.616 152 HG3 GLU 14 HG3 GLU 14 -32.384 -21.451 34.111 153 H ALA 15 H ALA 15 -36.051 -18.893 31.740 154 HA ALA 15 HA ALA 15 -35.047 -17.304 29.660 155 HB1 ALA 15 HB1 ALA 15 -37.656 -17.202 31.215 156 HB2 ALA 15 HB2 ALA 15 -37.407 -16.510 29.586 157 HB3 ALA 15 HB3 ALA 15 -37.299 -18.269 29.843 158 H ILE 16 H ILE 16 -34.038 -16.653 32.487 159 HA ILE 16 HA ILE 16 -34.180 -13.685 32.306 160 HB ILE 16 HB ILE 16 -34.115 -15.581 34.650 161 HG12 ILE 16 HG12 ILE 16 -36.131 -13.745 35.170 162 HG13 ILE 16 HG13 ILE 16 -36.182 -13.798 33.421 163 HG21 ILE 16 HG21 ILE 16 -33.724 -12.560 34.755 164 HG22 ILE 16 HG22 ILE 16 -34.163 -13.551 36.173 165 HG23 ILE 16 HG23 ILE 16 -32.628 -13.821 35.375 166 HD11 ILE 16 HD11 ILE 16 -36.399 -16.186 35.315 167 HD12 ILE 16 HD12 ILE 16 -37.738 -15.393 34.464 168 HD13 ILE 16 HD13 ILE 16 -36.515 -16.282 33.544 169 H ASN 17 H ASN 17 -32.276 -15.953 31.341 170 HA ASN 17 HA ASN 17 -29.745 -14.859 32.375 171 HB2 ASN 17 HB2 ASN 17 -28.660 -16.705 31.521 172 HB3 ASN 17 HB3 ASN 17 -30.229 -17.382 31.922 173 HD21 ASN 17 HD21 ASN 17 -31.008 -18.031 28.456 174 HD22 ASN 17 HD22 ASN 17 -31.711 -17.879 30.062 175 H SER 18 H SER 18 -31.787 -13.952 29.927 176 HA SER 18 HA SER 18 -29.606 -12.982 28.093 177 HB2 SER 18 HB2 SER 18 -31.093 -14.695 27.152 178 HB3 SER 18 HB3 SER 18 -32.498 -13.661 27.470 179 HG SER 18 HG SER 18 -31.711 -13.463 25.310 180 H ASN 19 H ASN 19 -32.844 -12.048 29.327 181 HA ASN 19 HA ASN 19 -32.872 -9.406 28.370 182 HB2 ASN 19 HB2 ASN 19 -34.713 -9.097 29.969 183 HB3 ASN 19 HB3 ASN 19 -34.863 -10.639 29.139 184 HD21 ASN 19 HD21 ASN 19 -35.580 -11.322 32.687 185 HD22 ASN 19 HD22 ASN 19 -36.330 -10.372 31.404 186 H VAL 20 H VAL 20 -31.188 -10.632 31.084 187 HA VAL 20 HA VAL 20 -30.551 -7.909 32.092 188 HB VAL 20 HB VAL 20 -31.586 -9.773 33.524 189 HG11 VAL 20 HG11 VAL 20 -28.699 -10.631 33.878 190 HG12 VAL 20 HG12 VAL 20 -30.145 -11.279 34.671 191 HG13 VAL 20 HG13 VAL 20 -29.910 -11.536 32.936 192 HG21 VAL 20 HG21 VAL 20 -30.811 -7.614 34.408 193 HG22 VAL 20 HG22 VAL 20 -30.528 -8.945 35.539 194 HG23 VAL 20 HG23 VAL 20 -29.174 -8.277 34.609 195 H VAL 21 H VAL 21 -29.147 -10.107 30.026 196 HA VAL 21 HA VAL 21 -26.411 -9.040 30.486 197 HB VAL 21 HB VAL 21 -26.793 -11.966 29.796 198 HG11 VAL 21 HG11 VAL 21 -24.447 -10.382 30.959 199 HG12 VAL 21 HG12 VAL 21 -24.441 -12.108 30.537 200 HG13 VAL 21 HG13 VAL 21 -24.586 -10.897 29.264 201 HG21 VAL 21 HG21 VAL 21 -27.730 -11.817 32.007 202 HG22 VAL 21 HG22 VAL 21 -26.115 -12.494 32.137 203 HG23 VAL 21 HG23 VAL 21 -26.384 -10.790 32.571 204 H LEU 22 H LEU 22 -27.756 -7.730 28.795 205 HA LEU 22 HA LEU 22 -27.195 -8.803 26.065 206 HB2 LEU 22 HB2 LEU 22 -29.626 -8.442 26.769 207 HB3 LEU 22 HB3 LEU 22 -29.263 -6.720 26.812 208 HG LEU 22 HG LEU 22 -28.640 -6.860 24.361 209 HD11 LEU 22 HD11 LEU 22 -29.776 -9.679 24.643 210 HD12 LEU 22 HD12 LEU 22 -29.504 -8.848 23.099 211 HD13 LEU 22 HD13 LEU 22 -28.128 -9.256 24.131 212 HD21 LEU 22 HD21 LEU 22 -30.871 -6.114 25.096 213 HD22 LEU 22 HD22 LEU 22 -30.962 -7.008 23.570 214 HD23 LEU 22 HD23 LEU 22 -31.442 -7.798 25.089 215 H LYS 23 H LYS 23 -26.086 -7.605 24.637 216 HA LYS 23 HA LYS 23 -24.980 -4.937 25.445 217 HB2 LYS 23 HB2 LYS 23 -23.430 -7.292 24.294 218 HB3 LYS 23 HB3 LYS 23 -22.796 -5.655 24.509 219 HG2 LYS 23 HG2 LYS 23 -23.248 -5.812 26.961 220 HG3 LYS 23 HG3 LYS 23 -23.717 -7.510 26.734 221 HD2 LYS 23 HD2 LYS 23 -21.458 -8.026 25.845 222 HD3 LYS 23 HD3 LYS 23 -21.016 -6.320 25.960 223 HE2 LYS 23 HE2 LYS 23 -20.026 -7.391 27.829 224 HE3 LYS 23 HE3 LYS 23 -21.357 -6.404 28.435 225 HZ1 LYS 23 HZ1 LYS 23 -21.473 -9.345 27.987 226 HZ2 LYS 23 HZ2 LYS 23 -21.323 -8.623 29.442 227 HZ3 LYS 23 HZ3 LYS 23 -22.699 -8.438 28.586 228 H ASN 24 H ASN 24 -27.191 -5.212 23.816 229 HA ASN 24 HA ASN 24 -28.129 -4.697 21.806 230 HB2 ASN 24 HB2 ASN 24 -27.160 -2.574 22.795 231 HB3 ASN 24 HB3 ASN 24 -25.844 -2.709 21.626 232 HD21 ASN 24 HD21 ASN 24 -27.921 -1.791 18.844 233 HD22 ASN 24 HD22 ASN 24 -26.527 -2.789 19.291 234 HA PRO 25 HA PRO 25 -25.065 -7.238 19.359 235 HB2 PRO 25 HB2 PRO 25 -26.546 -9.477 18.867 236 HB3 PRO 25 HB3 PRO 25 -25.722 -9.166 20.421 237 HG2 PRO 25 HG2 PRO 25 -28.630 -8.607 19.734 238 HG3 PRO 25 HG3 PRO 25 -27.978 -9.498 21.147 239 HD2 PRO 25 HD2 PRO 25 -28.636 -6.867 21.306 240 HD3 PRO 25 HD3 PRO 25 -27.201 -7.514 22.157 241 H ARG 26 H ARG 26 -25.260 -5.525 17.876 242 HA ARG 26 HA ARG 26 -26.866 -6.153 15.404 243 HB2 ARG 26 HB2 ARG 26 -26.262 -3.439 16.665 244 HB3 ARG 26 HB3 ARG 26 -26.912 -3.641 15.044 245 HG2 ARG 26 HG2 ARG 26 -28.314 -4.547 17.599 246 HG3 ARG 26 HG3 ARG 26 -28.637 -3.061 16.699 247 HD2 ARG 26 HD2 ARG 26 -29.179 -4.456 14.679 248 HD3 ARG 26 HD3 ARG 26 -29.044 -5.905 15.697 249 HE ARG 26 HE ARG 26 -30.830 -4.199 17.024 250 HH11 ARG 26 HH11 ARG 26 -33.046 -4.297 16.858 251 HH12 ARG 26 HH12 ARG 26 -33.782 -5.053 15.476 252 HH21 ARG 26 HH21 ARG 26 -30.825 -5.857 13.937 253 HH22 ARG 26 HH22 ARG 26 -32.565 -5.909 13.858 254 H VAL 27 H VAL 27 -23.881 -4.629 16.614 255 HA VAL 27 HA VAL 27 -22.598 -5.145 13.949 256 HB VAL 27 HB VAL 27 -22.198 -2.621 15.584 257 HG11 VAL 27 HG11 VAL 27 -21.308 -3.416 12.767 258 HG12 VAL 27 HG12 VAL 27 -21.038 -1.841 13.542 259 HG13 VAL 27 HG13 VAL 27 -20.241 -3.278 14.181 260 HG21 VAL 27 HG21 VAL 27 -24.441 -2.529 14.629 261 HG22 VAL 27 HG22 VAL 27 -23.370 -1.474 13.716 262 HG23 VAL 27 HG23 VAL 27 -23.823 -3.055 13.044 263 HA PRO 28 HA PRO 28 -19.744 -6.905 17.100 264 HB2 PRO 28 HB2 PRO 28 -19.147 -9.249 15.862 265 HB3 PRO 28 HB3 PRO 28 -20.622 -9.019 16.854 266 HG2 PRO 28 HG2 PRO 28 -20.360 -8.866 13.840 267 HG3 PRO 28 HG3 PRO 28 -21.605 -9.722 14.796 268 HD2 PRO 28 HD2 PRO 28 -22.019 -7.232 13.726 269 HD3 PRO 28 HD3 PRO 28 -22.750 -7.729 15.278 270 H THR 29 H THR 29 -17.493 -7.367 16.931 271 HA THR 29 HA THR 29 -16.086 -5.622 15.112 272 HB THR 29 HB THR 29 -14.125 -6.406 16.595 273 HG1 THR 29 HG1 THR 29 -14.745 -7.381 18.515 274 HG21 THR 29 HG21 THR 29 -16.538 -5.093 17.920 275 HG22 THR 29 HG22 THR 29 -14.851 -4.998 18.474 276 HG23 THR 29 HG23 THR 29 -15.315 -4.266 16.931 277 H GLN 30 H GLN 30 -16.930 -7.070 13.366 278 HA GLN 30 HA GLN 30 -15.383 -9.429 12.797 279 HB2 GLN 30 HB2 GLN 30 -16.982 -9.742 10.977 280 HB3 GLN 30 HB3 GLN 30 -17.832 -9.188 12.418 281 HG2 GLN 30 HG2 GLN 30 -17.455 -6.763 11.326 282 HG3 GLN 30 HG3 GLN 30 -17.255 -7.693 9.846 283 HE21 GLN 30 HE21 GLN 30 -20.957 -7.270 11.551 284 HE22 GLN 30 HE22 GLN 30 -19.515 -6.789 12.452 285 H LYS 31 H LYS 31 -13.919 -6.877 12.729 286 HA LYS 31 HA LYS 31 -13.551 -6.186 9.916 287 HB2 LYS 31 HB2 LYS 31 -14.016 -4.682 12.026 288 HB3 LYS 31 HB3 LYS 31 -12.291 -4.795 12.287 289 HG2 LYS 31 HG2 LYS 31 -12.303 -2.895 11.031 290 HG3 LYS 31 HG3 LYS 31 -12.228 -4.023 9.682 291 HD2 LYS 31 HD2 LYS 31 -14.751 -2.755 10.849 292 HD3 LYS 31 HD3 LYS 31 -13.925 -2.178 9.414 293 HE2 LYS 31 HE2 LYS 31 -15.105 -4.988 9.621 294 HE3 LYS 31 HE3 LYS 31 -16.039 -3.592 9.094 295 HZ1 LYS 31 HZ1 LYS 31 -13.570 -4.525 7.730 296 HZ2 LYS 31 HZ2 LYS 31 -15.097 -4.765 7.197 297 HZ3 LYS 31 HZ3 LYS 31 -14.492 -3.256 7.274 298 H THR 32 H THR 32 -12.507 -8.515 9.977 299 HA THR 32 HA THR 32 -9.592 -8.366 10.493 300 HB THR 32 HB THR 32 -11.013 -10.013 11.671 301 HG1 THR 32 HG1 THR 32 -9.604 -11.713 11.415 302 HG21 THR 32 HG21 THR 32 -11.244 -11.396 8.962 303 HG22 THR 32 HG22 THR 32 -11.795 -12.026 10.529 304 HG23 THR 32 HG23 THR 32 -12.572 -10.599 9.834 305 H GLY 33 H GLY 33 -11.508 -8.197 7.835 306 HA2 GLY 33 HA2 GLY 33 -9.653 -9.503 5.901 307 HA3 GLY 33 HA3 GLY 33 -11.229 -8.808 5.537 308 H GLU 34 H GLU 34 -11.432 -6.519 5.460 309 HA GLU 34 HA GLU 34 -10.984 -4.431 4.829 310 HB2 GLU 34 HB2 GLU 34 -8.352 -4.702 6.298 311 HB3 GLU 34 HB3 GLU 34 -9.138 -3.204 5.801 312 HG2 GLU 34 HG2 GLU 34 -11.136 -3.866 7.205 313 HG3 GLU 34 HG3 GLU 34 -10.163 -5.183 7.864 314 H LEU 35 H LEU 35 -9.643 -6.770 3.120 315 HA LEU 35 HA LEU 35 -9.091 -4.810 1.018 316 HB2 LEU 35 HB2 LEU 35 -7.210 -7.116 1.681 317 HB3 LEU 35 HB3 LEU 35 -7.383 -6.477 0.057 318 HG LEU 35 HG LEU 35 -7.018 -4.141 1.481 319 HD11 LEU 35 HD11 LEU 35 -5.133 -6.216 2.675 320 HD12 LEU 35 HD12 LEU 35 -5.074 -4.459 2.933 321 HD13 LEU 35 HD13 LEU 35 -6.445 -5.397 3.551 322 HD21 LEU 35 HD21 LEU 35 -5.970 -4.737 -0.647 323 HD22 LEU 35 HD22 LEU 35 -4.769 -4.137 0.508 324 HD23 LEU 35 HD23 LEU 35 -4.899 -5.884 0.183 325 H SER 36 H SER 36 -10.466 -5.119 -0.460 326 HA SER 36 HA SER 36 -11.492 -7.868 -1.115 327 HB2 SER 36 HB2 SER 36 -13.151 -5.354 -0.851 328 HB3 SER 36 HB3 SER 36 -13.721 -6.926 -1.449 329 HG SER 36 HG SER 36 -14.182 -6.652 0.775 330 H GLU 37 H GLU 37 -11.884 -4.644 -2.498 331 HA GLU 37 HA GLU 37 -10.945 -5.650 -5.123 332 HB2 GLU 37 HB2 GLU 37 -13.561 -6.080 -4.271 333 HB3 GLU 37 HB3 GLU 37 -13.727 -4.519 -5.086 334 HG2 GLU 37 HG2 GLU 37 -12.588 -5.534 -7.091 335 HG3 GLU 37 HG3 GLU 37 -12.484 -7.061 -6.201 336 H GLU 38 H GLU 38 -11.796 -2.934 -3.083 337 HA GLU 38 HA GLU 38 -10.896 -1.026 -5.192 338 HB2 GLU 38 HB2 GLU 38 -11.904 -0.605 -2.353 339 HB3 GLU 38 HB3 GLU 38 -11.380 0.678 -3.451 340 HG2 GLU 38 HG2 GLU 38 -13.138 0.010 -5.077 341 HG3 GLU 38 HG3 GLU 38 -13.700 -1.237 -3.962 342 H GLN 39 H GLN 39 -9.742 -2.647 -2.240 343 HA GLN 39 HA GLN 39 -7.694 -0.672 -1.715 344 HB2 GLN 39 HB2 GLN 39 -8.137 -3.452 -0.563 345 HB3 GLN 39 HB3 GLN 39 -6.982 -2.261 0.033 346 HG2 GLN 39 HG2 GLN 39 -8.816 -1.982 1.455 347 HG3 GLN 39 HG3 GLN 39 -8.933 -0.644 0.332 348 HE21 GLN 39 HE21 GLN 39 -12.358 -1.594 0.355 349 HE22 GLN 39 HE22 GLN 39 -11.149 -0.532 1.087 350 H LYS 40 H LYS 40 -7.532 -3.985 -3.052 351 HA LYS 40 HA LYS 40 -4.658 -3.865 -3.477 352 HB2 LYS 40 HB2 LYS 40 -4.938 -5.965 -4.666 353 HB3 LYS 40 HB3 LYS 40 -5.780 -5.948 -3.121 354 HG2 LYS 40 HG2 LYS 40 -7.893 -5.249 -4.566 355 HG3 LYS 40 HG3 LYS 40 -6.912 -5.788 -5.925 356 HD2 LYS 40 HD2 LYS 40 -8.455 -7.535 -5.146 357 HD3 LYS 40 HD3 LYS 40 -6.780 -8.054 -4.927 358 HE2 LYS 40 HE2 LYS 40 -6.896 -7.671 -2.516 359 HE3 LYS 40 HE3 LYS 40 -8.452 -6.854 -2.650 360 HZ1 LYS 40 HZ1 LYS 40 -8.039 -9.707 -3.367 361 HZ2 LYS 40 HZ2 LYS 40 -8.655 -9.193 -1.942 362 HZ3 LYS 40 HZ3 LYS 40 -9.469 -8.895 -3.327 363 H LYS 41 H LYS 41 -7.391 -2.747 -5.373 364 HA LYS 41 HA LYS 41 -5.801 -1.972 -7.685 365 HB2 LYS 41 HB2 LYS 41 -8.439 -0.831 -6.676 366 HB3 LYS 41 HB3 LYS 41 -7.690 -0.465 -8.227 367 HG2 LYS 41 HG2 LYS 41 -7.835 -2.867 -8.859 368 HG3 LYS 41 HG3 LYS 41 -8.689 -3.188 -7.335 369 HD2 LYS 41 HD2 LYS 41 -10.422 -1.491 -8.003 370 HD3 LYS 41 HD3 LYS 41 -9.618 -1.293 -9.560 371 HE2 LYS 41 HE2 LYS 41 -10.754 -3.923 -8.498 372 HE3 LYS 41 HE3 LYS 41 -11.637 -2.814 -9.548 373 HZ1 LYS 41 HZ1 LYS 41 -9.108 -4.185 -10.290 374 HZ2 LYS 41 HZ2 LYS 41 -10.594 -4.555 -10.850 375 HZ3 LYS 41 HZ3 LYS 41 -9.915 -3.126 -11.243 376 H ILE 42 H ILE 42 -5.585 -0.832 -4.549 377 HA ILE 42 HA ILE 42 -4.135 1.608 -5.513 378 HB ILE 42 HB ILE 42 -5.186 0.872 -2.773 379 HG12 ILE 42 HG12 ILE 42 -5.867 3.483 -4.073 380 HG13 ILE 42 HG13 ILE 42 -6.543 2.076 -4.873 381 HG21 ILE 42 HG21 ILE 42 -3.475 3.265 -3.534 382 HG22 ILE 42 HG22 ILE 42 -4.342 3.065 -1.993 383 HG23 ILE 42 HG23 ILE 42 -3.047 1.952 -2.418 384 HD11 ILE 42 HD11 ILE 42 -6.885 2.683 -1.922 385 HD12 ILE 42 HD12 ILE 42 -8.107 2.894 -3.208 386 HD13 ILE 42 HD13 ILE 42 -7.525 1.275 -2.792 387 H VAL 43 H VAL 43 -3.774 -1.265 -3.319 388 HA VAL 43 HA VAL 43 -1.001 -0.773 -2.840 389 HB VAL 43 HB VAL 43 -2.470 -3.430 -2.634 390 HG11 VAL 43 HG11 VAL 43 0.090 -2.453 -1.283 391 HG12 VAL 43 HG12 VAL 43 -0.726 -4.004 -0.977 392 HG13 VAL 43 HG13 VAL 43 -0.002 -3.697 -2.547 393 HG21 VAL 43 HG21 VAL 43 -3.535 -1.619 -1.252 394 HG22 VAL 43 HG22 VAL 43 -2.859 -2.938 -0.314 395 HG23 VAL 43 HG23 VAL 43 -1.988 -1.398 -0.422 396 H ALA 44 H ALA 44 -2.435 -3.337 -4.946 397 HA ALA 44 HA ALA 44 0.198 -4.075 -5.919 398 HB1 ALA 44 HB1 ALA 44 -2.556 -4.889 -6.912 399 HB2 ALA 44 HB2 ALA 44 -0.999 -5.676 -7.286 400 HB3 ALA 44 HB3 ALA 44 -1.616 -5.699 -5.624 401 H ASP 45 H ASP 45 -2.428 -2.029 -7.136 402 HA ASP 45 HA ASP 45 -1.343 -1.362 -9.682 403 HB2 ASP 45 HB2 ASP 45 -3.561 -0.686 -8.814 404 HB3 ASP 45 HB3 ASP 45 -2.772 0.436 -7.696 405 H TYR 46 H TYR 46 -0.450 -0.025 -6.438 406 HA TYR 46 HA TYR 46 1.528 1.806 -7.493 407 HB2 TYR 46 HB2 TYR 46 0.206 1.696 -5.211 408 HB3 TYR 46 HB3 TYR 46 1.527 0.681 -4.665 409 HD1 TYR 46 HD1 TYR 46 3.418 2.710 -6.573 410 HD2 TYR 46 HD2 TYR 46 0.765 3.009 -3.215 411 HE1 TYR 46 HE1 TYR 46 4.446 4.847 -6.019 412 HE2 TYR 46 HE2 TYR 46 1.809 5.191 -2.598 413 HH TYR 46 HH TYR 46 4.423 6.677 -4.560 414 H ILE 47 H ILE 47 1.681 -1.569 -6.266 415 HA ILE 47 HA ILE 47 4.542 -1.836 -6.409 416 HB ILE 47 HB ILE 47 2.372 -3.934 -6.769 417 HG12 ILE 47 HG12 ILE 47 1.954 -3.426 -4.592 418 HG13 ILE 47 HG13 ILE 47 3.291 -4.491 -4.308 419 HG21 ILE 47 HG21 ILE 47 5.271 -4.404 -6.031 420 HG22 ILE 47 HG22 ILE 47 3.988 -5.619 -6.199 421 HG23 ILE 47 HG23 ILE 47 4.548 -4.747 -7.621 422 HD11 ILE 47 HD11 ILE 47 3.315 -1.444 -4.231 423 HD12 ILE 47 HD12 ILE 47 3.566 -2.579 -2.903 424 HD13 ILE 47 HD13 ILE 47 4.801 -2.426 -4.170 425 H SER 48 H SER 48 2.033 -2.103 -8.895 426 HA SER 48 HA SER 48 3.882 -2.660 -11.064 427 HB2 SER 48 HB2 SER 48 1.354 -3.146 -10.891 428 HB3 SER 48 HB3 SER 48 1.121 -1.447 -11.335 429 HG SER 48 HG SER 48 1.132 -2.865 -13.156 430 H GLU 49 H GLU 49 3.421 0.272 -9.275 431 HA GLU 49 HA GLU 49 3.807 2.023 -11.633 432 HB2 GLU 49 HB2 GLU 49 1.959 2.395 -9.972 433 HB3 GLU 49 HB3 GLU 49 3.192 2.736 -8.751 434 HG2 GLU 49 HG2 GLU 49 4.030 4.592 -10.133 435 HG3 GLU 49 HG3 GLU 49 2.797 4.239 -11.349 436 H VAL 50 H VAL 50 5.364 1.292 -8.465 437 HA VAL 50 HA VAL 50 7.821 2.712 -9.431 438 HB VAL 50 HB VAL 50 8.105 3.778 -7.303 439 HG11 VAL 50 HG11 VAL 50 5.245 4.243 -8.125 440 HG12 VAL 50 HG12 VAL 50 6.359 5.360 -7.310 441 HG13 VAL 50 HG13 VAL 50 6.664 4.883 -8.985 442 HG21 VAL 50 HG21 VAL 50 7.260 2.109 -5.764 443 HG22 VAL 50 HG22 VAL 50 6.416 3.644 -5.533 444 HG23 VAL 50 HG23 VAL 50 5.617 2.309 -6.393 445 H GLY 51 H GLY 51 6.718 -0.199 -7.967 446 HA2 GLY 51 HA2 GLY 51 8.428 -1.921 -8.655 447 HA3 GLY 51 HA3 GLY 51 9.578 -1.067 -7.627 448 H LEU 52 H LEU 52 9.000 -0.850 -5.355 449 HA LEU 52 HA LEU 52 6.960 -2.464 -4.127 450 HB2 LEU 52 HB2 LEU 52 8.815 -4.202 -4.721 451 HB3 LEU 52 HB3 LEU 52 9.818 -3.371 -3.547 452 HG LEU 52 HG LEU 52 7.851 -3.787 -1.864 453 HD11 LEU 52 HD11 LEU 52 7.154 -5.758 -4.089 454 HD12 LEU 52 HD12 LEU 52 6.523 -5.819 -2.440 455 HD13 LEU 52 HD13 LEU 52 6.124 -4.445 -3.470 456 HD21 LEU 52 HD21 LEU 52 9.994 -4.969 -1.745 457 HD22 LEU 52 HD22 LEU 52 8.638 -6.006 -1.323 458 HD23 LEU 52 HD23 LEU 52 9.408 -6.167 -2.926 459 H ASN 53 H ASN 53 10.083 -0.969 -3.658 460 HA ASN 53 HA ASN 53 9.415 -0.110 -0.897 461 HB2 ASN 53 HB2 ASN 53 12.092 -0.407 -2.318 462 HB3 ASN 53 HB3 ASN 53 11.875 -0.007 -0.619 463 HD21 ASN 53 HD21 ASN 53 12.085 -3.841 -1.535 464 HD22 ASN 53 HD22 ASN 53 12.646 -2.545 -2.579 465 H ASN 54 H ASN 54 9.568 1.359 -3.918 466 HA ASN 54 HA ASN 54 10.692 3.921 -2.978 467 HB2 ASN 54 HB2 ASN 54 9.590 3.146 -5.698 468 HB3 ASN 54 HB3 ASN 54 10.552 4.574 -5.323 469 HD21 ASN 54 HD21 ASN 54 12.429 1.140 -6.191 470 HD22 ASN 54 HD22 ASN 54 10.746 1.487 -6.587 471 H LEU 55 H LEU 55 7.578 2.510 -3.137 472 HA LEU 55 HA LEU 55 5.993 4.942 -3.144 473 HB2 LEU 55 HB2 LEU 55 4.198 3.432 -2.432 474 HB3 LEU 55 HB3 LEU 55 5.062 2.849 -3.836 475 HG LEU 55 HG LEU 55 6.390 1.387 -2.049 476 HD11 LEU 55 HD11 LEU 55 3.700 1.894 -0.697 477 HD12 LEU 55 HD12 LEU 55 4.847 0.602 -0.295 478 HD13 LEU 55 HD13 LEU 55 5.300 2.289 -0.026 479 HD21 LEU 55 HD21 LEU 55 5.026 0.521 -3.900 480 HD22 LEU 55 HD22 LEU 55 4.739 -0.385 -2.408 481 HD23 LEU 55 HD23 LEU 55 3.544 0.813 -2.961 482 H ASN 56 H ASN 56 4.603 5.505 -1.197 483 HA ASN 56 HA ASN 56 6.041 5.094 1.360 484 HB2 ASN 56 HB2 ASN 56 5.942 7.324 2.024 485 HB3 ASN 56 HB3 ASN 56 6.587 7.343 0.396 486 HD21 ASN 56 HD21 ASN 56 4.339 10.078 0.081 487 HD22 ASN 56 HD22 ASN 56 6.019 9.614 0.324 488 H ALA 57 H ALA 57 4.747 5.616 3.241 489 HA ALA 57 HA ALA 57 2.392 3.946 3.204 490 HB1 ALA 57 HB1 ALA 57 3.773 5.619 5.344 491 HB2 ALA 57 HB2 ALA 57 2.547 4.369 5.653 492 HB3 ALA 57 HB3 ALA 57 4.111 3.919 4.937 493 H THR 58 H THR 58 2.926 7.443 3.307 494 HA THR 58 HA THR 58 0.386 8.306 4.232 495 HB THR 58 HB THR 58 2.288 9.739 2.341 496 HG1 THR 58 HG1 THR 58 3.199 10.539 4.245 497 HG21 THR 58 HG21 THR 58 0.234 10.782 4.338 498 HG22 THR 58 HG22 THR 58 1.421 11.785 3.467 499 HG23 THR 58 HG23 THR 58 0.168 10.924 2.566 500 H GLU 59 H GLU 59 1.588 7.861 0.870 501 HA GLU 59 HA GLU 59 -0.897 8.541 -0.421 502 HB2 GLU 59 HB2 GLU 59 1.548 6.887 -1.176 503 HB3 GLU 59 HB3 GLU 59 0.195 7.061 -2.286 504 HG2 GLU 59 HG2 GLU 59 1.799 9.388 -1.142 505 HG3 GLU 59 HG3 GLU 59 2.058 8.655 -2.723 506 H LEU 60 H LEU 60 0.228 5.504 0.996 507 HA LEU 60 HA LEU 60 -1.964 3.935 -0.071 508 HB2 LEU 60 HB2 LEU 60 0.450 3.278 1.015 509 HB3 LEU 60 HB3 LEU 60 -0.550 3.131 2.452 510 HG LEU 60 HG LEU 60 -2.115 1.648 0.966 511 HD11 LEU 60 HD11 LEU 60 0.474 1.519 -0.664 512 HD12 LEU 60 HD12 LEU 60 -0.991 0.556 -0.931 513 HD13 LEU 60 HD13 LEU 60 -1.019 2.299 -1.212 514 HD21 LEU 60 HD21 LEU 60 -0.709 0.731 2.764 515 HD22 LEU 60 HD22 LEU 60 -0.707 -0.350 1.362 516 HD23 LEU 60 HD23 LEU 60 0.693 0.702 1.671 517 H SER 61 H SER 61 -1.365 5.480 3.130 518 HA SER 61 HA SER 61 -3.813 4.700 4.342 519 HB2 SER 61 HB2 SER 61 -3.347 6.459 5.967 520 HB3 SER 61 HB3 SER 61 -1.913 5.462 5.648 521 HG SER 61 HG SER 61 -1.587 7.797 5.699 522 H LYS 62 H LYS 62 -3.062 7.354 2.180 523 HA LYS 62 HA LYS 62 -5.412 8.971 2.678 524 HB2 LYS 62 HB2 LYS 62 -3.358 8.821 0.454 525 HB3 LYS 62 HB3 LYS 62 -4.782 9.850 0.283 526 HG2 LYS 62 HG2 LYS 62 -4.224 11.192 2.169 527 HG3 LYS 62 HG3 LYS 62 -3.003 10.059 2.734 528 HD2 LYS 62 HD2 LYS 62 -1.901 11.966 1.735 529 HD3 LYS 62 HD3 LYS 62 -1.605 10.544 0.727 530 HE2 LYS 62 HE2 LYS 62 -3.457 11.296 -0.801 531 HE3 LYS 62 HE3 LYS 62 -3.676 12.734 0.207 532 HZ1 LYS 62 HZ1 LYS 62 -1.200 12.013 -1.284 533 HZ2 LYS 62 HZ2 LYS 62 -2.246 13.201 -1.699 534 HZ3 LYS 62 HZ3 LYS 62 -1.360 13.344 -0.335 535 H ARG 63 H ARG 63 -4.846 6.351 0.361 536 HA ARG 63 HA ARG 63 -7.627 6.686 -0.714 537 HB2 ARG 63 HB2 ARG 63 -5.160 5.308 -1.833 538 HB3 ARG 63 HB3 ARG 63 -6.778 5.198 -2.553 539 HG2 ARG 63 HG2 ARG 63 -6.876 7.665 -2.742 540 HG3 ARG 63 HG3 ARG 63 -5.228 7.790 -2.118 541 HD2 ARG 63 HD2 ARG 63 -5.981 6.196 -4.606 542 HD3 ARG 63 HD3 ARG 63 -5.536 7.894 -4.665 543 HE ARG 63 HE ARG 63 -3.745 5.622 -4.320 544 HH11 ARG 63 HH11 ARG 63 -1.506 6.022 -4.397 545 HH12 ARG 63 HH12 ARG 63 -0.969 7.682 -4.134 546 HH21 ARG 63 HH21 ARG 63 -3.942 9.114 -3.758 547 HH22 ARG 63 HH22 ARG 63 -2.177 9.232 -3.799 548 H LEU 64 H LEU 64 -5.639 4.243 0.907 549 HA LEU 64 HA LEU 64 -7.800 2.252 0.814 550 HB2 LEU 64 HB2 LEU 64 -5.189 2.035 0.730 551 HB3 LEU 64 HB3 LEU 64 -5.299 2.044 2.487 552 HG LEU 64 HG LEU 64 -6.710 0.072 0.650 553 HD11 LEU 64 HD11 LEU 64 -4.053 -0.202 2.112 554 HD12 LEU 64 HD12 LEU 64 -4.865 -1.478 1.178 555 HD13 LEU 64 HD13 LEU 64 -4.272 -0.027 0.359 556 HD21 LEU 64 HD21 LEU 64 -7.719 -0.031 2.860 557 HD22 LEU 64 HD22 LEU 64 -6.651 -1.415 2.700 558 HD23 LEU 64 HD23 LEU 64 -6.120 -0.008 3.642 559 H ASN 65 H ASN 65 -6.880 4.860 2.900 560 HA ASN 65 HA ASN 65 -7.681 5.730 4.792 561 HB2 ASN 65 HB2 ASN 65 -9.810 5.518 3.498 562 HB3 ASN 65 HB3 ASN 65 -10.173 4.048 4.403 563 HD21 ASN 65 HD21 ASN 65 -10.825 5.848 7.473 564 HD22 ASN 65 HD22 ASN 65 -10.127 4.337 6.876 565 H ILE 66 H ILE 66 -5.870 4.633 5.665 566 HA ILE 66 HA ILE 66 -6.526 2.912 7.995 567 HB ILE 66 HB ILE 66 -4.220 1.785 7.590 568 HG12 ILE 66 HG12 ILE 66 -4.762 2.681 4.736 569 HG13 ILE 66 HG13 ILE 66 -3.448 3.219 5.804 570 HG21 ILE 66 HG21 ILE 66 -6.552 0.990 5.844 571 HG22 ILE 66 HG22 ILE 66 -5.218 -0.046 6.434 572 HG23 ILE 66 HG23 ILE 66 -6.353 0.645 7.584 573 HD11 ILE 66 HD11 ILE 66 -3.818 0.447 4.633 574 HD12 ILE 66 HD12 ILE 66 -2.601 1.668 4.215 575 HD13 ILE 66 HD13 ILE 66 -2.572 0.895 5.830 576 H THR 67 H THR 67 -4.709 2.839 9.524 577 HA THR 67 HA THR 67 -3.523 5.437 10.150 578 HB THR 67 HB THR 67 -3.432 2.645 11.316 579 HG1 THR 67 HG1 THR 67 -4.441 3.724 13.012 580 HG21 THR 67 HG21 THR 67 -1.796 5.033 12.236 581 HG22 THR 67 HG22 THR 67 -2.168 3.614 13.249 582 HG23 THR 67 HG23 THR 67 -1.230 3.401 11.774 583 H VAL 68 H VAL 68 -1.472 6.116 9.664 584 HA VAL 68 HA VAL 68 -0.020 5.037 7.504 585 HB VAL 68 HB VAL 68 1.171 6.759 9.714 586 HG11 VAL 68 HG11 VAL 68 1.799 6.573 6.733 587 HG12 VAL 68 HG12 VAL 68 2.563 7.681 7.890 588 HG13 VAL 68 HG13 VAL 68 2.823 5.944 8.047 589 HG21 VAL 68 HG21 VAL 68 -0.911 7.853 8.971 590 HG22 VAL 68 HG22 VAL 68 0.489 8.721 8.350 591 HG23 VAL 68 HG23 VAL 68 -0.421 7.644 7.275 592 H ASP 69 H ASP 69 0.395 4.440 10.965 593 HA ASP 69 HA ASP 69 2.815 2.924 10.690 594 HB2 ASP 69 HB2 ASP 69 2.156 4.048 12.785 595 HB3 ASP 69 HB3 ASP 69 0.762 2.981 12.935 596 H LYS 70 H LYS 70 -0.541 1.989 10.256 597 HA LYS 70 HA LYS 70 0.161 -0.887 10.185 598 HB2 LYS 70 HB2 LYS 70 -2.420 0.531 9.361 599 HB3 LYS 70 HB3 LYS 70 -2.158 -1.214 9.460 600 HG2 LYS 70 HG2 LYS 70 -1.647 -0.923 11.933 601 HG3 LYS 70 HG3 LYS 70 -2.093 0.773 11.767 602 HD2 LYS 70 HD2 LYS 70 -4.017 -0.312 12.644 603 HD3 LYS 70 HD3 LYS 70 -4.367 0.064 10.961 604 HE2 LYS 70 HE2 LYS 70 -5.213 -2.127 11.380 605 HE3 LYS 70 HE3 LYS 70 -3.793 -2.321 10.354 606 HZ1 LYS 70 HZ1 LYS 70 -3.838 -2.710 13.306 607 HZ2 LYS 70 HZ2 LYS 70 -3.815 -3.909 12.203 608 HZ3 LYS 70 HZ3 LYS 70 -2.523 -2.928 12.360 609 H ALA 71 H ALA 71 -0.117 1.846 7.989 610 HA ALA 71 HA ALA 71 -0.125 0.254 5.543 611 HB1 ALA 71 HB1 ALA 71 0.704 3.157 6.029 612 HB2 ALA 71 HB2 ALA 71 0.388 2.411 4.457 613 HB3 ALA 71 HB3 ALA 71 -0.926 2.632 5.628 614 H LYS 72 H LYS 72 2.460 1.955 7.334 615 HA LYS 72 HA LYS 72 4.523 1.113 5.535 616 HB2 LYS 72 HB2 LYS 72 6.071 2.152 6.951 617 HB3 LYS 72 HB3 LYS 72 4.596 3.108 7.014 618 HG2 LYS 72 HG2 LYS 72 4.033 1.943 9.196 619 HG3 LYS 72 HG3 LYS 72 5.646 1.207 9.144 620 HD2 LYS 72 HD2 LYS 72 6.662 3.497 9.027 621 HD3 LYS 72 HD3 LYS 72 5.040 4.198 9.078 622 HE2 LYS 72 HE2 LYS 72 6.060 4.389 11.255 623 HE3 LYS 72 HE3 LYS 72 4.673 3.310 11.332 624 HZ1 LYS 72 HZ1 LYS 72 7.513 2.440 11.256 625 HZ2 LYS 72 HZ2 LYS 72 6.521 2.408 12.558 626 HZ3 LYS 72 HZ3 LYS 72 6.219 1.427 11.307 627 H THR 73 H THR 73 3.136 -0.713 8.171 628 HA THR 73 HA THR 73 5.327 -2.723 7.858 629 HB THR 73 HB THR 73 4.556 -2.046 10.145 630 HG1 THR 73 HG1 THR 73 4.766 -4.166 10.839 631 HG21 THR 73 HG21 THR 73 2.211 -3.908 9.557 632 HG22 THR 73 HG22 THR 73 2.610 -3.120 11.098 633 HG23 THR 73 HG23 THR 73 2.079 -2.143 9.723 634 H TYR 74 H TYR 74 1.829 -2.356 7.168 635 HA TYR 74 HA TYR 74 1.295 -4.992 6.341 636 HB2 TYR 74 HB2 TYR 74 -0.511 -3.468 6.614 637 HB3 TYR 74 HB3 TYR 74 0.209 -2.292 5.509 638 HD1 TYR 74 HD1 TYR 74 -0.188 -2.296 3.212 639 HD2 TYR 74 HD2 TYR 74 -1.371 -5.690 5.607 640 HE1 TYR 74 HE1 TYR 74 -1.214 -3.327 1.230 641 HE2 TYR 74 HE2 TYR 74 -2.433 -6.724 3.598 642 HH TYR 74 HH TYR 74 -2.259 -5.213 0.364 643 H ILE 75 H ILE 75 2.639 -2.287 4.401 644 HA ILE 75 HA ILE 75 2.836 -3.417 1.866 645 HB ILE 75 HB ILE 75 4.673 -1.589 3.442 646 HG12 ILE 75 HG12 ILE 75 3.031 -0.893 0.987 647 HG13 ILE 75 HG13 ILE 75 2.292 -0.932 2.579 648 HG21 ILE 75 HG21 ILE 75 4.991 -2.330 0.490 649 HG22 ILE 75 HG22 ILE 75 5.834 -1.000 1.300 650 HG23 ILE 75 HG23 ILE 75 6.169 -2.643 1.786 651 HD11 ILE 75 HD11 ILE 75 4.722 0.802 1.933 652 HD12 ILE 75 HD12 ILE 75 3.041 1.355 1.913 653 HD13 ILE 75 HD13 ILE 75 3.783 0.796 3.420 654 H LYS 76 H LYS 76 5.489 -3.630 4.251 655 HA LYS 76 HA LYS 76 6.809 -5.740 2.785 656 HB2 LYS 76 HB2 LYS 76 8.598 -5.441 4.412 657 HB3 LYS 76 HB3 LYS 76 8.015 -3.892 3.811 658 HG2 LYS 76 HG2 LYS 76 6.640 -3.637 5.913 659 HG3 LYS 76 HG3 LYS 76 7.351 -5.145 6.518 660 HD2 LYS 76 HD2 LYS 76 9.611 -4.124 6.377 661 HD3 LYS 76 HD3 LYS 76 8.894 -2.628 5.740 662 HE2 LYS 76 HE2 LYS 76 7.555 -2.388 7.822 663 HE3 LYS 76 HE3 LYS 76 8.295 -3.861 8.466 664 HZ1 LYS 76 HZ1 LYS 76 9.755 -1.364 7.773 665 HZ2 LYS 76 HZ2 LYS 76 9.438 -1.887 9.286 666 HZ3 LYS 76 HZ3 LYS 76 10.463 -2.725 8.336 667 H ASN 77 H ASN 77 4.217 -6.180 4.681 668 HA ASN 77 HA ASN 77 5.124 -8.944 5.442 669 HB2 ASN 77 HB2 ASN 77 3.004 -7.133 6.643 670 HB3 ASN 77 HB3 ASN 77 2.974 -8.881 6.861 671 HD21 ASN 77 HD21 ASN 77 5.712 -6.703 8.931 672 HD22 ASN 77 HD22 ASN 77 4.758 -5.939 7.669 673 H SER 78 H SER 78 2.715 -7.102 3.621 674 HA SER 78 HA SER 78 1.330 -9.504 2.660 675 HB2 SER 78 HB2 SER 78 0.229 -7.296 3.055 676 HB3 SER 78 HB3 SER 78 1.147 -6.631 1.690 677 HG SER 78 HG SER 78 -0.979 -7.392 1.125 678 H ASN 79 H ASN 79 3.683 -7.170 1.395 679 HA ASN 79 HA ASN 79 4.582 -9.154 -0.613 680 HB2 ASN 79 HB2 ASN 79 4.769 -7.293 -2.310 681 HB3 ASN 79 HB3 ASN 79 3.168 -7.920 -1.974 682 HD21 ASN 79 HD21 ASN 79 3.956 -4.055 -0.844 683 HD22 ASN 79 HD22 ASN 79 5.270 -5.233 -0.807 684 H ARG 80 H ARG 80 6.180 -9.537 0.970 685 HA ARG 80 HA ARG 80 8.178 -7.541 1.650 686 HB2 ARG 80 HB2 ARG 80 7.606 -9.532 3.034 687 HB3 ARG 80 HB3 ARG 80 8.242 -10.592 1.786 688 HG2 ARG 80 HG2 ARG 80 9.753 -10.273 3.715 689 HG3 ARG 80 HG3 ARG 80 10.503 -9.845 2.179 690 HD2 ARG 80 HD2 ARG 80 10.614 -7.587 2.680 691 HD3 ARG 80 HD3 ARG 80 9.195 -7.613 3.706 692 HE ARG 80 HE ARG 80 11.963 -8.283 4.484 693 HH11 ARG 80 HH11 ARG 80 12.440 -8.463 6.641 694 HH12 ARG 80 HH12 ARG 80 11.166 -8.465 7.823 695 HH21 ARG 80 HH21 ARG 80 8.602 -8.139 5.558 696 HH22 ARG 80 HH22 ARG 80 9.062 -8.319 7.231 697 H MET 81 H MET 81 7.916 -9.877 -0.923 698 HA MET 81 HA MET 81 10.187 -8.561 -2.365 699 HB2 MET 81 HB2 MET 81 9.687 -11.555 -2.077 700 HB3 MET 81 HB3 MET 81 10.692 -10.868 -3.354 701 HG2 MET 81 HG2 MET 81 11.215 -10.489 -0.385 702 HG3 MET 81 HG3 MET 81 11.984 -11.698 -1.410 703 HE1 MET 81 HE1 MET 81 14.360 -10.885 -0.601 704 HE2 MET 81 HE2 MET 81 14.908 -9.197 -0.685 705 HE3 MET 81 HE3 MET 81 13.588 -9.646 0.417 706 H GLY 82 H GLY 82 7.162 -10.414 -2.563 707 HA2 GLY 82 HA2 GLY 82 5.476 -9.426 -4.180 708 HA3 GLY 82 HA3 GLY 82 6.742 -9.543 -5.405 709 H ARG 83 H ARG 83 7.314 -11.562 -6.223 710 HA ARG 83 HA ARG 83 5.301 -13.640 -6.096 711 HB2 ARG 83 HB2 ARG 83 6.547 -12.614 -8.089 712 HB3 ARG 83 HB3 ARG 83 7.875 -13.687 -7.695 713 HG2 ARG 83 HG2 ARG 83 6.768 -15.549 -8.447 714 HG3 ARG 83 HG3 ARG 83 5.195 -15.026 -7.832 715 HD2 ARG 83 HD2 ARG 83 6.586 -13.820 -10.240 716 HD3 ARG 83 HD3 ARG 83 5.375 -15.109 -10.359 717 HE ARG 83 HE ARG 83 4.923 -12.270 -9.963 718 HH11 ARG 83 HH11 ARG 83 2.909 -11.418 -9.694 719 HH12 ARG 83 HH12 ARG 83 1.562 -12.456 -9.337 720 HH21 ARG 83 HH21 ARG 83 3.386 -15.357 -9.300 721 HH22 ARG 83 HH22 ARG 83 1.819 -14.622 -9.113 722 H THR 84 H THR 84 6.361 -13.524 -3.649 723 HA THR 84 HA THR 84 7.422 -14.546 -1.919 724 HB THR 84 HB THR 84 6.600 -17.162 -3.168 725 HG1 THR 84 HG1 THR 84 4.479 -16.657 -2.605 726 HG21 THR 84 HG21 THR 84 6.202 -15.927 -0.391 727 HG22 THR 84 HG22 THR 84 5.698 -17.560 -0.885 728 HG23 THR 84 HG23 THR 84 7.414 -17.158 -0.790 729 H ASN 85 H ASN 85 9.342 -13.999 -3.953 730 HA ASN 85 HA ASN 85 11.299 -14.535 -4.880 731 HB2 ASN 85 HB2 ASN 85 13.091 -15.041 -3.400 732 HB3 ASN 85 HB3 ASN 85 11.956 -13.962 -2.609 733 HD21 ASN 85 HD21 ASN 85 12.440 -17.790 -1.165 734 HD22 ASN 85 HD22 ASN 85 12.781 -17.446 -2.865 735 H ASN 86 H ASN 86 9.239 -16.582 -5.357 736 HA ASN 86 HA ASN 86 10.848 -19.030 -5.668 737 HB2 ASN 86 HB2 ASN 86 8.974 -20.202 -5.488 738 HB3 ASN 86 HB3 ASN 86 8.335 -18.735 -4.761 739 HD21 ASN 86 HD21 ASN 86 6.371 -17.976 -7.737 740 HD22 ASN 86 HD22 ASN 86 7.365 -17.145 -6.539 741 H PHE 87 H PHE 87 10.425 -16.374 -7.544 742 HA PHE 87 HA PHE 87 10.145 -17.533 -10.175 743 HB2 PHE 87 HB2 PHE 87 10.351 -15.280 -10.951 744 HB3 PHE 87 HB3 PHE 87 9.312 -15.310 -9.539 745 HD1 PHE 87 HD1 PHE 87 12.501 -14.121 -10.923 746 HD2 PHE 87 HD2 PHE 87 10.076 -14.337 -7.363 747 HE1 PHE 87 HE1 PHE 87 13.966 -12.450 -9.821 748 HE2 PHE 87 HE2 PHE 87 11.526 -12.637 -6.278 749 HZ PHE 87 HZ PHE 87 13.480 -11.703 -7.496 750 H LYS 88 H LYS 88 12.458 -18.344 -8.402 751 HA LYS 88 HA LYS 88 14.957 -17.673 -9.658 752 HB2 LYS 88 HB2 LYS 88 14.089 -20.055 -7.961 753 HB3 LYS 88 HB3 LYS 88 15.773 -19.641 -8.315 754 HG2 LYS 88 HG2 LYS 88 15.597 -17.540 -7.146 755 HG3 LYS 88 HG3 LYS 88 13.868 -17.745 -6.883 756 HD2 LYS 88 HD2 LYS 88 16.026 -19.523 -5.664 757 HD3 LYS 88 HD3 LYS 88 15.214 -18.177 -4.872 758 HE2 LYS 88 HE2 LYS 88 13.808 -19.724 -4.071 759 HE3 LYS 88 HE3 LYS 88 13.000 -19.531 -5.619 760 HZ1 LYS 88 HZ1 LYS 88 15.014 -21.632 -4.944 761 HZ2 LYS 88 HZ2 LYS 88 13.413 -21.881 -5.088 762 HZ3 LYS 88 HZ3 LYS 88 14.297 -21.500 -6.405 763 H THR 89 H THR 89 12.487 -19.811 -10.599 764 HA THR 89 HA THR 89 14.085 -20.829 -12.894 765 HB THR 89 HB THR 89 14.054 -22.409 -10.858 766 HG1 THR 89 HG1 THR 89 13.975 -24.163 -12.264 767 HG21 THR 89 HG21 THR 89 11.320 -23.053 -11.992 768 HG22 THR 89 HG22 THR 89 12.177 -23.922 -10.695 769 HG23 THR 89 HG23 THR 89 11.630 -22.254 -10.431 770 H ILE 90 H ILE 90 11.069 -19.745 -11.617 771 HA ILE 90 HA ILE 90 9.631 -20.362 -14.151 772 HB ILE 90 HB ILE 90 8.162 -19.524 -11.658 773 HG12 ILE 90 HG12 ILE 90 9.039 -22.400 -12.154 774 HG13 ILE 90 HG13 ILE 90 9.580 -21.349 -10.832 775 HG21 ILE 90 HG21 ILE 90 7.485 -21.411 -13.972 776 HG22 ILE 90 HG22 ILE 90 6.364 -20.886 -12.699 777 HG23 ILE 90 HG23 ILE 90 6.965 -19.717 -13.846 778 HD11 ILE 90 HD11 ILE 90 6.806 -22.471 -11.173 779 HD12 ILE 90 HD12 ILE 90 8.004 -22.800 -9.907 780 HD13 ILE 90 HD13 ILE 90 7.248 -21.194 -10.006 781 H LYS 91 H LYS 91 8.150 -18.614 -14.902 782 HA LYS 91 HA LYS 91 7.913 -16.598 -15.803 783 HB2 LYS 91 HB2 LYS 91 7.699 -16.173 -13.074 784 HB3 LYS 91 HB3 LYS 91 8.956 -15.032 -13.498 785 HG2 LYS 91 HG2 LYS 91 7.296 -13.635 -14.056 786 HG3 LYS 91 HG3 LYS 91 7.102 -14.603 -15.522 787 HD2 LYS 91 HD2 LYS 91 5.576 -14.968 -12.905 788 HD3 LYS 91 HD3 LYS 91 4.952 -14.207 -14.373 789 HE2 LYS 91 HE2 LYS 91 5.223 -16.339 -15.614 790 HE3 LYS 91 HE3 LYS 91 5.855 -17.116 -14.155 791 HZ1 LYS 91 HZ1 LYS 91 3.124 -15.973 -14.423 792 HZ2 LYS 91 HZ2 LYS 91 3.482 -17.562 -14.451 793 HZ3 LYS 91 HZ3 LYS 91 3.704 -16.706 -13.082 794 H MET 92 H MET 92 10.958 -17.681 -15.220 795 HA MET 92 HA MET 92 12.194 -15.516 -16.897 796 HB2 MET 92 HB2 MET 92 14.312 -16.064 -15.755 797 HB3 MET 92 HB3 MET 92 13.089 -15.443 -14.656 798 HG2 MET 92 HG2 MET 92 12.851 -17.418 -13.532 799 HG3 MET 92 HG3 MET 92 13.189 -18.426 -14.931 800 HE1 MET 92 HE1 MET 92 15.756 -18.202 -16.111 801 HE2 MET 92 HE2 MET 92 16.867 -19.058 -15.017 802 HE3 MET 92 HE3 MET 92 15.234 -19.701 -15.307 803 H PHE 93 H PHE 93 11.174 -18.657 -17.139 804 HA PHE 93 HA PHE 93 13.474 -19.571 -18.833 805 HB2 PHE 93 HB2 PHE 93 13.258 -20.418 -16.462 806 HB3 PHE 93 HB3 PHE 93 11.732 -21.159 -16.921 807 HD1 PHE 93 HD1 PHE 93 15.396 -21.094 -17.670 808 HD2 PHE 93 HD2 PHE 93 11.725 -23.343 -17.863 809 HE1 PHE 93 HE1 PHE 93 16.678 -23.123 -18.338 810 HE2 PHE 93 HE2 PHE 93 13.005 -25.373 -18.535 811 HZ PHE 93 HZ PHE 93 15.481 -25.262 -18.771 812 H GLU 94 H GLU 94 10.020 -19.204 -18.738 813 HA GLU 94 HA GLU 94 9.492 -21.236 -20.818 814 HB2 GLU 94 HB2 GLU 94 7.690 -19.355 -19.254 815 HB3 GLU 94 HB3 GLU 94 7.113 -20.471 -20.488 816 HG2 GLU 94 HG2 GLU 94 8.596 -21.353 -17.970 817 HG3 GLU 94 HG3 GLU 94 6.849 -21.259 -18.114 818 H ASP 95 H ASP 95 8.474 -20.774 -22.800 819 HA ASP 95 HA ASP 95 8.360 -18.008 -23.803 820 HB2 ASP 95 HB2 ASP 95 10.688 -18.778 -24.263 821 HB3 ASP 95 HB3 ASP 95 10.045 -20.174 -25.131 822 H ASP 96 H ASP 96 6.994 -17.788 -25.639 823 HA ASP 96 HA ASP 96 5.202 -20.124 -26.206 824 HB2 ASP 96 HB2 ASP 96 4.482 -17.199 -25.816 825 HB3 ASP 96 HB3 ASP 96 3.391 -18.417 -26.470 826 H VAL 97 H VAL 97 4.503 -20.462 -28.247 827 HA VAL 97 HA VAL 97 5.641 -18.770 -30.448 828 HB VAL 97 HB VAL 97 5.384 -21.800 -30.408 829 HG11 VAL 97 HG11 VAL 97 6.619 -19.926 -32.475 830 HG12 VAL 97 HG12 VAL 97 6.706 -21.700 -32.505 831 HG13 VAL 97 HG13 VAL 97 5.146 -20.900 -32.689 832 HG21 VAL 97 HG21 VAL 97 7.240 -21.110 -28.953 833 HG22 VAL 97 HG22 VAL 97 7.871 -21.801 -30.446 834 HG23 VAL 97 HG23 VAL 97 7.866 -20.036 -30.224 835 H SER 98 H SER 98 3.065 -21.145 -29.677 836 HA SER 98 HA SER 98 1.300 -19.853 -31.691 837 HB2 SER 98 HB2 SER 98 0.102 -22.033 -31.673 838 HB3 SER 98 HB3 SER 98 1.787 -22.138 -32.199 839 HG SER 98 HG SER 98 1.239 -23.790 -30.690 840 H SER 99 H SER 99 1.743 -19.602 -28.472 841 HA SER 99 HA SER 99 -1.125 -19.235 -27.847 842 HB2 SER 99 HB2 SER 99 0.953 -20.524 -26.053 843 HB3 SER 99 HB3 SER 99 -0.736 -20.202 -25.617 844 HG SER 99 HG SER 99 -0.417 -22.362 -26.326 845 H ALA 100 H ALA 100 1.112 -17.268 -28.487 846 HA ALA 100 HA ALA 100 1.566 -15.779 -26.020 847 HB1 ALA 100 HB1 ALA 100 2.107 -15.065 -28.930 848 HB2 ALA 100 HB2 ALA 100 2.747 -14.220 -27.505 849 HB3 ALA 100 HB3 ALA 100 3.238 -15.892 -27.833 850 H SER 101 H SER 101 1.039 -13.479 -25.810 851 HA SER 101 HA SER 101 -1.569 -12.611 -26.985 852 HB2 SER 101 HB2 SER 101 -0.769 -12.464 -24.051 853 HB3 SER 101 HB3 SER 101 -2.206 -11.711 -24.764 854 HG SER 101 HG SER 101 -2.666 -13.752 -23.809 855 H ALA 102 H ALA 102 -1.944 -10.267 -26.742 856 HA ALA 102 HA ALA 102 0.401 -8.774 -27.569 857 HB1 ALA 102 HB1 ALA 102 -2.512 -7.962 -27.294 858 HB2 ALA 102 HB2 ALA 102 -1.247 -7.081 -28.181 859 HB3 ALA 102 HB3 ALA 102 -1.767 -8.680 -28.745 860 H GLN 103 H GLN 103 0.564 -9.541 -24.889 861 HA GLN 103 HA GLN 103 0.841 -8.911 -22.706 862 HB2 GLN 103 HB2 GLN 103 2.049 -6.684 -24.329 863 HB3 GLN 103 HB3 GLN 103 2.326 -6.831 -22.583 864 HG2 GLN 103 HG2 GLN 103 3.452 -8.915 -22.798 865 HG3 GLN 103 HG3 GLN 103 2.906 -9.152 -24.461 866 HE21 GLN 103 HE21 GLN 103 5.319 -6.942 -25.918 867 HE22 GLN 103 HE22 GLN 103 3.694 -7.593 -26.124 868 HA PRO 104 HA PRO 104 -2.800 -5.969 -22.386 869 HB2 PRO 104 HB2 PRO 104 -4.829 -7.628 -21.708 870 HB3 PRO 104 HB3 PRO 104 -4.226 -7.516 -23.384 871 HG2 PRO 104 HG2 PRO 104 -3.424 -9.570 -21.282 872 HG3 PRO 104 HG3 PRO 104 -4.028 -9.874 -22.944 873 HD2 PRO 104 HD2 PRO 104 -1.354 -9.793 -22.380 874 HD3 PRO 104 HD3 PRO 104 -2.018 -9.161 -23.913 875 H ASN 105 H ASN 105 -0.966 -5.648 -20.671 876 HA ASN 105 HA ASN 105 -2.006 -6.229 -17.934 877 HB2 ASN 105 HB2 ASN 105 0.020 -7.550 -18.699 878 HB3 ASN 105 HB3 ASN 105 0.911 -6.029 -18.795 879 HD21 ASN 105 HD21 ASN 105 -0.122 -7.506 -15.076 880 HD22 ASN 105 HD22 ASN 105 -1.159 -7.867 -16.447 881 H LEU 106 H LEU 106 -2.626 -3.942 -19.543 882 HA LEU 106 HA LEU 106 -1.594 -1.711 -17.818 883 HB2 LEU 106 HB2 LEU 106 -2.296 -1.657 -20.774 884 HB3 LEU 106 HB3 LEU 106 -2.145 -0.239 -19.750 885 HG LEU 106 HG LEU 106 0.252 -1.025 -19.212 886 HD11 LEU 106 HD11 LEU 106 -0.258 -2.652 -21.751 887 HD12 LEU 106 HD12 LEU 106 1.347 -2.267 -21.094 888 HD13 LEU 106 HD13 LEU 106 0.255 -3.288 -20.173 889 HD21 LEU 106 HD21 LEU 106 -0.307 0.925 -20.605 890 HD22 LEU 106 HD22 LEU 106 1.102 0.074 -21.250 891 HD23 LEU 106 HD23 LEU 106 -0.485 -0.126 -22.029 892 HA PRO 107 HA PRO 107 -6.148 -2.227 -17.089 893 HB2 PRO 107 HB2 PRO 107 -6.171 -1.766 -14.394 894 HB3 PRO 107 HB3 PRO 107 -5.750 -3.348 -15.120 895 HG2 PRO 107 HG2 PRO 107 -3.857 -1.165 -14.186 896 HG3 PRO 107 HG3 PRO 107 -3.794 -2.919 -13.818 897 HD2 PRO 107 HD2 PRO 107 -2.298 -1.814 -15.798 898 HD3 PRO 107 HD3 PRO 107 -3.018 -3.442 -15.980 Start of MODEL 12 1 H1 GLY -5 H1 GLY -5 11.943 -26.317 11.812 2 H2 GLY -5 H2 GLY -5 13.310 -27.127 12.216 3 H3 GLY -5 H3 GLY -5 12.836 -25.827 13.094 4 HA2 GLY -5 HA2 GLY -5 11.394 -28.394 12.905 5 HA3 GLY -5 HA3 GLY -5 12.346 -27.849 14.298 6 H SER -4 H SER -4 10.522 -28.014 15.648 7 HA SER -4 HA SER -4 8.510 -25.809 15.445 8 HB2 SER -4 HB2 SER -4 7.931 -28.713 16.153 9 HB3 SER -4 HB3 SER -4 6.774 -27.373 16.229 10 HG SER -4 HG SER -4 6.602 -28.580 14.272 11 H HIS -3 H HIS -3 7.445 -25.314 17.483 12 HA HIS -3 HA HIS -3 8.940 -26.085 19.953 13 HB2 HIS -3 HB2 HIS -3 9.680 -23.855 19.078 14 HB3 HIS -3 HB3 HIS -3 8.026 -23.271 19.255 15 HD2 HIS -3 HD2 HIS -3 7.533 -22.138 21.553 16 HE1 HIS -3 HE1 HIS -3 10.702 -23.798 23.878 17 HE2 HIS -3 HE2 HIS -3 8.781 -22.128 23.874 18 H MET -2 H MET -2 7.725 -26.415 21.740 19 HA MET -2 HA MET -2 4.744 -26.145 21.544 20 HB2 MET -2 HB2 MET -2 6.367 -28.557 22.440 21 HB3 MET -2 HB3 MET -2 4.621 -28.384 22.651 22 HG2 MET -2 HG2 MET -2 6.062 -28.370 19.974 23 HG3 MET -2 HG3 MET -2 5.253 -29.759 20.687 24 HE1 MET -2 HE1 MET -2 4.051 -30.005 18.301 25 HE2 MET -2 HE2 MET -2 3.033 -28.739 17.581 26 HE3 MET -2 HE3 MET -2 4.787 -28.493 17.721 27 H ALA -1 H ALA -1 4.618 -24.394 22.847 28 HA ALA -1 HA ALA -1 5.132 -24.802 25.756 29 HB1 ALA -1 HB1 ALA -1 5.968 -22.389 24.114 30 HB2 ALA -1 HB2 ALA -1 6.162 -22.578 25.874 31 HB3 ALA -1 HB3 ALA -1 7.054 -23.642 24.776 32 H SER 0 H SER 0 2.681 -24.642 23.945 33 HA SER 0 HA SER 0 1.314 -22.207 24.928 34 HB2 SER 0 HB2 SER 0 1.406 -23.059 22.483 35 HB3 SER 0 HB3 SER 0 0.150 -24.203 22.980 36 HG SER 0 HG SER 0 -0.699 -22.234 22.123 37 H MET 1 H MET 1 1.667 -25.119 26.293 38 HA MET 1 HA MET 1 -0.923 -25.010 27.717 39 HB2 MET 1 HB2 MET 1 -1.538 -27.308 27.243 40 HB3 MET 1 HB3 MET 1 -1.378 -26.403 25.742 41 HG2 MET 1 HG2 MET 1 0.892 -27.387 25.407 42 HG3 MET 1 HG3 MET 1 0.677 -28.327 26.890 43 HE1 MET 1 HE1 MET 1 1.272 -30.547 25.648 44 HE2 MET 1 HE2 MET 1 0.500 -31.084 24.139 45 HE3 MET 1 HE3 MET 1 1.527 -29.632 24.144 46 H ASP 2 H ASP 2 2.303 -25.338 28.039 47 HA ASP 2 HA ASP 2 2.064 -26.643 30.735 48 HB2 ASP 2 HB2 ASP 2 4.310 -26.883 28.696 49 HB3 ASP 2 HB3 ASP 2 4.438 -27.416 30.368 50 H GLN 3 H GLN 3 2.378 -23.745 29.365 51 HA GLN 3 HA GLN 3 4.286 -22.575 31.322 52 HB2 GLN 3 HB2 GLN 3 5.515 -23.362 29.323 53 HB3 GLN 3 HB3 GLN 3 4.450 -22.449 28.293 54 HG2 GLN 3 HG2 GLN 3 5.664 -20.611 30.197 55 HG3 GLN 3 HG3 GLN 3 6.914 -21.657 29.548 56 HE21 GLN 3 HE21 GLN 3 4.819 -19.367 26.794 57 HE22 GLN 3 HE22 GLN 3 4.011 -19.932 28.261 58 H LEU 4 H LEU 4 1.434 -22.437 31.285 59 HA LEU 4 HA LEU 4 0.960 -19.569 30.610 60 HB2 LEU 4 HB2 LEU 4 -0.041 -21.858 29.219 61 HB3 LEU 4 HB3 LEU 4 -1.390 -21.240 30.145 62 HG LEU 4 HG LEU 4 -0.934 -18.943 29.154 63 HD11 LEU 4 HD11 LEU 4 1.035 -20.551 27.456 64 HD12 LEU 4 HD12 LEU 4 0.444 -18.923 27.039 65 HD13 LEU 4 HD13 LEU 4 1.408 -19.164 28.494 66 HD21 LEU 4 HD21 LEU 4 -2.657 -20.453 28.227 67 HD22 LEU 4 HD22 LEU 4 -1.890 -19.487 26.957 68 HD23 LEU 4 HD23 LEU 4 -1.439 -21.194 27.165 69 H ASP 5 H ASP 5 1.324 -21.128 33.246 70 HA ASP 5 HA ASP 5 -1.209 -20.254 34.586 71 HB2 ASP 5 HB2 ASP 5 -0.759 -22.660 34.662 72 HB3 ASP 5 HB3 ASP 5 0.803 -22.362 35.423 73 H GLU 6 H GLU 6 2.324 -20.482 35.410 74 HA GLU 6 HA GLU 6 1.972 -18.158 37.235 75 HB2 GLU 6 HB2 GLU 6 2.611 -20.310 38.241 76 HB3 GLU 6 HB3 GLU 6 4.063 -20.366 37.231 77 HG2 GLU 6 HG2 GLU 6 4.864 -18.270 38.258 78 HG3 GLU 6 HG3 GLU 6 3.369 -18.135 39.185 79 H ILE 7 H ILE 7 2.189 -16.493 35.809 80 HA ILE 7 HA ILE 7 4.908 -16.019 34.654 81 HB ILE 7 HB ILE 7 2.238 -15.198 33.458 82 HG12 ILE 7 HG12 ILE 7 2.623 -17.590 33.065 83 HG13 ILE 7 HG13 ILE 7 2.637 -16.637 31.596 84 HG21 ILE 7 HG21 ILE 7 5.085 -14.653 32.529 85 HG22 ILE 7 HG22 ILE 7 3.634 -14.385 31.539 86 HG23 ILE 7 HG23 ILE 7 3.864 -13.466 33.026 87 HD11 ILE 7 HD11 ILE 7 5.157 -17.594 33.012 88 HD12 ILE 7 HD12 ILE 7 4.390 -18.390 31.627 89 HD13 ILE 7 HD13 ILE 7 5.067 -16.763 31.444 90 H ILE 8 H ILE 8 5.862 -14.356 35.601 91 HA ILE 8 HA ILE 8 4.305 -12.024 36.599 92 HB ILE 8 HB ILE 8 6.454 -13.449 38.222 93 HG12 ILE 8 HG12 ILE 8 3.446 -13.270 38.721 94 HG13 ILE 8 HG13 ILE 8 4.336 -14.723 38.261 95 HG21 ILE 8 HG21 ILE 8 4.727 -11.019 38.908 96 HG22 ILE 8 HG22 ILE 8 5.944 -11.770 39.962 97 HG23 ILE 8 HG23 ILE 8 6.456 -10.965 38.496 98 HD11 ILE 8 HD11 ILE 8 4.547 -13.268 40.910 99 HD12 ILE 8 HD12 ILE 8 3.904 -14.881 40.585 100 HD13 ILE 8 HD13 ILE 8 5.641 -14.578 40.392 101 H GLU 9 H GLU 9 5.169 -10.180 35.896 102 HA GLU 9 HA GLU 9 8.056 -10.003 35.158 103 HB2 GLU 9 HB2 GLU 9 5.719 -9.220 33.370 104 HB3 GLU 9 HB3 GLU 9 7.409 -8.770 33.098 105 HG2 GLU 9 HG2 GLU 9 8.008 -11.206 33.027 106 HG3 GLU 9 HG3 GLU 9 6.288 -11.600 33.120 107 H GLN 10 H GLN 10 8.048 -8.981 37.292 108 HA GLN 10 HA GLN 10 7.727 -6.072 37.116 109 HB2 GLN 10 HB2 GLN 10 5.530 -7.351 37.968 110 HB3 GLN 10 HB3 GLN 10 6.405 -7.405 39.493 111 HG2 GLN 10 HG2 GLN 10 6.484 -4.962 39.578 112 HG3 GLN 10 HG3 GLN 10 5.954 -4.839 37.897 113 HE21 GLN 10 HE21 GLN 10 2.488 -5.401 38.653 114 HE22 GLN 10 HE22 GLN 10 3.692 -5.529 37.377 115 H ILE 11 H ILE 11 8.339 -5.222 39.525 116 HA ILE 11 HA ILE 11 9.975 -4.801 40.946 117 HB ILE 11 HB ILE 11 8.492 -6.376 42.064 118 HG12 ILE 11 HG12 ILE 11 11.303 -6.500 43.196 119 HG13 ILE 11 HG13 ILE 11 10.297 -5.049 43.169 120 HG21 ILE 11 HG21 ILE 11 10.607 -8.499 41.532 121 HG22 ILE 11 HG22 ILE 11 9.245 -8.663 42.656 122 HG23 ILE 11 HG23 ILE 11 8.943 -8.476 40.937 123 HD11 ILE 11 HD11 ILE 11 9.664 -7.645 44.631 124 HD12 ILE 11 HD12 ILE 11 10.126 -6.090 45.338 125 HD13 ILE 11 HD13 ILE 11 8.565 -6.249 44.512 126 H GLN 12 H GLN 12 11.129 -4.991 38.517 127 HA GLN 12 HA GLN 12 13.891 -5.959 39.114 128 HB2 GLN 12 HB2 GLN 12 13.972 -7.261 37.073 129 HB3 GLN 12 HB3 GLN 12 12.623 -7.805 38.059 130 HG2 GLN 12 HG2 GLN 12 11.108 -6.308 36.638 131 HG3 GLN 12 HG3 GLN 12 12.473 -6.066 35.553 132 HE21 GLN 12 HE21 GLN 12 10.204 -9.033 34.636 133 HE22 GLN 12 HE22 GLN 12 9.770 -7.464 35.332 134 H LYS 13 H LYS 13 15.049 -5.570 36.663 135 HA LYS 13 HA LYS 13 15.161 -2.666 36.267 136 HB2 LYS 13 HB2 LYS 13 16.424 -4.973 34.730 137 HB3 LYS 13 HB3 LYS 13 16.705 -3.255 34.412 138 HG2 LYS 13 HG2 LYS 13 17.488 -3.012 36.813 139 HG3 LYS 13 HG3 LYS 13 17.425 -4.773 36.956 140 HD2 LYS 13 HD2 LYS 13 19.126 -3.185 34.982 141 HD3 LYS 13 HD3 LYS 13 19.700 -3.943 36.473 142 HE2 LYS 13 HE2 LYS 13 19.061 -6.179 35.588 143 HE3 LYS 13 HE3 LYS 13 18.505 -5.426 34.087 144 HZ1 LYS 13 HZ1 LYS 13 21.300 -5.343 35.094 145 HZ2 LYS 13 HZ2 LYS 13 20.768 -6.268 33.861 146 HZ3 LYS 13 HZ3 LYS 13 20.782 -4.645 33.710 147 H GLU 14 H GLU 14 13.080 -2.096 35.785 148 HA GLU 14 HA GLU 14 12.120 -2.628 33.024 149 HB2 GLU 14 HB2 GLU 14 9.867 -2.815 33.795 150 HB3 GLU 14 HB3 GLU 14 10.860 -3.985 34.662 151 HG2 GLU 14 HG2 GLU 14 10.977 -2.160 36.549 152 HG3 GLU 14 HG3 GLU 14 9.635 -1.404 35.694 153 H ALA 15 H ALA 15 11.403 -0.922 31.968 154 HA ALA 15 HA ALA 15 10.971 1.721 33.218 155 HB1 ALA 15 HB1 ALA 15 13.249 1.223 31.250 156 HB2 ALA 15 HB2 ALA 15 12.709 2.812 31.844 157 HB3 ALA 15 HB3 ALA 15 13.399 1.638 32.964 158 H ILE 16 H ILE 16 11.796 1.074 29.865 159 HA ILE 16 HA ILE 16 8.963 1.437 29.018 160 HB ILE 16 HB ILE 16 11.433 2.926 28.113 161 HG12 ILE 16 HG12 ILE 16 9.367 4.790 28.333 162 HG13 ILE 16 HG13 ILE 16 8.945 3.655 29.593 163 HG21 ILE 16 HG21 ILE 16 8.784 2.912 26.615 164 HG22 ILE 16 HG22 ILE 16 10.120 4.052 26.334 165 HG23 ILE 16 HG23 ILE 16 10.362 2.344 26.008 166 HD11 ILE 16 HD11 ILE 16 11.617 5.100 29.270 167 HD12 ILE 16 HD12 ILE 16 10.341 5.489 30.441 168 HD13 ILE 16 HD13 ILE 16 11.229 3.966 30.581 169 H ASN 17 H ASN 17 11.442 -0.584 28.903 170 HA ASN 17 HA ASN 17 11.389 -1.282 26.136 171 HB2 ASN 17 HB2 ASN 17 12.550 -2.803 28.519 172 HB3 ASN 17 HB3 ASN 17 12.897 -3.168 26.833 173 HD21 ASN 17 HD21 ASN 17 15.121 -0.379 28.595 174 HD22 ASN 17 HD22 ASN 17 14.133 -1.532 29.475 175 H SER 18 H SER 18 9.136 -2.089 28.474 176 HA SER 18 HA SER 18 8.203 -4.548 27.045 177 HB2 SER 18 HB2 SER 18 8.446 -4.735 29.469 178 HB3 SER 18 HB3 SER 18 7.323 -3.384 29.705 179 HG SER 18 HG SER 18 6.308 -5.463 29.856 180 H ASN 19 H ASN 19 6.785 -1.473 28.338 181 HA ASN 19 HA ASN 19 4.337 -1.910 26.963 182 HB2 ASN 19 HB2 ASN 19 3.649 0.235 27.833 183 HB3 ASN 19 HB3 ASN 19 4.536 -0.634 29.073 184 HD21 ASN 19 HD21 ASN 19 6.877 1.987 29.427 185 HD22 ASN 19 HD22 ASN 19 6.227 0.489 30.066 186 H VAL 20 H VAL 20 7.211 -0.575 25.724 187 HA VAL 20 HA VAL 20 5.979 0.966 23.598 188 HB VAL 20 HB VAL 20 8.251 1.350 24.594 189 HG11 VAL 20 HG11 VAL 20 9.213 -0.759 22.626 190 HG12 VAL 20 HG12 VAL 20 10.179 0.209 23.751 191 HG13 VAL 20 HG13 VAL 20 9.085 -1.033 24.381 192 HG21 VAL 20 HG21 VAL 20 7.473 2.510 22.572 193 HG22 VAL 20 HG22 VAL 20 9.223 2.233 22.572 194 HG23 VAL 20 HG23 VAL 20 8.172 1.222 21.562 195 H VAL 21 H VAL 21 6.423 -2.404 24.027 196 HA VAL 21 HA VAL 21 5.772 -2.931 21.153 197 HB VAL 21 HB VAL 21 7.295 -4.877 22.919 198 HG11 VAL 21 HG11 VAL 21 6.837 -4.723 19.896 199 HG12 VAL 21 HG12 VAL 21 7.761 -5.974 20.754 200 HG13 VAL 21 HG13 VAL 21 6.019 -5.851 20.997 201 HG21 VAL 21 HG21 VAL 21 8.811 -3.035 22.597 202 HG22 VAL 21 HG22 VAL 21 9.277 -4.321 21.490 203 HG23 VAL 21 HG23 VAL 21 8.389 -2.909 20.869 204 H LEU 22 H LEU 22 3.606 -2.433 22.003 205 HA LEU 22 HA LEU 22 2.274 -4.915 22.923 206 HB2 LEU 22 HB2 LEU 22 2.796 -3.188 24.839 207 HB3 LEU 22 HB3 LEU 22 1.529 -2.222 24.092 208 HG LEU 22 HG LEU 22 -0.006 -4.274 24.376 209 HD11 LEU 22 HD11 LEU 22 2.268 -5.132 26.224 210 HD12 LEU 22 HD12 LEU 22 0.658 -5.875 26.156 211 HD13 LEU 22 HD13 LEU 22 1.746 -5.997 24.767 212 HD21 LEU 22 HD21 LEU 22 -0.154 -2.311 25.838 213 HD22 LEU 22 HD22 LEU 22 -0.419 -3.799 26.760 214 HD23 LEU 22 HD23 LEU 22 1.144 -2.958 26.867 215 H LYS 23 H LYS 23 0.331 -5.308 22.017 216 HA LYS 23 HA LYS 23 -0.831 -3.353 20.103 217 HB2 LYS 23 HB2 LYS 23 0.529 -5.471 19.335 218 HB3 LYS 23 HB3 LYS 23 -0.942 -6.361 19.754 219 HG2 LYS 23 HG2 LYS 23 -2.197 -4.696 18.269 220 HG3 LYS 23 HG3 LYS 23 -0.630 -4.055 17.791 221 HD2 LYS 23 HD2 LYS 23 -1.602 -6.922 17.395 222 HD3 LYS 23 HD3 LYS 23 -1.610 -5.686 16.145 223 HE2 LYS 23 HE2 LYS 23 0.903 -6.740 17.526 224 HE3 LYS 23 HE3 LYS 23 0.276 -7.339 15.992 225 HZ1 LYS 23 HZ1 LYS 23 1.182 -4.549 16.464 226 HZ2 LYS 23 HZ2 LYS 23 1.988 -5.683 15.614 227 HZ3 LYS 23 HZ3 LYS 23 0.569 -5.111 15.056 228 H ASN 24 H ASN 24 -1.666 -3.450 22.785 229 HA ASN 24 HA ASN 24 -3.402 -3.750 24.227 230 HB2 ASN 24 HB2 ASN 24 -4.107 -2.011 22.541 231 HB3 ASN 24 HB3 ASN 24 -5.097 -3.241 21.760 232 HD21 ASN 24 HD21 ASN 24 -7.517 -3.283 24.444 233 HD22 ASN 24 HD22 ASN 24 -6.733 -4.336 23.256 234 HA PRO 25 HA PRO 25 -4.181 -8.173 22.916 235 HB2 PRO 25 HB2 PRO 25 -2.885 -9.521 24.903 236 HB3 PRO 25 HB3 PRO 25 -2.045 -8.802 23.499 237 HG2 PRO 25 HG2 PRO 25 -2.392 -7.582 26.262 238 HG3 PRO 25 HG3 PRO 25 -0.880 -7.769 25.315 239 HD2 PRO 25 HD2 PRO 25 -2.286 -5.445 25.297 240 HD3 PRO 25 HD3 PRO 25 -1.493 -6.062 23.815 241 H ARG 26 H ARG 26 -6.364 -7.675 23.301 242 HA ARG 26 HA ARG 26 -7.487 -9.004 25.727 243 HB2 ARG 26 HB2 ARG 26 -8.302 -6.234 24.729 244 HB3 ARG 26 HB3 ARG 26 -9.277 -7.199 25.830 245 HG2 ARG 26 HG2 ARG 26 -6.478 -6.166 26.437 246 HG3 ARG 26 HG3 ARG 26 -7.994 -5.469 26.998 247 HD2 ARG 26 HD2 ARG 26 -8.551 -7.569 28.187 248 HD3 ARG 26 HD3 ARG 26 -7.022 -8.282 27.686 249 HE ARG 26 HE ARG 26 -7.460 -6.247 29.756 250 HH11 ARG 26 HH11 ARG 26 -5.816 -5.804 31.161 251 HH12 ARG 26 HH12 ARG 26 -4.191 -6.303 30.795 252 HH21 ARG 26 HH21 ARG 26 -4.969 -7.777 27.786 253 HH22 ARG 26 HH22 ARG 26 -3.728 -7.412 28.958 254 H VAL 27 H VAL 27 -8.481 -7.513 22.611 255 HA VAL 27 HA VAL 27 -10.269 -9.873 22.139 256 HB VAL 27 HB VAL 27 -11.127 -6.996 21.675 257 HG11 VAL 27 HG11 VAL 27 -12.664 -9.642 21.665 258 HG12 VAL 27 HG12 VAL 27 -13.356 -8.025 21.393 259 HG13 VAL 27 HG13 VAL 27 -12.225 -8.702 20.225 260 HG21 VAL 27 HG21 VAL 27 -11.028 -7.292 24.084 261 HG22 VAL 27 HG22 VAL 27 -12.707 -7.355 23.562 262 HG23 VAL 27 HG23 VAL 27 -11.858 -8.864 23.964 263 HA PRO 28 HA PRO 28 -8.018 -9.044 18.207 264 HB2 PRO 28 HB2 PRO 28 -6.801 -11.393 17.805 265 HB3 PRO 28 HB3 PRO 28 -6.153 -10.148 18.918 266 HG2 PRO 28 HG2 PRO 28 -7.765 -12.622 19.636 267 HG3 PRO 28 HG3 PRO 28 -6.273 -12.012 20.414 268 HD2 PRO 28 HD2 PRO 28 -8.818 -11.495 21.366 269 HD3 PRO 28 HD3 PRO 28 -7.441 -10.372 21.587 270 H THR 29 H THR 29 -9.929 -8.868 17.193 271 HA THR 29 HA THR 29 -10.855 -11.163 15.604 272 HB THR 29 HB THR 29 -12.127 -11.240 17.755 273 HG1 THR 29 HG1 THR 29 -14.046 -11.732 16.752 274 HG21 THR 29 HG21 THR 29 -13.761 -8.909 16.696 275 HG22 THR 29 HG22 THR 29 -13.921 -9.768 18.240 276 HG23 THR 29 HG23 THR 29 -12.515 -8.731 17.945 277 H GLN 30 H GLN 30 -9.476 -8.789 14.970 278 HA GLN 30 HA GLN 30 -11.433 -7.086 13.674 279 HB2 GLN 30 HB2 GLN 30 -9.654 -5.475 13.403 280 HB3 GLN 30 HB3 GLN 30 -9.575 -6.167 15.020 281 HG2 GLN 30 HG2 GLN 30 -7.809 -7.828 13.963 282 HG3 GLN 30 HG3 GLN 30 -7.727 -6.645 12.660 283 HE21 GLN 30 HE21 GLN 30 -6.119 -5.788 16.356 284 HE22 GLN 30 HE22 GLN 30 -7.175 -7.173 16.160 285 H LYS 31 H LYS 31 -10.850 -9.772 12.642 286 HA LYS 31 HA LYS 31 -9.640 -9.377 9.980 287 HB2 LYS 31 HB2 LYS 31 -9.074 -11.199 11.675 288 HB3 LYS 31 HB3 LYS 31 -10.655 -11.878 11.370 289 HG2 LYS 31 HG2 LYS 31 -9.287 -13.193 10.080 290 HG3 LYS 31 HG3 LYS 31 -9.891 -12.078 8.867 291 HD2 LYS 31 HD2 LYS 31 -7.207 -11.745 10.293 292 HD3 LYS 31 HD3 LYS 31 -7.416 -12.694 8.823 293 HE2 LYS 31 HE2 LYS 31 -8.281 -10.668 7.641 294 HE3 LYS 31 HE3 LYS 31 -7.935 -9.705 9.088 295 HZ1 LYS 31 HZ1 LYS 31 -5.913 -11.212 7.522 296 HZ2 LYS 31 HZ2 LYS 31 -6.099 -9.588 7.509 297 HZ3 LYS 31 HZ3 LYS 31 -5.594 -10.337 8.867 298 H THR 32 H THR 32 -11.699 -7.911 9.744 299 HA THR 32 HA THR 32 -13.979 -9.496 8.629 300 HB THR 32 HB THR 32 -14.184 -8.764 11.010 301 HG1 THR 32 HG1 THR 32 -16.311 -8.168 10.789 302 HG21 THR 32 HG21 THR 32 -14.565 -5.979 9.838 303 HG22 THR 32 HG22 THR 32 -14.812 -6.472 11.526 304 HG23 THR 32 HG23 THR 32 -13.186 -6.503 10.831 305 H GLY 33 H GLY 33 -11.816 -7.463 7.452 306 HA2 GLY 33 HA2 GLY 33 -13.054 -6.979 5.033 307 HA3 GLY 33 HA3 GLY 33 -13.560 -5.593 5.996 308 H GLU 34 H GLU 34 -10.364 -7.293 5.683 309 HA GLU 34 HA GLU 34 -8.998 -4.787 5.948 310 HB2 GLU 34 HB2 GLU 34 -8.365 -7.183 6.728 311 HB3 GLU 34 HB3 GLU 34 -7.724 -7.393 5.089 312 HG2 GLU 34 HG2 GLU 34 -6.269 -5.387 5.466 313 HG3 GLU 34 HG3 GLU 34 -6.986 -5.201 7.067 314 H LEU 35 H LEU 35 -9.356 -6.984 3.152 315 HA LEU 35 HA LEU 35 -9.090 -4.816 1.253 316 HB2 LEU 35 HB2 LEU 35 -7.166 -7.201 1.210 317 HB3 LEU 35 HB3 LEU 35 -7.562 -6.233 -0.194 318 HG LEU 35 HG LEU 35 -6.824 -4.221 1.446 319 HD11 LEU 35 HD11 LEU 35 -4.944 -6.508 2.192 320 HD12 LEU 35 HD12 LEU 35 -4.861 -4.816 2.737 321 HD13 LEU 35 HD13 LEU 35 -6.178 -5.864 3.277 322 HD21 LEU 35 HD21 LEU 35 -5.945 -4.669 -0.818 323 HD22 LEU 35 HD22 LEU 35 -4.653 -4.254 0.314 324 HD23 LEU 35 HD23 LEU 35 -4.911 -5.950 -0.168 325 H SER 36 H SER 36 -10.231 -5.217 -0.514 326 HA SER 36 HA SER 36 -11.331 -7.914 -1.119 327 HB2 SER 36 HB2 SER 36 -12.960 -6.724 0.339 328 HB3 SER 36 HB3 SER 36 -13.067 -5.442 -0.881 329 HG SER 36 HG SER 36 -14.721 -7.036 -1.116 330 H GLU 37 H GLU 37 -11.518 -4.619 -2.392 331 HA GLU 37 HA GLU 37 -10.820 -5.576 -5.105 332 HB2 GLU 37 HB2 GLU 37 -13.005 -5.345 -6.039 333 HB3 GLU 37 HB3 GLU 37 -13.162 -6.368 -4.600 334 HG2 GLU 37 HG2 GLU 37 -13.978 -4.389 -3.308 335 HG3 GLU 37 HG3 GLU 37 -13.910 -3.417 -4.780 336 H GLU 38 H GLU 38 -11.764 -2.945 -2.984 337 HA GLU 38 HA GLU 38 -10.848 -0.943 -4.969 338 HB2 GLU 38 HB2 GLU 38 -13.144 -1.000 -3.640 339 HB3 GLU 38 HB3 GLU 38 -12.158 -0.391 -2.316 340 HG2 GLU 38 HG2 GLU 38 -13.132 1.485 -3.355 341 HG3 GLU 38 HG3 GLU 38 -11.451 1.504 -3.871 342 H GLN 39 H GLN 39 -9.363 -2.867 -2.863 343 HA GLN 39 HA GLN 39 -7.567 -0.747 -1.720 344 HB2 GLN 39 HB2 GLN 39 -8.114 -3.576 -0.727 345 HB3 GLN 39 HB3 GLN 39 -7.084 -2.367 0.029 346 HG2 GLN 39 HG2 GLN 39 -9.049 -2.257 1.284 347 HG3 GLN 39 HG3 GLN 39 -9.166 -0.871 0.207 348 HE21 GLN 39 HE21 GLN 39 -12.525 -2.202 -0.066 349 HE22 GLN 39 HE22 GLN 39 -11.546 -1.064 0.854 350 H LYS 40 H LYS 40 -7.331 -4.112 -3.059 351 HA LYS 40 HA LYS 40 -4.503 -3.811 -3.548 352 HB2 LYS 40 HB2 LYS 40 -4.560 -5.810 -4.813 353 HB3 LYS 40 HB3 LYS 40 -5.448 -6.028 -3.326 354 HG2 LYS 40 HG2 LYS 40 -6.818 -5.414 -5.983 355 HG3 LYS 40 HG3 LYS 40 -6.345 -7.044 -5.547 356 HD2 LYS 40 HD2 LYS 40 -8.282 -5.342 -3.922 357 HD3 LYS 40 HD3 LYS 40 -8.747 -6.554 -5.091 358 HE2 LYS 40 HE2 LYS 40 -6.888 -7.389 -2.848 359 HE3 LYS 40 HE3 LYS 40 -8.581 -7.094 -2.465 360 HZ1 LYS 40 HZ1 LYS 40 -7.705 -8.969 -4.595 361 HZ2 LYS 40 HZ2 LYS 40 -8.164 -9.418 -3.093 362 HZ3 LYS 40 HZ3 LYS 40 -9.245 -8.705 -4.085 363 H LYS 41 H LYS 41 -7.271 -2.664 -5.372 364 HA LYS 41 HA LYS 41 -5.777 -2.050 -7.797 365 HB2 LYS 41 HB2 LYS 41 -8.325 -0.873 -6.612 366 HB3 LYS 41 HB3 LYS 41 -7.644 -0.382 -8.169 367 HG2 LYS 41 HG2 LYS 41 -7.765 -2.735 -8.972 368 HG3 LYS 41 HG3 LYS 41 -8.545 -3.200 -7.452 369 HD2 LYS 41 HD2 LYS 41 -10.346 -1.479 -7.948 370 HD3 LYS 41 HD3 LYS 41 -9.618 -1.234 -9.538 371 HE2 LYS 41 HE2 LYS 41 -10.667 -3.895 -8.458 372 HE3 LYS 41 HE3 LYS 41 -11.590 -2.802 -9.490 373 HZ1 LYS 41 HZ1 LYS 41 -9.058 -4.141 -10.284 374 HZ2 LYS 41 HZ2 LYS 41 -10.551 -4.536 -10.808 375 HZ3 LYS 41 HZ3 LYS 41 -9.901 -3.099 -11.224 376 H ILE 42 H ILE 42 -5.489 -0.746 -4.676 377 HA ILE 42 HA ILE 42 -4.089 1.708 -5.640 378 HB ILE 42 HB ILE 42 -4.902 0.756 -2.880 379 HG12 ILE 42 HG12 ILE 42 -6.210 2.698 -2.685 380 HG13 ILE 42 HG13 ILE 42 -5.650 3.368 -4.227 381 HG21 ILE 42 HG21 ILE 42 -3.256 3.221 -3.528 382 HG22 ILE 42 HG22 ILE 42 -3.984 2.840 -1.953 383 HG23 ILE 42 HG23 ILE 42 -2.721 1.802 -2.596 384 HD11 ILE 42 HD11 ILE 42 -7.284 0.830 -3.997 385 HD12 ILE 42 HD12 ILE 42 -8.014 2.445 -4.127 386 HD13 ILE 42 HD13 ILE 42 -7.012 1.826 -5.451 387 H VAL 43 H VAL 43 -3.466 -1.076 -3.410 388 HA VAL 43 HA VAL 43 -0.672 -0.425 -3.364 389 HB VAL 43 HB VAL 43 -1.973 -2.960 -2.299 390 HG11 VAL 43 HG11 VAL 43 0.615 -1.476 -1.586 391 HG12 VAL 43 HG12 VAL 43 -0.034 -2.868 -0.701 392 HG13 VAL 43 HG13 VAL 43 0.507 -3.072 -2.360 393 HG21 VAL 43 HG21 VAL 43 -3.136 -1.041 -1.358 394 HG22 VAL 43 HG22 VAL 43 -2.032 -1.662 -0.137 395 HG23 VAL 43 HG23 VAL 43 -1.592 -0.211 -1.054 396 H ALA 44 H ALA 44 -2.320 -3.278 -4.869 397 HA ALA 44 HA ALA 44 0.190 -4.411 -5.765 398 HB1 ALA 44 HB1 ALA 44 -2.649 -4.963 -6.723 399 HB2 ALA 44 HB2 ALA 44 -1.228 -5.992 -6.956 400 HB3 ALA 44 HB3 ALA 44 -1.862 -5.736 -5.321 401 H ASP 45 H ASP 45 -2.061 -2.086 -7.101 402 HA ASP 45 HA ASP 45 -0.829 -1.839 -9.719 403 HB2 ASP 45 HB2 ASP 45 -3.152 -1.143 -9.144 404 HB3 ASP 45 HB3 ASP 45 -2.493 0.135 -8.120 405 H TYR 46 H TYR 46 -0.226 -0.178 -6.554 406 HA TYR 46 HA TYR 46 1.687 1.686 -7.575 407 HB2 TYR 46 HB2 TYR 46 0.461 1.381 -5.207 408 HB3 TYR 46 HB3 TYR 46 1.951 0.575 -4.783 409 HD1 TYR 46 HD1 TYR 46 0.803 2.981 -3.465 410 HD2 TYR 46 HD2 TYR 46 3.581 2.675 -6.736 411 HE1 TYR 46 HE1 TYR 46 1.686 5.241 -2.915 412 HE2 TYR 46 HE2 TYR 46 4.392 4.931 -6.292 413 HH TYR 46 HH TYR 46 3.136 6.928 -3.559 414 H ILE 47 H ILE 47 2.022 -1.640 -6.348 415 HA ILE 47 HA ILE 47 4.875 -1.863 -6.692 416 HB ILE 47 HB ILE 47 2.553 -3.708 -6.265 417 HG12 ILE 47 HG12 ILE 47 3.733 -4.391 -4.308 418 HG13 ILE 47 HG13 ILE 47 5.258 -3.726 -4.879 419 HG21 ILE 47 HG21 ILE 47 5.295 -4.743 -7.039 420 HG22 ILE 47 HG22 ILE 47 3.975 -5.709 -6.345 421 HG23 ILE 47 HG23 ILE 47 3.782 -4.984 -7.947 422 HD11 ILE 47 HD11 ILE 47 2.871 -2.061 -3.998 423 HD12 ILE 47 HD12 ILE 47 4.343 -2.397 -3.058 424 HD13 ILE 47 HD13 ILE 47 4.451 -1.446 -4.546 425 H SER 48 H SER 48 2.305 -1.811 -9.031 426 HA SER 48 HA SER 48 4.104 -2.636 -11.236 427 HB2 SER 48 HB2 SER 48 1.222 -1.696 -11.336 428 HB3 SER 48 HB3 SER 48 2.174 -2.337 -12.678 429 HG SER 48 HG SER 48 0.859 -3.937 -11.764 430 H GLU 49 H GLU 49 3.618 0.281 -9.508 431 HA GLU 49 HA GLU 49 4.036 1.987 -11.920 432 HB2 GLU 49 HB2 GLU 49 1.981 2.354 -10.700 433 HB3 GLU 49 HB3 GLU 49 2.865 2.557 -9.181 434 HG2 GLU 49 HG2 GLU 49 3.805 4.610 -9.850 435 HG3 GLU 49 HG3 GLU 49 3.389 4.357 -11.554 436 H VAL 50 H VAL 50 5.421 1.267 -8.694 437 HA VAL 50 HA VAL 50 7.845 2.810 -9.510 438 HB VAL 50 HB VAL 50 6.081 3.954 -7.908 439 HG11 VAL 50 HG11 VAL 50 7.679 2.419 -5.854 440 HG12 VAL 50 HG12 VAL 50 6.516 3.735 -5.592 441 HG13 VAL 50 HG13 VAL 50 5.967 2.185 -6.255 442 HG21 VAL 50 HG21 VAL 50 7.965 5.109 -8.636 443 HG22 VAL 50 HG22 VAL 50 7.968 5.230 -6.869 444 HG23 VAL 50 HG23 VAL 50 9.080 4.109 -7.708 445 H GLY 51 H GLY 51 6.655 -0.062 -8.023 446 HA2 GLY 51 HA2 GLY 51 8.351 -1.855 -8.577 447 HA3 GLY 51 HA3 GLY 51 9.478 -0.973 -7.542 448 H LEU 52 H LEU 52 8.885 -0.660 -5.350 449 HA LEU 52 HA LEU 52 6.930 -2.190 -3.917 450 HB2 LEU 52 HB2 LEU 52 8.346 -4.107 -4.620 451 HB3 LEU 52 HB3 LEU 52 9.787 -3.294 -4.031 452 HG LEU 52 HG LEU 52 9.013 -3.549 -1.702 453 HD11 LEU 52 HD11 LEU 52 6.643 -5.025 -2.929 454 HD12 LEU 52 HD12 LEU 52 7.065 -4.971 -1.196 455 HD13 LEU 52 HD13 LEU 52 6.565 -3.494 -2.024 456 HD21 LEU 52 HD21 LEU 52 10.356 -5.332 -2.752 457 HD22 LEU 52 HD22 LEU 52 9.216 -5.992 -1.567 458 HD23 LEU 52 HD23 LEU 52 8.870 -6.137 -3.302 459 H ASN 53 H ASN 53 10.035 -0.616 -3.947 460 HA ASN 53 HA ASN 53 9.841 0.098 -1.073 461 HB2 ASN 53 HB2 ASN 53 12.214 -0.097 -1.004 462 HB3 ASN 53 HB3 ASN 53 11.582 -1.513 -1.837 463 HD21 ASN 53 HD21 ASN 53 13.363 -0.831 -4.818 464 HD22 ASN 53 HD22 ASN 53 12.250 -1.906 -3.994 465 H ASN 54 H ASN 54 9.456 1.736 -3.983 466 HA ASN 54 HA ASN 54 10.750 4.236 -2.975 467 HB2 ASN 54 HB2 ASN 54 9.564 3.571 -5.668 468 HB3 ASN 54 HB3 ASN 54 10.444 5.041 -5.268 469 HD21 ASN 54 HD21 ASN 54 12.472 1.801 -6.474 470 HD22 ASN 54 HD22 ASN 54 10.735 1.982 -6.678 471 H LEU 55 H LEU 55 7.623 2.768 -3.291 472 HA LEU 55 HA LEU 55 5.977 5.127 -3.151 473 HB2 LEU 55 HB2 LEU 55 4.221 3.542 -2.525 474 HB3 LEU 55 HB3 LEU 55 5.126 3.010 -3.920 475 HG LEU 55 HG LEU 55 6.483 1.705 -1.865 476 HD11 LEU 55 HD11 LEU 55 3.504 1.642 -1.221 477 HD12 LEU 55 HD12 LEU 55 4.780 0.645 -0.488 478 HD13 LEU 55 HD13 LEU 55 4.759 2.398 -0.215 479 HD21 LEU 55 HD21 LEU 55 5.776 0.718 -4.017 480 HD22 LEU 55 HD22 LEU 55 5.322 -0.295 -2.643 481 HD23 LEU 55 HD23 LEU 55 4.092 0.700 -3.454 482 H ASN 56 H ASN 56 4.670 5.778 -1.284 483 HA ASN 56 HA ASN 56 6.060 5.394 1.319 484 HB2 ASN 56 HB2 ASN 56 5.690 7.624 1.929 485 HB3 ASN 56 HB3 ASN 56 6.367 7.670 0.316 486 HD21 ASN 56 HD21 ASN 56 3.819 10.135 -0.070 487 HD22 ASN 56 HD22 ASN 56 5.520 9.895 0.309 488 H ALA 57 H ALA 57 4.584 5.963 3.155 489 HA ALA 57 HA ALA 57 2.292 4.126 3.038 490 HB1 ALA 57 HB1 ALA 57 3.766 5.618 5.243 491 HB2 ALA 57 HB2 ALA 57 2.455 4.462 5.529 492 HB3 ALA 57 HB3 ALA 57 3.960 3.915 4.767 493 H THR 58 H THR 58 2.818 7.566 2.981 494 HA THR 58 HA THR 58 0.385 8.519 4.105 495 HB THR 58 HB THR 58 2.149 9.835 2.008 496 HG1 THR 58 HG1 THR 58 3.229 10.689 3.807 497 HG21 THR 58 HG21 THR 58 0.291 10.990 4.133 498 HG22 THR 58 HG22 THR 58 1.429 11.938 3.142 499 HG23 THR 58 HG23 THR 58 0.095 11.080 2.365 500 H GLU 59 H GLU 59 1.285 7.939 0.660 501 HA GLU 59 HA GLU 59 -1.305 8.643 -0.400 502 HB2 GLU 59 HB2 GLU 59 0.869 6.802 -1.475 503 HB3 GLU 59 HB3 GLU 59 -0.526 7.341 -2.410 504 HG2 GLU 59 HG2 GLU 59 1.627 9.172 -1.256 505 HG3 GLU 59 HG3 GLU 59 1.553 8.604 -2.911 506 H LEU 60 H LEU 60 0.011 5.516 0.696 507 HA LEU 60 HA LEU 60 -2.308 3.928 0.120 508 HB2 LEU 60 HB2 LEU 60 0.116 3.680 1.884 509 HB3 LEU 60 HB3 LEU 60 -1.286 2.717 2.324 510 HG LEU 60 HG LEU 60 -1.377 1.760 0.042 511 HD11 LEU 60 HD11 LEU 60 1.299 3.160 -0.342 512 HD12 LEU 60 HD12 LEU 60 0.622 1.908 -1.403 513 HD13 LEU 60 HD13 LEU 60 -0.195 3.473 -1.255 514 HD21 LEU 60 HD21 LEU 60 -0.268 0.572 1.882 515 HD22 LEU 60 HD22 LEU 60 0.585 0.275 0.358 516 HD23 LEU 60 HD23 LEU 60 1.250 1.427 1.535 517 H SER 61 H SER 61 -1.446 5.614 3.220 518 HA SER 61 HA SER 61 -3.799 4.852 4.588 519 HB2 SER 61 HB2 SER 61 -3.207 6.592 6.193 520 HB3 SER 61 HB3 SER 61 -1.795 5.629 5.716 521 HG SER 61 HG SER 61 -1.194 7.753 5.632 522 H LYS 62 H LYS 62 -3.317 7.306 2.200 523 HA LYS 62 HA LYS 62 -5.650 8.979 2.860 524 HB2 LYS 62 HB2 LYS 62 -3.623 8.892 0.608 525 HB3 LYS 62 HB3 LYS 62 -5.079 9.871 0.454 526 HG2 LYS 62 HG2 LYS 62 -4.548 11.229 2.315 527 HG3 LYS 62 HG3 LYS 62 -3.251 10.164 2.862 528 HD2 LYS 62 HD2 LYS 62 -1.887 10.676 0.905 529 HD3 LYS 62 HD3 LYS 62 -3.189 11.622 0.175 530 HE2 LYS 62 HE2 LYS 62 -1.857 12.304 2.836 531 HE3 LYS 62 HE3 LYS 62 -1.342 12.959 1.277 532 HZ1 LYS 62 HZ1 LYS 62 -4.027 13.372 2.482 533 HZ2 LYS 62 HZ2 LYS 62 -2.843 14.487 2.385 534 HZ3 LYS 62 HZ3 LYS 62 -3.556 13.947 1.024 535 H ARG 63 H ARG 63 -4.957 6.486 0.410 536 HA ARG 63 HA ARG 63 -7.732 6.597 -0.639 537 HB2 ARG 63 HB2 ARG 63 -5.266 4.946 -1.318 538 HB3 ARG 63 HB3 ARG 63 -6.846 4.662 -2.051 539 HG2 ARG 63 HG2 ARG 63 -5.480 7.371 -2.222 540 HG3 ARG 63 HG3 ARG 63 -5.215 6.068 -3.390 541 HD2 ARG 63 HD2 ARG 63 -7.675 5.955 -3.809 542 HD3 ARG 63 HD3 ARG 63 -7.915 7.342 -2.753 543 HE ARG 63 HE ARG 63 -6.631 7.288 -5.437 544 HH11 ARG 63 HH11 ARG 63 -6.503 9.171 -6.581 545 HH12 ARG 63 HH12 ARG 63 -6.866 10.689 -5.813 546 HH21 ARG 63 HH21 ARG 63 -7.593 9.329 -2.751 547 HH22 ARG 63 HH22 ARG 63 -7.473 10.782 -3.704 548 H LEU 64 H LEU 64 -5.810 4.363 1.336 549 HA LEU 64 HA LEU 64 -7.977 2.377 1.426 550 HB2 LEU 64 HB2 LEU 64 -5.309 2.469 2.861 551 HB3 LEU 64 HB3 LEU 64 -6.361 1.069 2.723 552 HG LEU 64 HG LEU 64 -5.009 2.417 0.336 553 HD11 LEU 64 HD11 LEU 64 -4.232 -0.106 1.848 554 HD12 LEU 64 HD12 LEU 64 -3.461 0.559 0.390 555 HD13 LEU 64 HD13 LEU 64 -3.372 1.453 1.906 556 HD21 LEU 64 HD21 LEU 64 -7.002 1.173 -0.316 557 HD22 LEU 64 HD22 LEU 64 -5.557 0.245 -0.758 558 HD23 LEU 64 HD23 LEU 64 -6.491 -0.213 0.680 559 H ASN 65 H ASN 65 -7.018 5.070 3.388 560 HA ASN 65 HA ASN 65 -7.708 5.919 5.324 561 HB2 ASN 65 HB2 ASN 65 -9.929 5.512 4.068 562 HB3 ASN 65 HB3 ASN 65 -10.214 4.222 5.231 563 HD21 ASN 65 HD21 ASN 65 -10.715 6.565 7.960 564 HD22 ASN 65 HD22 ASN 65 -9.972 4.995 7.626 565 H ILE 66 H ILE 66 -5.968 3.772 5.426 566 HA ILE 66 HA ILE 66 -6.335 2.539 8.112 567 HB ILE 66 HB ILE 66 -4.122 1.466 7.611 568 HG12 ILE 66 HG12 ILE 66 -4.495 2.774 4.891 569 HG13 ILE 66 HG13 ILE 66 -3.164 2.993 6.018 570 HG21 ILE 66 HG21 ILE 66 -6.280 0.837 5.569 571 HG22 ILE 66 HG22 ILE 66 -5.047 -0.266 6.234 572 HG23 ILE 66 HG23 ILE 66 -6.317 0.356 7.283 573 HD11 ILE 66 HD11 ILE 66 -3.810 0.493 4.403 574 HD12 ILE 66 HD12 ILE 66 -2.500 1.642 4.132 575 HD13 ILE 66 HD13 ILE 66 -2.491 0.622 5.598 576 H THR 67 H THR 67 -4.498 2.811 9.662 577 HA THR 67 HA THR 67 -3.468 5.565 9.752 578 HB THR 67 HB THR 67 -4.065 4.502 11.840 579 HG1 THR 67 HG1 THR 67 -2.208 5.108 12.901 580 HG21 THR 67 HG21 THR 67 -1.691 2.636 11.431 581 HG22 THR 67 HG22 THR 67 -2.721 2.755 12.867 582 HG23 THR 67 HG23 THR 67 -3.399 2.135 11.357 583 H VAL 68 H VAL 68 -1.246 6.127 9.702 584 HA VAL 68 HA VAL 68 0.135 5.175 7.410 585 HB VAL 68 HB VAL 68 1.365 6.700 9.743 586 HG11 VAL 68 HG11 VAL 68 2.023 6.703 6.761 587 HG12 VAL 68 HG12 VAL 68 2.819 7.685 8.008 588 HG13 VAL 68 HG13 VAL 68 3.002 5.931 8.028 589 HG21 VAL 68 HG21 VAL 68 -0.673 7.903 9.046 590 HG22 VAL 68 HG22 VAL 68 0.763 8.768 8.503 591 HG23 VAL 68 HG23 VAL 68 -0.165 7.797 7.346 592 H ASP 69 H ASP 69 0.510 4.295 10.825 593 HA ASP 69 HA ASP 69 2.859 2.700 10.408 594 HB2 ASP 69 HB2 ASP 69 2.181 3.731 12.581 595 HB3 ASP 69 HB3 ASP 69 0.822 2.608 12.669 596 H LYS 70 H LYS 70 -0.575 1.889 10.149 597 HA LYS 70 HA LYS 70 -0.033 -0.986 9.853 598 HB2 LYS 70 HB2 LYS 70 -2.499 0.730 9.385 599 HB3 LYS 70 HB3 LYS 70 -2.379 -0.915 8.751 600 HG2 LYS 70 HG2 LYS 70 -1.810 -1.721 11.081 601 HG3 LYS 70 HG3 LYS 70 -2.225 -0.107 11.682 602 HD2 LYS 70 HD2 LYS 70 -4.534 -0.375 10.796 603 HD3 LYS 70 HD3 LYS 70 -4.085 -1.945 10.096 604 HE2 LYS 70 HE2 LYS 70 -3.490 -2.745 12.416 605 HE3 LYS 70 HE3 LYS 70 -4.134 -1.233 13.063 606 HZ1 LYS 70 HZ1 LYS 70 -5.703 -3.212 11.488 607 HZ2 LYS 70 HZ2 LYS 70 -5.780 -3.055 13.105 608 HZ3 LYS 70 HZ3 LYS 70 -6.307 -1.839 12.141 609 H ALA 71 H ALA 71 -0.173 1.831 7.725 610 HA ALA 71 HA ALA 71 -0.044 0.269 5.251 611 HB1 ALA 71 HB1 ALA 71 0.741 3.162 5.845 612 HB2 ALA 71 HB2 ALA 71 0.547 2.450 4.232 613 HB3 ALA 71 HB3 ALA 71 -0.846 2.641 5.316 614 H LYS 72 H LYS 72 2.420 1.925 7.232 615 HA LYS 72 HA LYS 72 4.781 1.262 5.813 616 HB2 LYS 72 HB2 LYS 72 4.118 1.818 8.717 617 HB3 LYS 72 HB3 LYS 72 5.766 1.354 8.266 618 HG2 LYS 72 HG2 LYS 72 6.035 3.268 6.864 619 HG3 LYS 72 HG3 LYS 72 4.317 3.661 6.971 620 HD2 LYS 72 HD2 LYS 72 5.742 5.162 8.318 621 HD3 LYS 72 HD3 LYS 72 4.464 4.355 9.236 622 HE2 LYS 72 HE2 LYS 72 6.032 2.777 10.193 623 HE3 LYS 72 HE3 LYS 72 7.345 3.374 9.161 624 HZ1 LYS 72 HZ1 LYS 72 5.969 4.976 11.256 625 HZ2 LYS 72 HZ2 LYS 72 7.455 4.322 11.401 626 HZ3 LYS 72 HZ3 LYS 72 7.196 5.510 10.315 627 H THR 73 H THR 73 3.135 -0.720 8.307 628 HA THR 73 HA THR 73 5.161 -2.863 7.957 629 HB THR 73 HB THR 73 4.052 -2.120 10.156 630 HG1 THR 73 HG1 THR 73 4.335 -4.245 10.897 631 HG21 THR 73 HG21 THR 73 2.017 -4.237 9.344 632 HG22 THR 73 HG22 THR 73 2.157 -3.407 10.906 633 HG23 THR 73 HG23 THR 73 1.672 -2.496 9.472 634 H TYR 74 H TYR 74 1.717 -2.416 7.022 635 HA TYR 74 HA TYR 74 1.300 -5.002 5.980 636 HB2 TYR 74 HB2 TYR 74 -0.512 -3.466 6.363 637 HB3 TYR 74 HB3 TYR 74 0.173 -2.293 5.228 638 HD1 TYR 74 HD1 TYR 74 -0.242 -2.356 2.934 639 HD2 TYR 74 HD2 TYR 74 -1.418 -5.671 5.440 640 HE1 TYR 74 HE1 TYR 74 -1.318 -3.429 1.004 641 HE2 TYR 74 HE2 TYR 74 -2.506 -6.758 3.474 642 HH TYR 74 HH TYR 74 -2.301 -5.354 0.186 643 H ILE 75 H ILE 75 2.785 -2.160 4.363 644 HA ILE 75 HA ILE 75 3.070 -3.067 1.743 645 HB ILE 75 HB ILE 75 4.880 -1.440 3.549 646 HG12 ILE 75 HG12 ILE 75 3.429 -0.589 1.006 647 HG13 ILE 75 HG13 ILE 75 2.617 -0.603 2.553 648 HG21 ILE 75 HG21 ILE 75 5.414 -2.107 0.618 649 HG22 ILE 75 HG22 ILE 75 6.216 -0.794 1.513 650 HG23 ILE 75 HG23 ILE 75 6.467 -2.451 2.011 651 HD11 ILE 75 HD11 ILE 75 5.101 1.056 1.898 652 HD12 ILE 75 HD12 ILE 75 3.453 1.649 2.102 653 HD13 ILE 75 HD13 ILE 75 4.321 0.969 3.489 654 H LYS 76 H LYS 76 5.089 -4.069 4.534 655 HA LYS 76 HA LYS 76 6.537 -5.978 2.751 656 HB2 LYS 76 HB2 LYS 76 8.112 -6.247 4.631 657 HB3 LYS 76 HB3 LYS 76 7.986 -4.573 4.081 658 HG2 LYS 76 HG2 LYS 76 6.576 -3.986 5.984 659 HG3 LYS 76 HG3 LYS 76 6.542 -5.682 6.507 660 HD2 LYS 76 HD2 LYS 76 8.948 -5.623 6.983 661 HD3 LYS 76 HD3 LYS 76 9.045 -3.971 6.353 662 HE2 LYS 76 HE2 LYS 76 8.972 -3.837 8.759 663 HE3 LYS 76 HE3 LYS 76 7.462 -3.199 8.106 664 HZ1 LYS 76 HZ1 LYS 76 7.828 -5.894 9.306 665 HZ2 LYS 76 HZ2 LYS 76 6.998 -4.648 9.967 666 HZ3 LYS 76 HZ3 LYS 76 6.420 -5.384 8.647 667 H ASN 77 H ASN 77 4.431 -6.063 5.621 668 HA ASN 77 HA ASN 77 4.751 -8.900 5.947 669 HB2 ASN 77 HB2 ASN 77 2.767 -6.866 7.036 670 HB3 ASN 77 HB3 ASN 77 2.642 -8.581 7.414 671 HD21 ASN 77 HD21 ASN 77 5.297 -8.517 9.734 672 HD22 ASN 77 HD22 ASN 77 4.048 -9.488 8.959 673 H SER 78 H SER 78 2.644 -7.126 3.776 674 HA SER 78 HA SER 78 1.067 -9.538 3.122 675 HB2 SER 78 HB2 SER 78 0.120 -7.235 3.177 676 HB3 SER 78 HB3 SER 78 1.101 -6.827 1.759 677 HG SER 78 HG SER 78 -1.046 -7.529 1.230 678 H ASN 79 H ASN 79 3.686 -7.631 1.665 679 HA ASN 79 HA ASN 79 4.121 -9.723 -0.397 680 HB2 ASN 79 HB2 ASN 79 4.077 -7.978 -2.175 681 HB3 ASN 79 HB3 ASN 79 2.516 -8.309 -1.424 682 HD21 ASN 79 HD21 ASN 79 4.246 -4.656 -0.902 683 HD22 ASN 79 HD22 ASN 79 5.217 -6.010 -1.439 684 H ARG 80 H ARG 80 5.825 -9.657 1.557 685 HA ARG 80 HA ARG 80 8.046 -7.975 1.554 686 HB2 ARG 80 HB2 ARG 80 7.492 -9.761 3.224 687 HB3 ARG 80 HB3 ARG 80 7.967 -10.988 2.059 688 HG2 ARG 80 HG2 ARG 80 10.272 -10.213 2.110 689 HG3 ARG 80 HG3 ARG 80 9.834 -8.819 3.120 690 HD2 ARG 80 HD2 ARG 80 9.482 -10.113 5.026 691 HD3 ARG 80 HD3 ARG 80 9.146 -11.581 4.122 692 HE ARG 80 HE ARG 80 11.810 -10.489 4.814 693 HH11 ARG 80 HH11 ARG 80 13.601 -11.782 4.505 694 HH12 ARG 80 HH12 ARG 80 13.446 -13.292 3.655 695 HH21 ARG 80 HH21 ARG 80 10.084 -13.002 3.080 696 HH22 ARG 80 HH22 ARG 80 11.521 -13.959 2.851 697 H MET 81 H MET 81 7.587 -10.830 -0.467 698 HA MET 81 HA MET 81 10.078 -10.191 -2.005 699 HB2 MET 81 HB2 MET 81 8.538 -12.797 -1.773 700 HB3 MET 81 HB3 MET 81 9.978 -12.535 -2.772 701 HG2 MET 81 HG2 MET 81 11.223 -11.823 -0.712 702 HG3 MET 81 HG3 MET 81 9.834 -12.304 0.260 703 HE1 MET 81 HE1 MET 81 8.853 -15.060 -1.082 704 HE2 MET 81 HE2 MET 81 9.801 -16.204 -0.115 705 HE3 MET 81 HE3 MET 81 9.060 -14.789 0.664 706 H GLY 82 H GLY 82 6.654 -10.057 -2.368 707 HA2 GLY 82 HA2 GLY 82 5.841 -8.617 -4.143 708 HA3 GLY 82 HA3 GLY 82 6.971 -9.365 -5.267 709 H ARG 83 H ARG 83 3.836 -9.223 -4.593 710 HA ARG 83 HA ARG 83 1.955 -10.556 -4.693 711 HB2 ARG 83 HB2 ARG 83 3.479 -11.598 -7.093 712 HB3 ARG 83 HB3 ARG 83 1.715 -11.568 -6.877 713 HG2 ARG 83 HG2 ARG 83 1.994 -8.984 -6.613 714 HG3 ARG 83 HG3 ARG 83 3.628 -9.229 -7.253 715 HD2 ARG 83 HD2 ARG 83 2.453 -10.475 -9.197 716 HD3 ARG 83 HD3 ARG 83 0.970 -9.704 -8.633 717 HE ARG 83 HE ARG 83 3.162 -8.527 -10.117 718 HH11 ARG 83 HH11 ARG 83 3.134 -6.463 -10.810 719 HH12 ARG 83 HH12 ARG 83 2.047 -5.302 -10.125 720 HH21 ARG 83 HH21 ARG 83 0.671 -7.478 -7.852 721 HH22 ARG 83 HH22 ARG 83 0.777 -5.826 -8.440 722 H THR 84 H THR 84 3.363 -11.533 -2.753 723 HA THR 84 HA THR 84 4.015 -13.230 -1.442 724 HB THR 84 HB THR 84 1.756 -14.973 -2.338 725 HG1 THR 84 HG1 THR 84 0.292 -13.571 -1.360 726 HG21 THR 84 HG21 THR 84 2.635 -13.786 0.344 727 HG22 THR 84 HG22 THR 84 1.358 -15.008 0.113 728 HG23 THR 84 HG23 THR 84 3.047 -15.413 -0.232 729 H ASN 85 H ASN 85 5.303 -13.370 -4.038 730 HA ASN 85 HA ASN 85 6.487 -14.637 -5.411 731 HB2 ASN 85 HB2 ASN 85 7.501 -14.976 -3.009 732 HB3 ASN 85 HB3 ASN 85 6.967 -16.642 -3.197 733 HD21 ASN 85 HD21 ASN 85 9.395 -17.263 -5.849 734 HD22 ASN 85 HD22 ASN 85 7.704 -17.608 -5.451 735 H ASN 86 H ASN 86 3.606 -15.231 -5.360 736 HA ASN 86 HA ASN 86 3.523 -18.063 -6.186 737 HB2 ASN 86 HB2 ASN 86 1.401 -18.097 -5.553 738 HB3 ASN 86 HB3 ASN 86 1.809 -16.649 -4.649 739 HD21 ASN 86 HD21 ASN 86 -0.004 -14.525 -6.997 740 HD22 ASN 86 HD22 ASN 86 1.463 -14.509 -6.020 741 H PHE 87 H PHE 87 3.874 -15.048 -7.703 742 HA PHE 87 HA PHE 87 2.388 -15.456 -10.092 743 HB2 PHE 87 HB2 PHE 87 3.122 -13.314 -10.672 744 HB3 PHE 87 HB3 PHE 87 2.988 -13.296 -8.925 745 HD1 PHE 87 HD1 PHE 87 5.132 -13.431 -7.499 746 HD2 PHE 87 HD2 PHE 87 5.169 -12.814 -11.770 747 HE1 PHE 87 HE1 PHE 87 7.480 -12.657 -7.364 748 HE2 PHE 87 HE2 PHE 87 7.528 -12.036 -11.629 749 HZ PHE 87 HZ PHE 87 8.688 -11.964 -9.428 750 H LYS 88 H LYS 88 4.674 -17.446 -9.517 751 HA LYS 88 HA LYS 88 6.534 -17.023 -11.793 752 HB2 LYS 88 HB2 LYS 88 7.872 -18.811 -10.507 753 HB3 LYS 88 HB3 LYS 88 7.786 -17.161 -9.911 754 HG2 LYS 88 HG2 LYS 88 7.670 -18.736 -8.083 755 HG3 LYS 88 HG3 LYS 88 6.196 -17.787 -8.184 756 HD2 LYS 88 HD2 LYS 88 5.041 -19.730 -9.273 757 HD3 LYS 88 HD3 LYS 88 6.548 -20.663 -9.140 758 HE2 LYS 88 HE2 LYS 88 6.481 -20.302 -6.652 759 HE3 LYS 88 HE3 LYS 88 4.943 -19.453 -6.835 760 HZ1 LYS 88 HZ1 LYS 88 5.425 -22.295 -7.579 761 HZ2 LYS 88 HZ2 LYS 88 4.614 -21.799 -6.255 762 HZ3 LYS 88 HZ3 LYS 88 3.995 -21.519 -7.740 763 H THR 89 H THR 89 3.767 -18.470 -11.632 764 HA THR 89 HA THR 89 4.432 -20.677 -13.521 765 HB THR 89 HB THR 89 2.685 -20.913 -11.026 766 HG1 THR 89 HG1 THR 89 4.256 -22.592 -10.574 767 HG21 THR 89 HG21 THR 89 3.361 -22.890 -13.221 768 HG22 THR 89 HG22 THR 89 2.530 -23.296 -11.689 769 HG23 THR 89 HG23 THR 89 1.759 -22.201 -12.851 770 H ILE 90 H ILE 90 1.887 -18.790 -11.873 771 HA ILE 90 HA ILE 90 -0.080 -19.040 -14.008 772 HB ILE 90 HB ILE 90 -1.352 -17.469 -12.676 773 HG12 ILE 90 HG12 ILE 90 0.962 -17.448 -10.692 774 HG13 ILE 90 HG13 ILE 90 0.582 -16.119 -11.791 775 HG21 ILE 90 HG21 ILE 90 -0.210 -19.690 -10.944 776 HG22 ILE 90 HG22 ILE 90 -1.827 -18.963 -10.850 777 HG23 ILE 90 HG23 ILE 90 -1.385 -19.926 -12.258 778 HD11 ILE 90 HD11 ILE 90 -1.193 -17.183 -9.570 779 HD12 ILE 90 HD12 ILE 90 -0.361 -15.617 -9.639 780 HD13 ILE 90 HD13 ILE 90 -1.695 -15.964 -10.762 781 H LYS 91 H LYS 91 -1.086 -17.040 -14.929 782 HA LYS 91 HA LYS 91 -1.063 -15.224 -16.273 783 HB2 LYS 91 HB2 LYS 91 1.029 -14.380 -14.260 784 HB3 LYS 91 HB3 LYS 91 0.713 -13.379 -15.642 785 HG2 LYS 91 HG2 LYS 91 -0.406 -12.729 -13.550 786 HG3 LYS 91 HG3 LYS 91 -1.436 -12.808 -14.972 787 HD2 LYS 91 HD2 LYS 91 -1.378 -15.106 -13.003 788 HD3 LYS 91 HD3 LYS 91 -2.294 -13.641 -12.650 789 HE2 LYS 91 HE2 LYS 91 -3.573 -13.853 -14.735 790 HE3 LYS 91 HE3 LYS 91 -2.671 -15.304 -15.171 791 HZ1 LYS 91 HZ1 LYS 91 -4.479 -15.066 -12.832 792 HZ2 LYS 91 HZ2 LYS 91 -4.748 -15.921 -14.217 793 HZ3 LYS 91 HZ3 LYS 91 -3.587 -16.399 -13.208 794 H MET 92 H MET 92 1.510 -17.337 -16.546 795 HA MET 92 HA MET 92 2.041 -16.270 -19.282 796 HB2 MET 92 HB2 MET 92 4.452 -16.651 -19.014 797 HB3 MET 92 HB3 MET 92 3.836 -15.419 -17.913 798 HG2 MET 92 HG2 MET 92 3.818 -17.043 -16.066 799 HG3 MET 92 HG3 MET 92 4.409 -18.310 -17.147 800 HE1 MET 92 HE1 MET 92 6.125 -18.645 -15.086 801 HE2 MET 92 HE2 MET 92 7.277 -17.398 -14.552 802 HE3 MET 92 HE3 MET 92 5.533 -17.174 -14.278 803 H PHE 93 H PHE 93 0.503 -18.614 -18.123 804 HA PHE 93 HA PHE 93 1.630 -20.715 -19.907 805 HB2 PHE 93 HB2 PHE 93 2.571 -20.930 -17.569 806 HB3 PHE 93 HB3 PHE 93 0.933 -21.194 -16.984 807 HD1 PHE 93 HD1 PHE 93 3.451 -22.450 -19.448 808 HD2 PHE 93 HD2 PHE 93 0.057 -23.404 -16.978 809 HE1 PHE 93 HE1 PHE 93 3.694 -24.865 -20.052 810 HE2 PHE 93 HE2 PHE 93 0.304 -25.818 -17.562 811 HZ PHE 93 HZ PHE 93 2.118 -26.543 -19.105 812 H GLU 94 H GLU 94 -1.136 -19.546 -18.018 813 HA GLU 94 HA GLU 94 -3.041 -21.489 -18.925 814 HB2 GLU 94 HB2 GLU 94 -4.684 -19.986 -17.917 815 HB3 GLU 94 HB3 GLU 94 -3.299 -20.267 -16.866 816 HG2 GLU 94 HG2 GLU 94 -2.391 -17.994 -17.896 817 HG3 GLU 94 HG3 GLU 94 -4.073 -17.744 -18.342 818 H ASP 95 H ASP 95 -4.686 -21.362 -20.460 819 HA ASP 95 HA ASP 95 -4.658 -19.248 -22.517 820 HB2 ASP 95 HB2 ASP 95 -4.149 -20.691 -24.328 821 HB3 ASP 95 HB3 ASP 95 -2.865 -20.893 -23.151 822 H ASP 96 H ASP 96 -6.337 -19.588 -24.194 823 HA ASP 96 HA ASP 96 -8.673 -21.249 -23.376 824 HB2 ASP 96 HB2 ASP 96 -8.720 -18.283 -24.065 825 HB3 ASP 96 HB3 ASP 96 -10.143 -19.316 -24.052 826 H VAL 97 H VAL 97 -9.785 -22.142 -25.020 827 HA VAL 97 HA VAL 97 -9.229 -21.344 -27.854 828 HB VAL 97 HB VAL 97 -9.287 -24.221 -26.859 829 HG11 VAL 97 HG11 VAL 97 -8.784 -23.072 -29.643 830 HG12 VAL 97 HG12 VAL 97 -8.606 -24.780 -29.180 831 HG13 VAL 97 HG13 VAL 97 -10.200 -24.028 -29.143 832 HG21 VAL 97 HG21 VAL 97 -7.145 -23.192 -26.256 833 HG22 VAL 97 HG22 VAL 97 -6.916 -24.309 -27.600 834 HG23 VAL 97 HG23 VAL 97 -6.956 -22.557 -27.905 835 H SER 98 H SER 98 -11.325 -23.428 -25.807 836 HA SER 98 HA SER 98 -13.651 -22.825 -27.563 837 HB2 SER 98 HB2 SER 98 -14.534 -24.973 -26.715 838 HB3 SER 98 HB3 SER 98 -12.983 -25.135 -27.549 839 HG SER 98 HG SER 98 -13.018 -26.309 -25.576 840 H SER 99 H SER 99 -12.584 -21.375 -24.986 841 HA SER 99 HA SER 99 -13.358 -20.372 -23.120 842 HB2 SER 99 HB2 SER 99 -14.800 -19.410 -24.982 843 HB3 SER 99 HB3 SER 99 -16.121 -20.404 -24.345 844 HG SER 99 HG SER 99 -16.089 -18.293 -23.426 845 H ALA 100 H ALA 100 -12.908 -22.854 -22.505 846 HA ALA 100 HA ALA 100 -15.100 -23.659 -20.642 847 HB1 ALA 100 HB1 ALA 100 -13.198 -25.475 -22.176 848 HB2 ALA 100 HB2 ALA 100 -14.395 -25.991 -20.969 849 HB3 ALA 100 HB3 ALA 100 -14.934 -25.261 -22.495 850 H SER 101 H SER 101 -14.573 -23.753 -18.565 851 HA SER 101 HA SER 101 -11.723 -23.920 -17.655 852 HB2 SER 101 HB2 SER 101 -13.734 -21.788 -16.827 853 HB3 SER 101 HB3 SER 101 -12.161 -22.070 -16.060 854 HG SER 101 HG SER 101 -12.093 -20.385 -17.629 855 H ALA 102 H ALA 102 -11.625 -25.567 -16.259 856 HA ALA 102 HA ALA 102 -12.171 -27.196 -14.804 857 HB1 ALA 102 HB1 ALA 102 -13.634 -24.973 -13.357 858 HB2 ALA 102 HB2 ALA 102 -12.994 -26.470 -12.645 859 HB3 ALA 102 HB3 ALA 102 -11.877 -25.260 -13.310 860 H GLN 103 H GLN 103 -13.923 -27.005 -17.025 861 HA GLN 103 HA GLN 103 -16.538 -28.053 -16.033 862 HB2 GLN 103 HB2 GLN 103 -15.745 -26.362 -18.408 863 HB3 GLN 103 HB3 GLN 103 -17.286 -27.216 -18.384 864 HG2 GLN 103 HG2 GLN 103 -18.187 -25.980 -16.657 865 HG3 GLN 103 HG3 GLN 103 -16.640 -25.526 -15.977 866 HE21 GLN 103 HE21 GLN 103 -18.142 -22.507 -17.614 867 HE22 GLN 103 HE22 GLN 103 -18.713 -23.630 -16.385 868 HA PRO 104 HA PRO 104 -15.682 -31.861 -18.057 869 HB2 PRO 104 HB2 PRO 104 -18.137 -32.976 -18.378 870 HB3 PRO 104 HB3 PRO 104 -17.453 -32.602 -16.772 871 HG2 PRO 104 HG2 PRO 104 -19.383 -30.901 -18.391 872 HG3 PRO 104 HG3 PRO 104 -19.526 -31.410 -16.678 873 HD2 PRO 104 HD2 PRO 104 -18.504 -28.982 -17.390 874 HD3 PRO 104 HD3 PRO 104 -17.873 -29.894 -15.988 875 H ASN 105 H ASN 105 -14.727 -30.760 -19.895 876 HA ASN 105 HA ASN 105 -16.207 -31.197 -22.469 877 HB2 ASN 105 HB2 ASN 105 -14.400 -28.879 -21.653 878 HB3 ASN 105 HB3 ASN 105 -14.932 -29.191 -23.304 879 HD21 ASN 105 HD21 ASN 105 -18.273 -28.059 -22.737 880 HD22 ASN 105 HD22 ASN 105 -17.278 -29.064 -23.779 881 H LEU 106 H LEU 106 -15.290 -33.293 -22.533 882 HA LEU 106 HA LEU 106 -12.508 -33.352 -23.578 883 HB2 LEU 106 HB2 LEU 106 -12.536 -33.960 -21.138 884 HB3 LEU 106 HB3 LEU 106 -13.602 -35.304 -21.525 885 HG LEU 106 HG LEU 106 -11.759 -36.164 -23.102 886 HD11 LEU 106 HD11 LEU 106 -10.118 -34.063 -21.612 887 HD12 LEU 106 HD12 LEU 106 -9.460 -35.354 -22.640 888 HD13 LEU 106 HD13 LEU 106 -10.448 -34.081 -23.358 889 HD21 LEU 106 HD21 LEU 106 -12.139 -37.127 -20.874 890 HD22 LEU 106 HD22 LEU 106 -10.412 -37.091 -21.260 891 HD23 LEU 106 HD23 LEU 106 -11.094 -35.887 -20.142 892 HA PRO 107 HA PRO 107 -15.490 -35.517 -26.385 893 HB2 PRO 107 HB2 PRO 107 -14.496 -34.647 -28.775 894 HB3 PRO 107 HB3 PRO 107 -15.581 -33.665 -27.745 895 HG2 PRO 107 HG2 PRO 107 -12.553 -33.545 -27.904 896 HG3 PRO 107 HG3 PRO 107 -13.720 -32.186 -27.961 897 HD2 PRO 107 HD2 PRO 107 -12.439 -32.903 -25.669 898 HD3 PRO 107 HD3 PRO 107 -14.128 -32.315 -25.643 Start of MODEL 13 1 H1 GLY -5 H1 GLY -5 -51.710 16.173 -25.227 2 H2 GLY -5 H2 GLY -5 -51.037 17.525 -24.588 3 H3 GLY -5 H3 GLY -5 -52.654 17.453 -24.840 4 HA2 GLY -5 HA2 GLY -5 -52.208 17.195 -22.505 5 HA3 GLY -5 HA3 GLY -5 -52.901 15.714 -23.188 6 H SER -4 H SER -4 -51.823 13.860 -22.777 7 HA SER -4 HA SER -4 -48.876 13.826 -22.456 8 HB2 SER -4 HB2 SER -4 -49.881 14.098 -20.177 9 HB3 SER -4 HB3 SER -4 -50.760 12.575 -20.421 10 HG SER -4 HG SER -4 -48.730 12.331 -19.305 11 H HIS -3 H HIS -3 -47.950 11.735 -22.782 12 HA HIS -3 HA HIS -3 -49.625 10.009 -24.562 13 HB2 HIS -3 HB2 HIS -3 -47.652 11.327 -25.467 14 HB3 HIS -3 HB3 HIS -3 -46.605 10.227 -24.579 15 HD2 HIS -3 HD2 HIS -3 -47.201 7.426 -25.262 16 HE1 HIS -3 HE1 HIS -3 -48.211 8.464 -29.278 17 HE2 HIS -3 HE2 HIS -3 -47.611 6.546 -27.716 18 H MET -2 H MET -2 -50.468 8.488 -23.273 19 HA MET -2 HA MET -2 -48.636 6.708 -21.695 20 HB2 MET -2 HB2 MET -2 -51.432 7.692 -21.020 21 HB3 MET -2 HB3 MET -2 -50.629 6.360 -20.189 22 HG2 MET -2 HG2 MET -2 -49.562 9.204 -20.360 23 HG3 MET -2 HG3 MET -2 -50.459 8.547 -19.001 24 HE1 MET -2 HE1 MET -2 -49.328 5.691 -18.374 25 HE2 MET -2 HE2 MET -2 -48.005 6.112 -17.267 26 HE3 MET -2 HE3 MET -2 -49.548 6.987 -17.175 27 H ALA -1 H ALA -1 -48.351 5.179 -23.209 28 HA ALA -1 HA ALA -1 -50.569 3.321 -23.770 29 HB1 ALA -1 HB1 ALA -1 -49.064 4.711 -26.040 30 HB2 ALA -1 HB2 ALA -1 -50.237 3.386 -26.212 31 HB3 ALA -1 HB3 ALA -1 -50.770 4.964 -25.613 32 H SER 0 H SER 0 -47.205 4.128 -24.404 33 HA SER 0 HA SER 0 -45.268 3.143 -24.563 34 HB2 SER 0 HB2 SER 0 -44.556 1.534 -23.002 35 HB3 SER 0 HB3 SER 0 -45.679 2.647 -22.212 36 HG SER 0 HG SER 0 -46.088 0.469 -21.646 37 H MET 1 H MET 1 -47.705 0.651 -25.118 38 HA MET 1 HA MET 1 -45.816 -0.929 -26.731 39 HB2 MET 1 HB2 MET 1 -48.720 -1.447 -25.994 40 HB3 MET 1 HB3 MET 1 -47.614 -2.608 -26.748 41 HG2 MET 1 HG2 MET 1 -46.106 -2.354 -24.738 42 HG3 MET 1 HG3 MET 1 -47.381 -1.409 -23.965 43 HE1 MET 1 HE1 MET 1 -50.098 -2.888 -24.687 44 HE2 MET 1 HE2 MET 1 -50.200 -4.009 -23.315 45 HE3 MET 1 HE3 MET 1 -49.623 -2.349 -23.059 46 H ASP 2 H ASP 2 -48.026 1.465 -27.435 47 HA ASP 2 HA ASP 2 -48.609 0.538 -30.200 48 HB2 ASP 2 HB2 ASP 2 -49.698 2.836 -28.543 49 HB3 ASP 2 HB3 ASP 2 -50.173 2.505 -30.207 50 H GLN 3 H GLN 3 -46.024 2.023 -28.969 51 HA GLN 3 HA GLN 3 -45.652 3.903 -31.255 52 HB2 GLN 3 HB2 GLN 3 -44.613 5.513 -29.757 53 HB3 GLN 3 HB3 GLN 3 -46.273 5.153 -29.347 54 HG2 GLN 3 HG2 GLN 3 -45.231 5.307 -27.278 55 HG3 GLN 3 HG3 GLN 3 -45.402 3.582 -27.518 56 HE21 GLN 3 HE21 GLN 3 -41.929 3.171 -26.895 57 HE22 GLN 3 HE22 GLN 3 -43.553 2.494 -26.786 58 H LEU 4 H LEU 4 -44.616 1.070 -30.722 59 HA LEU 4 HA LEU 4 -41.696 1.394 -30.742 60 HB2 LEU 4 HB2 LEU 4 -43.579 -0.977 -30.947 61 HB3 LEU 4 HB3 LEU 4 -41.874 -1.119 -31.362 62 HG LEU 4 HG LEU 4 -41.225 -0.324 -29.103 63 HD11 LEU 4 HD11 LEU 4 -44.197 -0.647 -28.509 64 HD12 LEU 4 HD12 LEU 4 -42.918 -0.494 -27.283 65 HD13 LEU 4 HD13 LEU 4 -43.243 0.848 -28.377 66 HD21 LEU 4 HD21 LEU 4 -41.316 -2.721 -29.692 67 HD22 LEU 4 HD22 LEU 4 -41.747 -2.458 -27.996 68 HD23 LEU 4 HD23 LEU 4 -43.022 -2.786 -29.193 69 H ASP 5 H ASP 5 -42.026 3.031 -32.506 70 HA ASP 5 HA ASP 5 -41.509 1.754 -35.159 71 HB2 ASP 5 HB2 ASP 5 -43.930 2.440 -34.912 72 HB3 ASP 5 HB3 ASP 5 -43.386 4.107 -34.733 73 H GLU 6 H GLU 6 -40.527 4.096 -32.870 74 HA GLU 6 HA GLU 6 -38.517 5.142 -34.796 75 HB2 GLU 6 HB2 GLU 6 -38.580 7.333 -33.622 76 HB3 GLU 6 HB3 GLU 6 -39.943 6.983 -34.671 77 HG2 GLU 6 HG2 GLU 6 -41.399 6.521 -32.758 78 HG3 GLU 6 HG3 GLU 6 -40.044 6.662 -31.633 79 H ILE 7 H ILE 7 -36.551 4.736 -34.199 80 HA ILE 7 HA ILE 7 -35.799 4.490 -31.316 81 HB ILE 7 HB ILE 7 -34.804 2.686 -33.547 82 HG12 ILE 7 HG12 ILE 7 -37.131 2.080 -33.040 83 HG13 ILE 7 HG13 ILE 7 -35.970 0.835 -32.641 84 HG21 ILE 7 HG21 ILE 7 -34.268 2.696 -30.545 85 HG22 ILE 7 HG22 ILE 7 -33.765 1.409 -31.664 86 HG23 ILE 7 HG23 ILE 7 -33.104 3.036 -31.838 87 HD11 ILE 7 HD11 ILE 7 -37.144 2.713 -30.556 88 HD12 ILE 7 HD12 ILE 7 -37.804 1.117 -30.961 89 HD13 ILE 7 HD13 ILE 7 -36.171 1.255 -30.276 90 H ILE 8 H ILE 8 -35.151 6.641 -31.425 91 HA ILE 8 HA ILE 8 -32.673 7.223 -33.003 92 HB ILE 8 HB ILE 8 -34.978 9.146 -32.506 93 HG12 ILE 8 HG12 ILE 8 -34.055 7.827 -35.104 94 HG13 ILE 8 HG13 ILE 8 -35.546 7.458 -34.236 95 HG21 ILE 8 HG21 ILE 8 -32.385 9.511 -34.090 96 HG22 ILE 8 HG22 ILE 8 -33.669 10.721 -33.883 97 HG23 ILE 8 HG23 ILE 8 -32.719 10.226 -32.498 98 HD11 ILE 8 HD11 ILE 8 -34.909 10.060 -35.656 99 HD12 ILE 8 HD12 ILE 8 -36.126 8.849 -36.072 100 HD13 ILE 8 HD13 ILE 8 -36.320 9.811 -34.594 101 H GLU 9 H GLU 9 -31.048 7.494 -31.656 102 HA GLU 9 HA GLU 9 -31.399 8.909 -29.051 103 HB2 GLU 9 HB2 GLU 9 -30.056 6.204 -29.450 104 HB3 GLU 9 HB3 GLU 9 -29.924 7.199 -27.997 105 HG2 GLU 9 HG2 GLU 9 -32.419 7.098 -27.740 106 HG3 GLU 9 HG3 GLU 9 -32.486 5.975 -29.103 107 H GLN 10 H GLN 10 -30.081 10.573 -29.047 108 HA GLN 10 HA GLN 10 -27.272 10.393 -29.738 109 HB2 GLN 10 HB2 GLN 10 -27.237 12.108 -31.444 110 HB3 GLN 10 HB3 GLN 10 -28.252 10.773 -31.965 111 HG2 GLN 10 HG2 GLN 10 -30.279 12.151 -31.201 112 HG3 GLN 10 HG3 GLN 10 -29.160 13.506 -30.985 113 HE21 GLN 10 HE21 GLN 10 -28.656 13.904 -34.563 114 HE22 GLN 10 HE22 GLN 10 -27.830 14.118 -33.025 115 H ILE 11 H ILE 11 -26.218 12.590 -29.377 116 HA ILE 11 HA ILE 11 -25.573 14.105 -27.893 117 HB ILE 11 HB ILE 11 -26.933 15.233 -29.594 118 HG12 ILE 11 HG12 ILE 11 -26.744 16.793 -26.993 119 HG13 ILE 11 HG13 ILE 11 -25.368 16.363 -28.012 120 HG21 ILE 11 HG21 ILE 11 -29.037 15.547 -27.418 121 HG22 ILE 11 HG22 ILE 11 -29.039 16.351 -29.002 122 HG23 ILE 11 HG23 ILE 11 -29.197 14.607 -28.907 123 HD11 ILE 11 HD11 ILE 11 -27.699 18.161 -28.789 124 HD12 ILE 11 HD12 ILE 11 -26.018 18.627 -28.499 125 HD13 ILE 11 HD13 ILE 11 -26.419 17.624 -29.907 126 H GLN 12 H GLN 12 -26.379 11.916 -26.471 127 HA GLN 12 HA GLN 12 -26.962 13.166 -23.826 128 HB2 GLN 12 HB2 GLN 12 -28.234 11.367 -23.102 129 HB3 GLN 12 HB3 GLN 12 -28.877 11.766 -24.685 130 HG2 GLN 12 HG2 GLN 12 -26.961 9.443 -24.114 131 HG3 GLN 12 HG3 GLN 12 -28.707 9.314 -24.164 132 HE21 GLN 12 HE21 GLN 12 -26.680 9.499 -27.702 133 HE22 GLN 12 HE22 GLN 12 -25.813 9.856 -26.214 134 H LYS 13 H LYS 13 -26.097 11.924 -21.981 135 HA LYS 13 HA LYS 13 -23.260 11.504 -22.339 136 HB2 LYS 13 HB2 LYS 13 -24.550 12.726 -20.445 137 HB3 LYS 13 HB3 LYS 13 -24.796 11.120 -19.757 138 HG2 LYS 13 HG2 LYS 13 -22.178 10.893 -19.959 139 HG3 LYS 13 HG3 LYS 13 -22.193 12.631 -20.236 140 HD2 LYS 13 HD2 LYS 13 -23.278 11.173 -17.783 141 HD3 LYS 13 HD3 LYS 13 -21.745 12.047 -17.879 142 HE2 LYS 13 HE2 LYS 13 -22.971 14.164 -18.319 143 HE3 LYS 13 HE3 LYS 13 -24.509 13.297 -18.216 144 HZ1 LYS 13 HZ1 LYS 13 -22.548 13.544 -15.997 145 HZ2 LYS 13 HZ2 LYS 13 -23.956 14.358 -16.105 146 HZ3 LYS 13 HZ3 LYS 13 -23.967 12.739 -15.905 147 H GLU 14 H GLU 14 -24.385 9.502 -23.772 148 HA GLU 14 HA GLU 14 -23.353 7.070 -22.426 149 HB2 GLU 14 HB2 GLU 14 -26.093 7.260 -23.738 150 HB3 GLU 14 HB3 GLU 14 -25.209 5.739 -23.557 151 HG2 GLU 14 HG2 GLU 14 -25.084 6.046 -21.135 152 HG3 GLU 14 HG3 GLU 14 -25.988 7.563 -21.258 153 H ALA 15 H ALA 15 -22.011 6.013 -23.653 154 HA ALA 15 HA ALA 15 -22.406 5.678 -26.492 155 HB1 ALA 15 HB1 ALA 15 -19.942 7.205 -25.528 156 HB2 ALA 15 HB2 ALA 15 -20.138 6.514 -27.158 157 HB3 ALA 15 HB3 ALA 15 -21.216 7.808 -26.605 158 H ILE 16 H ILE 16 -19.442 5.481 -24.572 159 HA ILE 16 HA ILE 16 -19.398 2.516 -24.868 160 HB ILE 16 HB ILE 16 -17.343 4.679 -25.309 161 HG12 ILE 16 HG12 ILE 16 -18.181 2.343 -27.080 162 HG13 ILE 16 HG13 ILE 16 -18.846 3.969 -27.183 163 HG21 ILE 16 HG21 ILE 16 -16.662 1.712 -25.071 164 HG22 ILE 16 HG22 ILE 16 -15.554 2.978 -25.643 165 HG23 ILE 16 HG23 ILE 16 -16.112 3.012 -23.987 166 HD11 ILE 16 HD11 ILE 16 -15.992 3.168 -27.821 167 HD12 ILE 16 HD12 ILE 16 -17.240 3.768 -28.918 168 HD13 ILE 16 HD13 ILE 16 -16.555 4.854 -27.695 169 H ASN 17 H ASN 17 -19.624 4.790 -22.618 170 HA ASN 17 HA ASN 17 -17.765 3.802 -20.697 171 HB2 ASN 17 HB2 ASN 17 -20.211 5.580 -20.277 172 HB3 ASN 17 HB3 ASN 17 -18.924 5.340 -19.100 173 HD21 ASN 17 HD21 ASN 17 -18.396 8.155 -21.875 174 HD22 ASN 17 HD22 ASN 17 -19.954 7.430 -21.514 175 H SER 18 H SER 18 -20.817 2.575 -21.574 176 HA SER 18 HA SER 18 -21.360 1.169 -19.045 177 HB2 SER 18 HB2 SER 18 -23.180 1.928 -20.524 178 HB3 SER 18 HB3 SER 18 -22.613 0.825 -21.792 179 HG SER 18 HG SER 18 -24.318 -0.060 -20.493 180 H ASN 19 H ASN 19 -20.196 0.182 -22.321 181 HA ASN 19 HA ASN 19 -19.883 -2.565 -21.418 182 HB2 ASN 19 HB2 ASN 19 -19.321 -3.084 -23.693 183 HB3 ASN 19 HB3 ASN 19 -20.710 -2.012 -23.678 184 HD21 ASN 19 HD21 ASN 19 -19.075 0.333 -25.750 185 HD22 ASN 19 HD22 ASN 19 -20.582 -0.211 -25.031 186 H VAL 20 H VAL 20 -17.785 0.109 -21.415 187 HA VAL 20 HA VAL 20 -15.310 -1.437 -21.494 188 HB VAL 20 HB VAL 20 -15.622 0.917 -22.335 189 HG11 VAL 20 HG11 VAL 20 -15.131 1.741 -19.449 190 HG12 VAL 20 HG12 VAL 20 -15.364 2.785 -20.862 191 HG13 VAL 20 HG13 VAL 20 -16.716 1.820 -20.245 192 HG21 VAL 20 HG21 VAL 20 -13.413 -0.145 -22.135 193 HG22 VAL 20 HG22 VAL 20 -13.356 1.602 -21.849 194 HG23 VAL 20 HG23 VAL 20 -13.260 0.480 -20.477 195 H VAL 21 H VAL 21 -17.532 -0.651 -18.987 196 HA VAL 21 HA VAL 21 -15.587 -1.488 -16.876 197 HB VAL 21 HB VAL 21 -18.143 0.054 -16.351 198 HG11 VAL 21 HG11 VAL 21 -15.609 -0.425 -14.698 199 HG12 VAL 21 HG12 VAL 21 -17.030 0.512 -14.190 200 HG13 VAL 21 HG13 VAL 21 -17.169 -1.230 -14.427 201 HG21 VAL 21 HG21 VAL 21 -16.749 1.547 -17.659 202 HG22 VAL 21 HG22 VAL 21 -16.643 2.022 -15.969 203 HG23 VAL 21 HG23 VAL 21 -15.306 1.112 -16.710 204 H LEU 22 H LEU 22 -16.071 -3.583 -17.999 205 HA LEU 22 HA LEU 22 -18.276 -4.992 -16.550 206 HB2 LEU 22 HB2 LEU 22 -17.335 -5.216 -19.408 207 HB3 LEU 22 HB3 LEU 22 -17.949 -6.655 -18.596 208 HG LEU 22 HG LEU 22 -19.525 -4.055 -18.829 209 HD11 LEU 22 HD11 LEU 22 -19.743 -6.637 -20.437 210 HD12 LEU 22 HD12 LEU 22 -20.814 -5.222 -20.568 211 HD13 LEU 22 HD13 LEU 22 -19.112 -5.091 -21.040 212 HD21 LEU 22 HD21 LEU 22 -20.313 -5.440 -16.947 213 HD22 LEU 22 HD22 LEU 22 -21.458 -5.565 -18.278 214 HD23 LEU 22 HD23 LEU 22 -20.311 -6.889 -17.976 215 H LYS 23 H LYS 23 -17.468 -5.978 -14.946 216 HA LYS 23 HA LYS 23 -14.851 -7.431 -15.071 217 HB2 LYS 23 HB2 LYS 23 -15.801 -5.494 -12.916 218 HB3 LYS 23 HB3 LYS 23 -14.318 -6.460 -12.852 219 HG2 LYS 23 HG2 LYS 23 -13.442 -5.311 -14.850 220 HG3 LYS 23 HG3 LYS 23 -14.920 -4.340 -14.960 221 HD2 LYS 23 HD2 LYS 23 -14.464 -3.352 -12.744 222 HD3 LYS 23 HD3 LYS 23 -12.941 -4.271 -12.652 223 HE2 LYS 23 HE2 LYS 23 -12.116 -3.166 -14.692 224 HE3 LYS 23 HE3 LYS 23 -13.661 -2.340 -14.909 225 HZ1 LYS 23 HZ1 LYS 23 -11.809 -1.896 -12.630 226 HZ2 LYS 23 HZ2 LYS 23 -12.032 -0.877 -13.880 227 HZ3 LYS 23 HZ3 LYS 23 -13.247 -1.142 -12.824 228 H ASN 24 H ASN 24 -17.119 -8.776 -15.462 229 HA ASN 24 HA ASN 24 -18.566 -10.386 -14.817 230 HB2 ASN 24 HB2 ASN 24 -16.216 -11.341 -14.616 231 HB3 ASN 24 HB3 ASN 24 -16.397 -11.193 -12.864 232 HD21 ASN 24 HD21 ASN 24 -18.674 -13.926 -12.629 233 HD22 ASN 24 HD22 ASN 24 -18.204 -12.389 -11.881 234 HA PRO 25 HA PRO 25 -19.793 -8.094 -10.942 235 HB2 PRO 25 HB2 PRO 25 -21.695 -6.375 -11.769 236 HB3 PRO 25 HB3 PRO 25 -19.977 -6.144 -12.199 237 HG2 PRO 25 HG2 PRO 25 -22.123 -7.491 -13.891 238 HG3 PRO 25 HG3 PRO 25 -21.038 -6.143 -14.364 239 HD2 PRO 25 HD2 PRO 25 -20.440 -8.759 -14.913 240 HD3 PRO 25 HD3 PRO 25 -19.188 -7.548 -14.513 241 H ARG 26 H ARG 26 -20.415 -10.568 -10.969 242 HA ARG 26 HA ARG 26 -23.249 -10.715 -10.051 243 HB2 ARG 26 HB2 ARG 26 -23.771 -12.660 -11.321 244 HB3 ARG 26 HB3 ARG 26 -23.168 -11.410 -12.387 245 HG2 ARG 26 HG2 ARG 26 -21.957 -13.044 -13.307 246 HG3 ARG 26 HG3 ARG 26 -20.834 -12.760 -11.981 247 HD2 ARG 26 HD2 ARG 26 -21.823 -14.614 -10.702 248 HD3 ARG 26 HD3 ARG 26 -23.085 -14.830 -11.910 249 HE ARG 26 HE ARG 26 -20.377 -15.852 -11.981 250 HH11 ARG 26 HH11 ARG 26 -19.689 -17.113 -13.677 251 HH12 ARG 26 HH12 ARG 26 -20.629 -17.188 -15.137 252 HH21 ARG 26 HH21 ARG 26 -23.046 -15.001 -14.097 253 HH22 ARG 26 HH22 ARG 26 -22.470 -16.032 -15.376 254 H VAL 27 H VAL 27 -20.455 -10.808 -8.795 255 HA VAL 27 HA VAL 27 -20.916 -13.193 -7.050 256 HB VAL 27 HB VAL 27 -18.239 -12.014 -7.832 257 HG11 VAL 27 HG11 VAL 27 -18.974 -14.305 -5.941 258 HG12 VAL 27 HG12 VAL 27 -17.328 -13.889 -6.469 259 HG13 VAL 27 HG13 VAL 27 -18.241 -12.759 -5.469 260 HG21 VAL 27 HG21 VAL 27 -19.193 -13.437 -9.603 261 HG22 VAL 27 HG22 VAL 27 -17.854 -14.263 -8.798 262 HG23 VAL 27 HG23 VAL 27 -19.530 -14.717 -8.416 263 HA PRO 28 HA PRO 28 -20.979 -9.749 -4.035 264 HB2 PRO 28 HB2 PRO 28 -22.752 -10.835 -2.285 265 HB3 PRO 28 HB3 PRO 28 -23.261 -10.006 -3.789 266 HG2 PRO 28 HG2 PRO 28 -22.978 -12.977 -3.304 267 HG3 PRO 28 HG3 PRO 28 -24.308 -12.102 -4.137 268 HD2 PRO 28 HD2 PRO 28 -22.240 -13.370 -5.422 269 HD3 PRO 28 HD3 PRO 28 -23.100 -11.954 -6.101 270 H THR 29 H THR 29 -19.073 -9.826 -3.123 271 HA THR 29 HA THR 29 -18.386 -11.932 -1.158 272 HB THR 29 HB THR 29 -17.496 -12.705 -3.263 273 HG1 THR 29 HG1 THR 29 -15.407 -13.050 -2.551 274 HG21 THR 29 HG21 THR 29 -15.705 -10.243 -3.347 275 HG22 THR 29 HG22 THR 29 -15.658 -11.643 -4.434 276 HG23 THR 29 HG23 THR 29 -17.064 -10.574 -4.441 277 H GLN 30 H GLN 30 -19.332 -9.813 -0.251 278 HA GLN 30 HA GLN 30 -17.241 -7.802 0.213 279 HB2 GLN 30 HB2 GLN 30 -20.243 -7.789 0.631 280 HB3 GLN 30 HB3 GLN 30 -19.215 -6.424 1.080 281 HG2 GLN 30 HG2 GLN 30 -18.685 -5.859 -1.107 282 HG3 GLN 30 HG3 GLN 30 -18.995 -7.468 -1.744 283 HE21 GLN 30 HE21 GLN 30 -22.511 -6.999 -2.157 284 HE22 GLN 30 HE22 GLN 30 -21.268 -8.218 -1.919 285 H LYS 31 H LYS 31 -17.316 -10.378 1.612 286 HA LYS 31 HA LYS 31 -17.555 -9.665 4.465 287 HB2 LYS 31 HB2 LYS 31 -18.269 -11.827 3.076 288 HB3 LYS 31 HB3 LYS 31 -16.658 -12.369 3.469 289 HG2 LYS 31 HG2 LYS 31 -18.819 -11.517 5.475 290 HG3 LYS 31 HG3 LYS 31 -18.507 -13.158 4.951 291 HD2 LYS 31 HD2 LYS 31 -17.423 -13.201 6.952 292 HD3 LYS 31 HD3 LYS 31 -16.099 -12.823 5.870 293 HE2 LYS 31 HE2 LYS 31 -15.819 -11.410 7.743 294 HE3 LYS 31 HE3 LYS 31 -16.448 -10.354 6.482 295 HZ1 LYS 31 HZ1 LYS 31 -18.059 -11.561 8.673 296 HZ2 LYS 31 HZ2 LYS 31 -17.586 -10.005 8.605 297 HZ3 LYS 31 HZ3 LYS 31 -18.663 -10.574 7.520 298 H THR 32 H THR 32 -15.558 -8.241 3.079 299 HA THR 32 HA THR 32 -13.117 -8.926 4.567 300 HB THR 32 HB THR 32 -12.829 -10.348 2.679 301 HG1 THR 32 HG1 THR 32 -10.956 -8.954 1.755 302 HG21 THR 32 HG21 THR 32 -13.244 -7.913 0.915 303 HG22 THR 32 HG22 THR 32 -12.585 -9.475 0.372 304 HG23 THR 32 HG23 THR 32 -14.237 -9.364 1.000 305 H GLY 33 H GLY 33 -14.272 -7.002 5.398 306 HA2 GLY 33 HA2 GLY 33 -14.192 -4.432 4.220 307 HA3 GLY 33 HA3 GLY 33 -14.184 -4.764 5.954 308 H GLU 34 H GLU 34 -11.455 -6.266 5.309 309 HA GLU 34 HA GLU 34 -9.699 -3.956 5.782 310 HB2 GLU 34 HB2 GLU 34 -9.118 -6.927 5.530 311 HB3 GLU 34 HB3 GLU 34 -7.908 -5.683 5.877 312 HG2 GLU 34 HG2 GLU 34 -9.164 -5.029 7.923 313 HG3 GLU 34 HG3 GLU 34 -10.338 -6.310 7.612 314 H LEU 35 H LEU 35 -9.844 -6.484 3.253 315 HA LEU 35 HA LEU 35 -9.027 -4.548 1.194 316 HB2 LEU 35 HB2 LEU 35 -7.263 -6.831 2.113 317 HB3 LEU 35 HB3 LEU 35 -7.333 -6.436 0.415 318 HG LEU 35 HG LEU 35 -6.990 -3.915 1.609 319 HD11 LEU 35 HD11 LEU 35 -5.109 -5.934 2.899 320 HD12 LEU 35 HD12 LEU 35 -4.984 -4.163 2.997 321 HD13 LEU 35 HD13 LEU 35 -6.357 -4.993 3.745 322 HD21 LEU 35 HD21 LEU 35 -6.025 -4.653 -0.509 323 HD22 LEU 35 HD22 LEU 35 -4.760 -4.031 0.564 324 HD23 LEU 35 HD23 LEU 35 -4.963 -5.784 0.342 325 H SER 36 H SER 36 -10.507 -4.719 -0.230 326 HA SER 36 HA SER 36 -11.841 -7.315 -0.860 327 HB2 SER 36 HB2 SER 36 -13.289 -5.555 0.036 328 HB3 SER 36 HB3 SER 36 -12.808 -4.488 -1.293 329 HG SER 36 HG SER 36 -14.775 -5.620 -1.721 330 H GLU 37 H GLU 37 -11.195 -4.412 -2.729 331 HA GLU 37 HA GLU 37 -9.756 -5.925 -4.763 332 HB2 GLU 37 HB2 GLU 37 -12.527 -6.130 -4.841 333 HB3 GLU 37 HB3 GLU 37 -12.257 -4.715 -5.876 334 HG2 GLU 37 HG2 GLU 37 -10.387 -6.134 -6.981 335 HG3 GLU 37 HG3 GLU 37 -11.071 -7.500 -6.093 336 H GLU 38 H GLU 38 -11.670 -3.006 -4.084 337 HA GLU 38 HA GLU 38 -10.285 -1.150 -5.730 338 HB2 GLU 38 HB2 GLU 38 -12.454 -0.830 -4.430 339 HB3 GLU 38 HB3 GLU 38 -11.487 -0.705 -2.963 340 HG2 GLU 38 HG2 GLU 38 -11.960 1.502 -3.579 341 HG3 GLU 38 HG3 GLU 38 -10.285 1.274 -4.056 342 H GLN 39 H GLN 39 -9.544 -2.439 -2.495 343 HA GLN 39 HA GLN 39 -7.388 -0.648 -1.858 344 HB2 GLN 39 HB2 GLN 39 -8.018 -3.425 -0.791 345 HB3 GLN 39 HB3 GLN 39 -6.896 -2.258 -0.095 346 HG2 GLN 39 HG2 GLN 39 -8.833 -2.016 1.206 347 HG3 GLN 39 HG3 GLN 39 -8.850 -0.630 0.126 348 HE21 GLN 39 HE21 GLN 39 -12.302 -1.681 -0.139 349 HE22 GLN 39 HE22 GLN 39 -11.239 -0.654 0.825 350 H LYS 40 H LYS 40 -7.449 -3.805 -3.501 351 HA LYS 40 HA LYS 40 -4.537 -3.973 -3.869 352 HB2 LYS 40 HB2 LYS 40 -6.936 -5.339 -5.134 353 HB3 LYS 40 HB3 LYS 40 -5.300 -5.632 -5.722 354 HG2 LYS 40 HG2 LYS 40 -4.636 -6.802 -3.922 355 HG3 LYS 40 HG3 LYS 40 -5.518 -5.823 -2.773 356 HD2 LYS 40 HD2 LYS 40 -7.449 -7.318 -4.376 357 HD3 LYS 40 HD3 LYS 40 -6.210 -8.421 -3.753 358 HE2 LYS 40 HE2 LYS 40 -6.542 -7.459 -1.470 359 HE3 LYS 40 HE3 LYS 40 -7.824 -6.418 -2.113 360 HZ1 LYS 40 HZ1 LYS 40 -7.909 -9.397 -2.151 361 HZ2 LYS 40 HZ2 LYS 40 -8.694 -8.463 -1.057 362 HZ3 LYS 40 HZ3 LYS 40 -9.119 -8.389 -2.626 363 H LYS 41 H LYS 41 -7.223 -2.716 -5.800 364 HA LYS 41 HA LYS 41 -5.575 -1.716 -7.964 365 HB2 LYS 41 HB2 LYS 41 -8.293 -0.713 -7.046 366 HB3 LYS 41 HB3 LYS 41 -7.513 -0.314 -8.574 367 HG2 LYS 41 HG2 LYS 41 -7.575 -2.651 -9.289 368 HG3 LYS 41 HG3 LYS 41 -8.237 -3.139 -7.732 369 HD2 LYS 41 HD2 LYS 41 -10.167 -1.448 -8.266 370 HD3 LYS 41 HD3 LYS 41 -9.601 -1.575 -9.934 371 HE2 LYS 41 HE2 LYS 41 -10.522 -3.849 -8.105 372 HE3 LYS 41 HE3 LYS 41 -11.471 -3.131 -9.405 373 HZ1 LYS 41 HZ1 LYS 41 -8.957 -4.672 -9.767 374 HZ2 LYS 41 HZ2 LYS 41 -10.470 -5.188 -10.102 375 HZ3 LYS 41 HZ3 LYS 41 -9.800 -3.979 -10.986 376 H ILE 42 H ILE 42 -5.505 -0.711 -4.786 377 HA ILE 42 HA ILE 42 -4.043 1.772 -5.595 378 HB ILE 42 HB ILE 42 -5.019 0.900 -2.870 379 HG12 ILE 42 HG12 ILE 42 -5.851 3.548 -3.938 380 HG13 ILE 42 HG13 ILE 42 -6.444 2.221 -4.912 381 HG21 ILE 42 HG21 ILE 42 -3.406 3.369 -3.658 382 HG22 ILE 42 HG22 ILE 42 -4.188 3.133 -2.086 383 HG23 ILE 42 HG23 ILE 42 -2.885 2.059 -2.576 384 HD11 ILE 42 HD11 ILE 42 -6.835 2.380 -1.898 385 HD12 ILE 42 HD12 ILE 42 -8.049 2.796 -3.144 386 HD13 ILE 42 HD13 ILE 42 -7.452 1.144 -2.985 387 H VAL 43 H VAL 43 -3.608 -1.032 -3.298 388 HA VAL 43 HA VAL 43 -0.812 -0.405 -3.083 389 HB VAL 43 HB VAL 43 -2.178 -2.963 -2.169 390 HG11 VAL 43 HG11 VAL 43 0.417 -1.577 -1.323 391 HG12 VAL 43 HG12 VAL 43 -0.304 -2.979 -0.505 392 HG13 VAL 43 HG13 VAL 43 0.289 -3.138 -2.155 393 HG21 VAL 43 HG21 VAL 43 -3.323 -1.039 -1.182 394 HG22 VAL 43 HG22 VAL 43 -2.305 -1.788 0.042 395 HG23 VAL 43 HG23 VAL 43 -1.769 -0.299 -0.760 396 H ALA 44 H ALA 44 -2.380 -3.240 -4.707 397 HA ALA 44 HA ALA 44 0.145 -4.295 -5.656 398 HB1 ALA 44 HB1 ALA 44 -2.681 -4.789 -6.695 399 HB2 ALA 44 HB2 ALA 44 -1.245 -5.783 -6.994 400 HB3 ALA 44 HB3 ALA 44 -1.911 -5.671 -5.353 401 H ASP 45 H ASP 45 -2.294 -2.076 -6.966 402 HA ASP 45 HA ASP 45 -1.088 -1.597 -9.522 403 HB2 ASP 45 HB2 ASP 45 -3.365 -0.890 -8.823 404 HB3 ASP 45 HB3 ASP 45 -2.647 0.333 -7.773 405 H TYR 46 H TYR 46 -0.287 -0.157 -6.319 406 HA TYR 46 HA TYR 46 1.632 1.714 -7.342 407 HB2 TYR 46 HB2 TYR 46 0.445 1.329 -4.926 408 HB3 TYR 46 HB3 TYR 46 1.983 0.588 -4.584 409 HD1 TYR 46 HD1 TYR 46 0.567 3.146 -3.457 410 HD2 TYR 46 HD2 TYR 46 3.695 2.525 -6.344 411 HE1 TYR 46 HE1 TYR 46 1.453 5.419 -2.977 412 HE2 TYR 46 HE2 TYR 46 4.489 4.809 -6.023 413 HH TYR 46 HH TYR 46 2.969 7.050 -3.626 414 H ILE 47 H ILE 47 1.935 -1.637 -6.139 415 HA ILE 47 HA ILE 47 4.776 -1.909 -6.453 416 HB ILE 47 HB ILE 47 2.412 -3.740 -6.218 417 HG12 ILE 47 HG12 ILE 47 3.457 -4.536 -4.261 418 HG13 ILE 47 HG13 ILE 47 5.042 -3.953 -4.741 419 HG21 ILE 47 HG21 ILE 47 5.172 -4.730 -6.983 420 HG22 ILE 47 HG22 ILE 47 3.850 -5.742 -6.366 421 HG23 ILE 47 HG23 ILE 47 3.671 -4.931 -7.929 422 HD11 ILE 47 HD11 ILE 47 2.737 -2.195 -3.819 423 HD12 ILE 47 HD12 ILE 47 4.189 -2.632 -2.900 424 HD13 ILE 47 HD13 ILE 47 4.332 -1.621 -4.343 425 H SER 48 H SER 48 2.158 -2.091 -8.835 426 HA SER 48 HA SER 48 3.909 -2.795 -11.051 427 HB2 SER 48 HB2 SER 48 1.142 -1.546 -11.039 428 HB3 SER 48 HB3 SER 48 1.997 -2.132 -12.470 429 HG SER 48 HG SER 48 0.565 -3.716 -11.623 430 H GLU 49 H GLU 49 3.619 0.233 -9.348 431 HA GLU 49 HA GLU 49 4.187 1.811 -11.803 432 HB2 GLU 49 HB2 GLU 49 2.229 2.319 -10.306 433 HB3 GLU 49 HB3 GLU 49 3.369 2.683 -9.013 434 HG2 GLU 49 HG2 GLU 49 2.669 4.733 -9.983 435 HG3 GLU 49 HG3 GLU 49 4.352 4.490 -10.431 436 H VAL 50 H VAL 50 5.525 1.165 -8.539 437 HA VAL 50 HA VAL 50 8.007 2.648 -9.336 438 HB VAL 50 HB VAL 50 6.248 3.676 -7.706 439 HG11 VAL 50 HG11 VAL 50 7.709 1.958 -5.704 440 HG12 VAL 50 HG12 VAL 50 6.548 3.270 -5.415 441 HG13 VAL 50 HG13 VAL 50 6.019 1.783 -6.218 442 HG21 VAL 50 HG21 VAL 50 8.198 4.849 -8.239 443 HG22 VAL 50 HG22 VAL 50 8.074 4.843 -6.473 444 HG23 VAL 50 HG23 VAL 50 9.232 3.772 -7.305 445 H GLY 51 H GLY 51 6.896 -0.341 -7.995 446 HA2 GLY 51 HA2 GLY 51 8.805 -2.007 -8.562 447 HA3 GLY 51 HA3 GLY 51 9.694 -1.158 -7.290 448 H LEU 52 H LEU 52 8.907 -1.139 -5.218 449 HA LEU 52 HA LEU 52 6.814 -2.842 -4.202 450 HB2 LEU 52 HB2 LEU 52 8.439 -4.574 -4.948 451 HB3 LEU 52 HB3 LEU 52 9.715 -3.844 -3.997 452 HG LEU 52 HG LEU 52 7.261 -4.492 -2.466 453 HD11 LEU 52 HD11 LEU 52 8.969 -6.705 -3.697 454 HD12 LEU 52 HD12 LEU 52 7.764 -6.954 -2.424 455 HD13 LEU 52 HD13 LEU 52 7.246 -6.401 -4.022 456 HD21 LEU 52 HD21 LEU 52 9.319 -3.816 -1.315 457 HD22 LEU 52 HD22 LEU 52 8.868 -5.458 -0.868 458 HD23 LEU 52 HD23 LEU 52 10.189 -5.200 -2.024 459 H ASN 53 H ASN 53 9.931 -1.465 -3.586 460 HA ASN 53 HA ASN 53 9.248 -0.705 -0.826 461 HB2 ASN 53 HB2 ASN 53 11.553 -0.921 -0.367 462 HB3 ASN 53 HB3 ASN 53 11.134 -2.271 -1.417 463 HD21 ASN 53 HD21 ASN 53 13.415 -1.308 -3.941 464 HD22 ASN 53 HD22 ASN 53 12.195 -2.464 -3.441 465 H ASN 54 H ASN 54 9.316 1.034 -3.741 466 HA ASN 54 HA ASN 54 10.621 3.410 -2.527 467 HB2 ASN 54 HB2 ASN 54 9.659 2.922 -5.349 468 HB3 ASN 54 HB3 ASN 54 10.630 4.285 -4.810 469 HD21 ASN 54 HD21 ASN 54 12.447 0.892 -5.917 470 HD22 ASN 54 HD22 ASN 54 10.782 1.291 -6.318 471 H LEU 55 H LEU 55 7.452 2.211 -3.023 472 HA LEU 55 HA LEU 55 5.988 4.594 -3.423 473 HB2 LEU 55 HB2 LEU 55 4.064 3.264 -2.918 474 HB3 LEU 55 HB3 LEU 55 5.179 2.345 -3.890 475 HG LEU 55 HG LEU 55 5.906 1.538 -1.322 476 HD11 LEU 55 HD11 LEU 55 2.882 1.961 -1.453 477 HD12 LEU 55 HD12 LEU 55 3.717 0.961 -0.266 478 HD13 LEU 55 HD13 LEU 55 3.996 2.710 -0.283 479 HD21 LEU 55 HD21 LEU 55 5.526 0.096 -3.303 480 HD22 LEU 55 HD22 LEU 55 4.696 -0.518 -1.871 481 HD23 LEU 55 HD23 LEU 55 3.777 0.330 -3.133 482 H ASN 56 H ASN 56 4.384 5.573 -2.045 483 HA ASN 56 HA ASN 56 5.523 6.252 0.613 484 HB2 ASN 56 HB2 ASN 56 5.329 8.025 -1.097 485 HB3 ASN 56 HB3 ASN 56 3.585 7.761 -1.175 486 HD21 ASN 56 HD21 ASN 56 3.997 10.628 1.048 487 HD22 ASN 56 HD22 ASN 56 4.102 10.252 -0.667 488 H ALA 57 H ALA 57 4.579 5.576 2.380 489 HA ALA 57 HA ALA 57 2.157 4.028 2.441 490 HB1 ALA 57 HB1 ALA 57 3.884 5.229 4.646 491 HB2 ALA 57 HB2 ALA 57 2.678 3.943 4.858 492 HB3 ALA 57 HB3 ALA 57 4.125 3.643 3.881 493 H THR 58 H THR 58 2.748 7.488 2.838 494 HA THR 58 HA THR 58 0.342 8.151 4.260 495 HB THR 58 HB THR 58 1.991 9.805 2.317 496 HG1 THR 58 HG1 THR 58 2.925 10.562 4.216 497 HG21 THR 58 HG21 THR 58 -0.095 10.638 4.378 498 HG22 THR 58 HG22 THR 58 1.042 11.752 3.577 499 HG23 THR 58 HG23 THR 58 -0.156 10.882 2.616 500 H GLU 59 H GLU 59 1.011 7.861 0.735 501 HA GLU 59 HA GLU 59 -1.600 8.604 -0.177 502 HB2 GLU 59 HB2 GLU 59 0.402 6.672 -1.403 503 HB3 GLU 59 HB3 GLU 59 -0.979 7.376 -2.239 504 HG2 GLU 59 HG2 GLU 59 1.400 8.930 -1.121 505 HG3 GLU 59 HG3 GLU 59 1.161 8.485 -2.802 506 H LEU 60 H LEU 60 -0.271 5.351 0.615 507 HA LEU 60 HA LEU 60 -2.692 3.881 0.338 508 HB2 LEU 60 HB2 LEU 60 -0.213 3.541 2.050 509 HB3 LEU 60 HB3 LEU 60 -1.619 2.523 2.330 510 HG LEU 60 HG LEU 60 -1.584 1.784 -0.030 511 HD11 LEU 60 HD11 LEU 60 1.083 3.244 -0.152 512 HD12 LEU 60 HD12 LEU 60 0.488 2.065 -1.343 513 HD13 LEU 60 HD13 LEU 60 -0.364 3.596 -1.130 514 HD21 LEU 60 HD21 LEU 60 -0.556 0.441 1.745 515 HD22 LEU 60 HD22 LEU 60 0.417 0.314 0.270 516 HD23 LEU 60 HD23 LEU 60 0.955 1.362 1.597 517 H SER 61 H SER 61 -1.531 5.678 3.246 518 HA SER 61 HA SER 61 -3.707 5.007 4.922 519 HB2 SER 61 HB2 SER 61 -2.904 6.589 6.411 520 HB3 SER 61 HB3 SER 61 -1.464 6.109 5.517 521 HG SER 61 HG SER 61 -1.958 8.060 4.170 522 H LYS 62 H LYS 62 -3.551 7.296 2.346 523 HA LYS 62 HA LYS 62 -5.971 8.829 3.111 524 HB2 LYS 62 HB2 LYS 62 -4.044 8.894 0.753 525 HB3 LYS 62 HB3 LYS 62 -5.493 9.892 0.817 526 HG2 LYS 62 HG2 LYS 62 -4.745 11.132 2.669 527 HG3 LYS 62 HG3 LYS 62 -3.466 9.984 3.079 528 HD2 LYS 62 HD2 LYS 62 -2.170 10.539 1.131 529 HD3 LYS 62 HD3 LYS 62 -3.473 11.520 0.442 530 HE2 LYS 62 HE2 LYS 62 -2.064 12.153 3.075 531 HE3 LYS 62 HE3 LYS 62 -1.568 12.807 1.509 532 HZ1 LYS 62 HZ1 LYS 62 -4.219 13.266 2.772 533 HZ2 LYS 62 HZ2 LYS 62 -3.015 14.358 2.660 534 HZ3 LYS 62 HZ3 LYS 62 -3.766 13.841 1.309 535 H ARG 63 H ARG 63 -5.045 6.384 0.729 536 HA ARG 63 HA ARG 63 -7.736 6.329 -0.485 537 HB2 ARG 63 HB2 ARG 63 -5.080 4.975 -1.055 538 HB3 ARG 63 HB3 ARG 63 -6.553 4.575 -1.930 539 HG2 ARG 63 HG2 ARG 63 -5.421 7.392 -1.852 540 HG3 ARG 63 HG3 ARG 63 -5.044 6.190 -3.093 541 HD2 ARG 63 HD2 ARG 63 -7.521 5.955 -3.541 542 HD3 ARG 63 HD3 ARG 63 -7.807 7.326 -2.476 543 HE ARG 63 HE ARG 63 -6.516 7.322 -5.151 544 HH11 ARG 63 HH11 ARG 63 -6.397 9.215 -6.275 545 HH12 ARG 63 HH12 ARG 63 -6.752 10.724 -5.487 546 HH21 ARG 63 HH21 ARG 63 -7.456 9.332 -2.434 547 HH22 ARG 63 HH22 ARG 63 -7.340 10.795 -3.373 548 H LEU 64 H LEU 64 -5.865 4.135 1.617 549 HA LEU 64 HA LEU 64 -8.137 2.214 1.637 550 HB2 LEU 64 HB2 LEU 64 -5.362 2.052 2.883 551 HB3 LEU 64 HB3 LEU 64 -6.649 0.896 3.146 552 HG LEU 64 HG LEU 64 -6.715 0.636 0.548 553 HD11 LEU 64 HD11 LEU 64 -3.878 1.680 0.954 554 HD12 LEU 64 HD12 LEU 64 -4.504 0.898 -0.513 555 HD13 LEU 64 HD13 LEU 64 -5.140 2.467 -0.019 556 HD21 LEU 64 HD21 LEU 64 -6.039 -1.122 2.109 557 HD22 LEU 64 HD22 LEU 64 -4.964 -1.110 0.702 558 HD23 LEU 64 HD23 LEU 64 -4.411 -0.415 2.242 559 H ASN 65 H ASN 65 -7.094 4.933 3.462 560 HA ASN 65 HA ASN 65 -7.817 5.898 5.364 561 HB2 ASN 65 HB2 ASN 65 -9.995 5.812 4.307 562 HB3 ASN 65 HB3 ASN 65 -10.295 4.196 4.956 563 HD21 ASN 65 HD21 ASN 65 -10.329 7.320 7.645 564 HD22 ASN 65 HD22 ASN 65 -9.224 7.406 6.283 565 H ILE 66 H ILE 66 -5.929 4.762 6.091 566 HA ILE 66 HA ILE 66 -6.430 3.103 8.507 567 HB ILE 66 HB ILE 66 -4.233 1.895 7.942 568 HG12 ILE 66 HG12 ILE 66 -4.860 2.891 5.132 569 HG13 ILE 66 HG13 ILE 66 -3.447 3.283 6.131 570 HG21 ILE 66 HG21 ILE 66 -6.662 1.231 6.271 571 HG22 ILE 66 HG22 ILE 66 -5.378 0.121 6.840 572 HG23 ILE 66 HG23 ILE 66 -6.450 0.885 8.009 573 HD11 ILE 66 HD11 ILE 66 -4.116 0.559 4.965 574 HD12 ILE 66 HD12 ILE 66 -2.868 1.687 4.425 575 HD13 ILE 66 HD13 ILE 66 -2.731 0.924 6.032 576 H THR 67 H THR 67 -4.679 3.084 10.004 577 HA THR 67 HA THR 67 -3.266 5.509 10.579 578 HB THR 67 HB THR 67 -2.934 2.590 11.378 579 HG1 THR 67 HG1 THR 67 -3.912 3.350 13.277 580 HG21 THR 67 HG21 THR 67 -1.537 5.035 12.510 581 HG22 THR 67 HG22 THR 67 -1.660 3.460 13.344 582 HG23 THR 67 HG23 THR 67 -0.809 3.562 11.808 583 H VAL 68 H VAL 68 -1.300 6.235 9.795 584 HA VAL 68 HA VAL 68 -0.188 5.194 7.414 585 HB VAL 68 HB VAL 68 1.320 6.887 9.444 586 HG11 VAL 68 HG11 VAL 68 1.541 6.650 6.406 587 HG12 VAL 68 HG12 VAL 68 2.441 7.801 7.415 588 HG13 VAL 68 HG13 VAL 68 2.733 6.071 7.590 589 HG21 VAL 68 HG21 VAL 68 -0.844 7.992 8.983 590 HG22 VAL 68 HG22 VAL 68 0.482 8.863 8.218 591 HG23 VAL 68 HG23 VAL 68 -0.561 7.819 7.237 592 H ASP 69 H ASP 69 0.670 4.481 10.766 593 HA ASP 69 HA ASP 69 3.034 2.960 10.097 594 HB2 ASP 69 HB2 ASP 69 2.631 4.049 12.306 595 HB3 ASP 69 HB3 ASP 69 1.342 2.886 12.624 596 H LYS 70 H LYS 70 -0.380 2.089 10.205 597 HA LYS 70 HA LYS 70 0.147 -0.795 10.033 598 HB2 LYS 70 HB2 LYS 70 -2.351 0.876 9.502 599 HB3 LYS 70 HB3 LYS 70 -2.255 -0.860 9.207 600 HG2 LYS 70 HG2 LYS 70 -1.641 -1.251 11.577 601 HG3 LYS 70 HG3 LYS 70 -1.816 0.482 11.909 602 HD2 LYS 70 HD2 LYS 70 -4.200 0.385 11.272 603 HD3 LYS 70 HD3 LYS 70 -4.029 -1.327 10.826 604 HE2 LYS 70 HE2 LYS 70 -3.388 -1.872 13.162 605 HE3 LYS 70 HE3 LYS 70 -3.583 -0.174 13.617 606 HZ1 LYS 70 HZ1 LYS 70 -5.758 -1.921 12.580 607 HZ2 LYS 70 HZ2 LYS 70 -5.569 -1.482 14.138 608 HZ3 LYS 70 HZ3 LYS 70 -5.942 -0.356 13.020 609 H ALA 71 H ALA 71 -0.169 1.896 7.756 610 HA ALA 71 HA ALA 71 -0.129 0.197 5.371 611 HB1 ALA 71 HB1 ALA 71 0.689 3.128 5.693 612 HB2 ALA 71 HB2 ALA 71 0.332 2.282 4.179 613 HB3 ALA 71 HB3 ALA 71 -0.950 2.574 5.371 614 H LYS 72 H LYS 72 2.389 2.030 7.115 615 HA LYS 72 HA LYS 72 4.650 1.332 5.562 616 HB2 LYS 72 HB2 LYS 72 4.332 1.965 8.514 617 HB3 LYS 72 HB3 LYS 72 5.911 1.714 7.756 618 HG2 LYS 72 HG2 LYS 72 5.645 3.616 6.318 619 HG3 LYS 72 HG3 LYS 72 3.953 3.799 6.767 620 HD2 LYS 72 HD2 LYS 72 5.318 5.497 7.876 621 HD3 LYS 72 HD3 LYS 72 4.500 4.444 9.019 622 HE2 LYS 72 HE2 LYS 72 6.686 4.835 9.868 623 HE3 LYS 72 HE3 LYS 72 6.620 3.154 9.346 624 HZ1 LYS 72 HZ1 LYS 72 7.836 5.389 7.796 625 HZ2 LYS 72 HZ2 LYS 72 8.667 4.254 8.616 626 HZ3 LYS 72 HZ3 LYS 72 7.801 3.830 7.301 627 H THR 73 H THR 73 3.211 -0.563 8.252 628 HA THR 73 HA THR 73 5.276 -2.648 7.833 629 HB THR 73 HB THR 73 4.475 -1.965 10.105 630 HG1 THR 73 HG1 THR 73 4.703 -4.084 10.804 631 HG21 THR 73 HG21 THR 73 2.160 -3.872 9.539 632 HG22 THR 73 HG22 THR 73 2.542 -3.038 11.061 633 HG23 THR 73 HG23 THR 73 1.992 -2.107 9.661 634 H TYR 74 H TYR 74 1.794 -2.281 7.079 635 HA TYR 74 HA TYR 74 1.313 -4.948 6.256 636 HB2 TYR 74 HB2 TYR 74 -0.508 -3.427 6.595 637 HB3 TYR 74 HB3 TYR 74 0.133 -2.293 5.395 638 HD1 TYR 74 HD1 TYR 74 -1.245 -5.769 5.742 639 HD2 TYR 74 HD2 TYR 74 -0.490 -2.394 3.154 640 HE1 TYR 74 HE1 TYR 74 -2.392 -6.943 3.869 641 HE2 TYR 74 HE2 TYR 74 -1.637 -3.561 1.302 642 HH TYR 74 HH TYR 74 -2.919 -6.899 1.650 643 H ILE 75 H ILE 75 2.698 -2.215 4.404 644 HA ILE 75 HA ILE 75 2.881 -3.277 1.832 645 HB ILE 75 HB ILE 75 4.762 -1.554 3.467 646 HG12 ILE 75 HG12 ILE 75 3.110 -0.756 1.042 647 HG13 ILE 75 HG13 ILE 75 2.393 -0.801 2.633 648 HG21 ILE 75 HG21 ILE 75 5.051 -2.180 0.488 649 HG22 ILE 75 HG22 ILE 75 5.932 -0.912 1.361 650 HG23 ILE 75 HG23 ILE 75 6.218 -2.589 1.768 651 HD11 ILE 75 HD11 ILE 75 4.787 0.927 1.850 652 HD12 ILE 75 HD12 ILE 75 3.142 1.473 2.199 653 HD13 ILE 75 HD13 ILE 75 4.133 0.782 3.487 654 H LYS 76 H LYS 76 5.468 -3.703 4.325 655 HA LYS 76 HA LYS 76 6.795 -5.698 2.698 656 HB2 LYS 76 HB2 LYS 76 8.419 -5.832 4.477 657 HB3 LYS 76 HB3 LYS 76 8.031 -4.143 4.158 658 HG2 LYS 76 HG2 LYS 76 6.608 -4.046 6.163 659 HG3 LYS 76 HG3 LYS 76 6.850 -5.781 6.452 660 HD2 LYS 76 HD2 LYS 76 9.291 -5.377 6.732 661 HD3 LYS 76 HD3 LYS 76 9.008 -3.632 6.529 662 HE2 LYS 76 HE2 LYS 76 7.495 -3.647 8.496 663 HE3 LYS 76 HE3 LYS 76 7.718 -5.390 8.672 664 HZ1 LYS 76 HZ1 LYS 76 9.883 -3.369 8.942 665 HZ2 LYS 76 HZ2 LYS 76 9.171 -4.161 10.178 666 HZ3 LYS 76 HZ3 LYS 76 10.082 -4.984 9.105 667 H ASN 77 H ASN 77 4.313 -6.033 5.121 668 HA ASN 77 HA ASN 77 4.863 -8.904 5.519 669 HB2 ASN 77 HB2 ASN 77 2.731 -6.983 6.511 670 HB3 ASN 77 HB3 ASN 77 2.554 -8.724 6.699 671 HD21 ASN 77 HD21 ASN 77 5.226 -6.781 9.072 672 HD22 ASN 77 HD22 ASN 77 4.487 -5.930 7.725 673 H SER 78 H SER 78 2.716 -6.978 3.475 674 HA SER 78 HA SER 78 1.273 -9.315 2.452 675 HB2 SER 78 HB2 SER 78 0.254 -7.067 2.762 676 HB3 SER 78 HB3 SER 78 1.290 -6.446 1.461 677 HG SER 78 HG SER 78 -0.838 -7.128 0.770 678 H ASN 79 H ASN 79 3.723 -7.055 1.203 679 HA ASN 79 HA ASN 79 4.530 -9.069 -0.836 680 HB2 ASN 79 HB2 ASN 79 4.842 -7.184 -2.471 681 HB3 ASN 79 HB3 ASN 79 3.189 -7.682 -2.134 682 HD21 ASN 79 HD21 ASN 79 4.361 -3.929 -0.976 683 HD22 ASN 79 HD22 ASN 79 5.561 -5.218 -1.025 684 H ARG 80 H ARG 80 6.134 -9.634 0.677 685 HA ARG 80 HA ARG 80 8.294 -7.774 1.260 686 HB2 ARG 80 HB2 ARG 80 7.636 -9.809 2.663 687 HB3 ARG 80 HB3 ARG 80 8.320 -10.825 1.406 688 HG2 ARG 80 HG2 ARG 80 9.907 -10.557 3.210 689 HG3 ARG 80 HG3 ARG 80 10.541 -9.780 1.757 690 HD2 ARG 80 HD2 ARG 80 9.838 -7.558 2.647 691 HD3 ARG 80 HD3 ARG 80 9.165 -8.331 4.077 692 HE ARG 80 HE ARG 80 12.015 -7.910 3.382 693 HH11 ARG 80 HH11 ARG 80 13.536 -8.083 4.976 694 HH12 ARG 80 HH12 ARG 80 13.119 -8.786 6.511 695 HH21 ARG 80 HH21 ARG 80 9.843 -9.402 5.697 696 HH22 ARG 80 HH22 ARG 80 11.084 -9.513 6.916 697 H MET 81 H MET 81 7.858 -10.342 -1.096 698 HA MET 81 HA MET 81 10.223 -9.362 -2.679 699 HB2 MET 81 HB2 MET 81 9.106 -12.188 -2.453 700 HB3 MET 81 HB3 MET 81 10.416 -11.683 -3.527 701 HG2 MET 81 HG2 MET 81 11.771 -11.006 -1.570 702 HG3 MET 81 HG3 MET 81 10.478 -11.539 -0.489 703 HE1 MET 81 HE1 MET 81 12.174 -13.004 0.877 704 HE2 MET 81 HE2 MET 81 13.260 -14.207 0.146 705 HE3 MET 81 HE3 MET 81 13.490 -12.479 -0.199 706 H GLY 82 H GLY 82 6.877 -10.465 -2.809 707 HA2 GLY 82 HA2 GLY 82 5.271 -9.419 -4.286 708 HA3 GLY 82 HA3 GLY 82 6.527 -9.198 -5.500 709 H ARG 83 H ARG 83 4.011 -11.164 -4.440 710 HA ARG 83 HA ARG 83 3.240 -13.306 -4.860 711 HB2 ARG 83 HB2 ARG 83 3.969 -12.174 -7.573 712 HB3 ARG 83 HB3 ARG 83 3.283 -13.788 -7.440 713 HG2 ARG 83 HG2 ARG 83 1.488 -12.353 -7.891 714 HG3 ARG 83 HG3 ARG 83 1.323 -12.904 -6.227 715 HD2 ARG 83 HD2 ARG 83 2.226 -10.686 -5.448 716 HD3 ARG 83 HD3 ARG 83 2.365 -10.185 -7.132 717 HE ARG 83 HE ARG 83 0.046 -9.936 -7.281 718 HH11 ARG 83 HH11 ARG 83 -1.982 -9.595 -6.455 719 HH12 ARG 83 HH12 ARG 83 -2.353 -10.079 -4.827 720 HH21 ARG 83 HH21 ARG 83 0.750 -11.347 -4.140 721 HH22 ARG 83 HH22 ARG 83 -0.855 -11.029 -3.548 722 H THR 84 H THR 84 5.622 -13.492 -3.693 723 HA THR 84 HA THR 84 7.524 -14.667 -3.340 724 HB THR 84 HB THR 84 6.093 -17.155 -4.235 725 HG1 THR 84 HG1 THR 84 4.813 -17.020 -2.396 726 HG21 THR 84 HG21 THR 84 7.546 -16.338 -1.665 727 HG22 THR 84 HG22 THR 84 6.904 -17.958 -2.031 728 HG23 THR 84 HG23 THR 84 8.258 -17.311 -2.967 729 H ASN 85 H ASN 85 7.625 -13.530 -5.952 730 HA ASN 85 HA ASN 85 8.604 -13.613 -7.965 731 HB2 ASN 85 HB2 ASN 85 10.565 -13.714 -6.459 732 HB3 ASN 85 HB3 ASN 85 10.562 -15.472 -6.560 733 HD21 ASN 85 HD21 ASN 85 11.918 -13.311 -9.781 734 HD22 ASN 85 HD22 ASN 85 10.808 -12.541 -8.660 735 H ASN 86 H ASN 86 6.471 -15.680 -7.540 736 HA ASN 86 HA ASN 86 7.329 -17.787 -9.421 737 HB2 ASN 86 HB2 ASN 86 6.228 -19.299 -8.239 738 HB3 ASN 86 HB3 ASN 86 6.384 -18.121 -6.943 739 HD21 ASN 86 HD21 ASN 86 2.843 -17.171 -7.307 740 HD22 ASN 86 HD22 ASN 86 4.416 -16.365 -7.261 741 H PHE 87 H PHE 87 6.583 -15.157 -10.359 742 HA PHE 87 HA PHE 87 4.088 -15.688 -11.924 743 HB2 PHE 87 HB2 PHE 87 3.786 -13.292 -11.887 744 HB3 PHE 87 HB3 PHE 87 3.993 -13.925 -10.260 745 HD1 PHE 87 HD1 PHE 87 5.697 -12.010 -12.987 746 HD2 PHE 87 HD2 PHE 87 5.809 -13.189 -8.837 747 HE1 PHE 87 HE1 PHE 87 7.531 -10.393 -12.578 748 HE2 PHE 87 HE2 PHE 87 7.628 -11.542 -8.432 749 HZ PHE 87 HZ PHE 87 8.500 -10.159 -10.298 750 H LYS 88 H LYS 88 7.074 -16.263 -12.549 751 HA LYS 88 HA LYS 88 7.801 -14.269 -14.584 752 HB2 LYS 88 HB2 LYS 88 10.055 -15.273 -14.283 753 HB3 LYS 88 HB3 LYS 88 9.300 -14.754 -12.778 754 HG2 LYS 88 HG2 LYS 88 8.556 -17.232 -12.475 755 HG3 LYS 88 HG3 LYS 88 9.672 -17.616 -13.783 756 HD2 LYS 88 HD2 LYS 88 11.555 -17.063 -12.477 757 HD3 LYS 88 HD3 LYS 88 10.625 -15.998 -11.406 758 HE2 LYS 88 HE2 LYS 88 9.383 -17.957 -10.502 759 HE3 LYS 88 HE3 LYS 88 10.383 -19.040 -11.490 760 HZ1 LYS 88 HZ1 LYS 88 11.415 -17.164 -9.422 761 HZ2 LYS 88 HZ2 LYS 88 11.234 -18.779 -9.200 762 HZ3 LYS 88 HZ3 LYS 88 12.335 -18.216 -10.272 763 H THR 89 H THR 89 6.609 -17.422 -14.633 764 HA THR 89 HA THR 89 7.110 -17.909 -17.514 765 HB THR 89 HB THR 89 8.416 -19.450 -15.246 766 HG1 THR 89 HG1 THR 89 10.196 -19.257 -16.606 767 HG21 THR 89 HG21 THR 89 7.765 -20.489 -18.015 768 HG22 THR 89 HG22 THR 89 9.050 -21.171 -16.971 769 HG23 THR 89 HG23 THR 89 7.368 -21.204 -16.432 770 H ILE 90 H ILE 90 6.113 -19.482 -14.443 771 HA ILE 90 HA ILE 90 3.873 -20.947 -15.585 772 HB ILE 90 HB ILE 90 3.421 -21.473 -13.244 773 HG12 ILE 90 HG12 ILE 90 5.945 -19.980 -12.469 774 HG13 ILE 90 HG13 ILE 90 4.351 -19.220 -12.401 775 HG21 ILE 90 HG21 ILE 90 6.337 -21.892 -14.002 776 HG22 ILE 90 HG22 ILE 90 5.362 -22.889 -12.905 777 HG23 ILE 90 HG23 ILE 90 4.961 -22.830 -14.620 778 HD11 ILE 90 HD11 ILE 90 5.102 -21.770 -10.923 779 HD12 ILE 90 HD12 ILE 90 4.997 -20.146 -10.223 780 HD13 ILE 90 HD13 ILE 90 3.534 -20.921 -10.861 781 H LYS 91 H LYS 91 1.793 -20.590 -13.960 782 HA LYS 91 HA LYS 91 -0.155 -19.575 -13.877 783 HB2 LYS 91 HB2 LYS 91 1.310 -16.914 -13.811 784 HB3 LYS 91 HB3 LYS 91 -0.327 -17.190 -13.276 785 HG2 LYS 91 HG2 LYS 91 1.982 -18.645 -11.917 786 HG3 LYS 91 HG3 LYS 91 1.632 -16.966 -11.568 787 HD2 LYS 91 HD2 LYS 91 0.611 -18.353 -9.905 788 HD3 LYS 91 HD3 LYS 91 -0.634 -17.512 -10.837 789 HE2 LYS 91 HE2 LYS 91 -1.092 -19.564 -12.121 790 HE3 LYS 91 HE3 LYS 91 0.229 -20.404 -11.294 791 HZ1 LYS 91 HZ1 LYS 91 -2.217 -19.346 -9.974 792 HZ2 LYS 91 HZ2 LYS 91 -1.926 -20.919 -10.301 793 HZ3 LYS 91 HZ3 LYS 91 -1.003 -20.132 -9.210 794 H MET 92 H MET 92 1.794 -18.377 -16.549 795 HA MET 92 HA MET 92 -0.576 -17.303 -17.908 796 HB2 MET 92 HB2 MET 92 0.871 -16.514 -19.582 797 HB3 MET 92 HB3 MET 92 1.656 -16.223 -18.032 798 HG2 MET 92 HG2 MET 92 3.057 -18.260 -18.407 799 HG3 MET 92 HG3 MET 92 2.293 -18.474 -19.985 800 HE1 MET 92 HE1 MET 92 4.482 -18.529 -21.348 801 HE2 MET 92 HE2 MET 92 5.820 -17.380 -21.133 802 HE3 MET 92 HE3 MET 92 5.378 -18.483 -19.814 803 H PHE 93 H PHE 93 0.967 -20.401 -17.843 804 HA PHE 93 HA PHE 93 -0.650 -21.276 -20.190 805 HB2 PHE 93 HB2 PHE 93 0.994 -22.911 -20.693 806 HB3 PHE 93 HB3 PHE 93 1.779 -21.355 -20.558 807 HD1 PHE 93 HD1 PHE 93 3.524 -20.963 -18.922 808 HD2 PHE 93 HD2 PHE 93 1.322 -24.673 -18.925 809 HE1 PHE 93 HE1 PHE 93 5.221 -21.986 -17.427 810 HE2 PHE 93 HE2 PHE 93 2.999 -25.672 -17.398 811 HZ PHE 93 HZ PHE 93 4.960 -24.334 -16.654 812 H GLU 94 H GLU 94 -1.002 -21.302 -16.995 813 HA GLU 94 HA GLU 94 -1.640 -24.189 -16.645 814 HB2 GLU 94 HB2 GLU 94 -1.295 -21.961 -14.615 815 HB3 GLU 94 HB3 GLU 94 -1.662 -23.650 -14.242 816 HG2 GLU 94 HG2 GLU 94 0.475 -24.347 -15.326 817 HG3 GLU 94 HG3 GLU 94 0.873 -22.649 -15.619 818 H ASP 95 H ASP 95 -3.599 -24.924 -15.867 819 HA ASP 95 HA ASP 95 -5.924 -23.072 -15.731 820 HB2 ASP 95 HB2 ASP 95 -5.651 -25.459 -17.594 821 HB3 ASP 95 HB3 ASP 95 -7.195 -24.717 -17.185 822 H ASP 96 H ASP 96 -4.677 -24.150 -13.521 823 HA ASP 96 HA ASP 96 -6.886 -25.774 -12.417 824 HB2 ASP 96 HB2 ASP 96 -5.514 -27.356 -11.338 825 HB3 ASP 96 HB3 ASP 96 -5.062 -27.364 -13.034 826 H VAL 97 H VAL 97 -7.271 -25.564 -10.247 827 HA VAL 97 HA VAL 97 -5.813 -23.463 -8.688 828 HB VAL 97 HB VAL 97 -8.841 -23.599 -9.002 829 HG11 VAL 97 HG11 VAL 97 -7.082 -21.650 -7.444 830 HG12 VAL 97 HG12 VAL 97 -8.835 -21.490 -7.693 831 HG13 VAL 97 HG13 VAL 97 -8.209 -22.836 -6.746 832 HG21 VAL 97 HG21 VAL 97 -7.853 -22.598 -11.011 833 HG22 VAL 97 HG22 VAL 97 -8.629 -21.351 -10.038 834 HG23 VAL 97 HG23 VAL 97 -6.859 -21.514 -10.012 835 H SER 98 H SER 98 -8.387 -25.952 -8.536 836 HA SER 98 HA SER 98 -7.539 -26.723 -5.786 837 HB2 SER 98 HB2 SER 98 -9.907 -27.417 -5.510 838 HB3 SER 98 HB3 SER 98 -9.709 -25.693 -5.849 839 HG SER 98 HG SER 98 -11.380 -26.649 -7.118 840 H SER 99 H SER 99 -6.427 -27.762 -8.312 841 HA SER 99 HA SER 99 -5.913 -29.586 -9.475 842 HB2 SER 99 HB2 SER 99 -5.102 -31.484 -8.268 843 HB3 SER 99 HB3 SER 99 -4.674 -29.975 -7.462 844 HG SER 99 HG SER 99 -5.396 -31.592 -5.998 845 H ALA 100 H ALA 100 -8.852 -29.157 -9.328 846 HA ALA 100 HA ALA 100 -9.609 -31.758 -10.581 847 HB1 ALA 100 HB1 ALA 100 -11.334 -30.039 -8.751 848 HB2 ALA 100 HB2 ALA 100 -11.875 -31.473 -9.650 849 HB3 ALA 100 HB3 ALA 100 -10.658 -31.637 -8.367 850 H SER 101 H SER 101 -9.743 -31.375 -12.674 851 HA SER 101 HA SER 101 -11.364 -29.138 -13.760 852 HB2 SER 101 HB2 SER 101 -8.500 -29.722 -14.628 853 HB3 SER 101 HB3 SER 101 -9.635 -28.654 -15.468 854 HG SER 101 HG SER 101 -8.296 -27.430 -14.139 855 H ALA 102 H ALA 102 -12.679 -29.934 -15.305 856 HA ALA 102 HA ALA 102 -13.766 -31.401 -16.613 857 HB1 ALA 102 HB1 ALA 102 -11.013 -32.022 -17.711 858 HB2 ALA 102 HB2 ALA 102 -12.569 -32.241 -18.539 859 HB3 ALA 102 HB3 ALA 102 -12.003 -30.606 -18.141 860 H GLN 103 H GLN 103 -13.027 -32.430 -14.043 861 HA GLN 103 HA GLN 103 -13.092 -35.386 -14.523 862 HB2 GLN 103 HB2 GLN 103 -11.880 -33.788 -12.258 863 HB3 GLN 103 HB3 GLN 103 -12.194 -35.517 -12.136 864 HG2 GLN 103 HG2 GLN 103 -10.427 -34.250 -14.264 865 HG3 GLN 103 HG3 GLN 103 -9.849 -34.973 -12.772 866 HE21 GLN 103 HE21 GLN 103 -9.525 -37.521 -15.483 867 HE22 GLN 103 HE22 GLN 103 -8.890 -35.901 -15.224 868 HA PRO 104 HA PRO 104 -17.226 -34.414 -12.610 869 HB2 PRO 104 HB2 PRO 104 -18.763 -35.952 -14.271 870 HB3 PRO 104 HB3 PRO 104 -18.286 -34.269 -14.651 871 HG2 PRO 104 HG2 PRO 104 -16.981 -36.834 -15.613 872 HG3 PRO 104 HG3 PRO 104 -17.447 -35.397 -16.575 873 HD2 PRO 104 HD2 PRO 104 -14.904 -35.787 -15.674 874 HD3 PRO 104 HD3 PRO 104 -15.623 -34.149 -15.772 875 H ASN 105 H ASN 105 -17.227 -35.503 -10.774 876 HA ASN 105 HA ASN 105 -17.085 -38.469 -10.732 877 HB2 ASN 105 HB2 ASN 105 -15.331 -38.463 -9.087 878 HB3 ASN 105 HB3 ASN 105 -14.798 -37.470 -10.434 879 HD21 ASN 105 HD21 ASN 105 -14.762 -34.447 -8.480 880 HD22 ASN 105 HD22 ASN 105 -14.869 -35.049 -10.130 881 H LEU 106 H LEU 106 -19.294 -36.626 -10.318 882 HA LEU 106 HA LEU 106 -20.211 -37.524 -7.626 883 HB2 LEU 106 HB2 LEU 106 -19.278 -35.220 -7.505 884 HB3 LEU 106 HB3 LEU 106 -20.454 -34.698 -8.704 885 HG LEU 106 HG LEU 106 -22.302 -35.359 -7.098 886 HD11 LEU 106 HD11 LEU 106 -19.971 -35.749 -5.168 887 HD12 LEU 106 HD12 LEU 106 -21.684 -35.648 -4.705 888 HD13 LEU 106 HD13 LEU 106 -21.123 -36.998 -5.693 889 HD21 LEU 106 HD21 LEU 106 -21.495 -33.038 -7.263 890 HD22 LEU 106 HD22 LEU 106 -21.970 -33.432 -5.604 891 HD23 LEU 106 HD23 LEU 106 -20.247 -33.372 -6.041 892 HA PRO 107 HA PRO 107 -23.413 -38.478 -10.833 893 HB2 PRO 107 HB2 PRO 107 -24.155 -40.944 -9.925 894 HB3 PRO 107 HB3 PRO 107 -22.698 -40.665 -10.928 895 HG2 PRO 107 HG2 PRO 107 -22.860 -40.922 -7.908 896 HG3 PRO 107 HG3 PRO 107 -21.728 -41.741 -9.030 897 HD2 PRO 107 HD2 PRO 107 -21.046 -39.486 -7.664 898 HD3 PRO 107 HD3 PRO 107 -20.456 -39.780 -9.326 Start of MODEL 14 1 H1 GLY -5 H1 GLY -5 7.312 -73.201 7.468 2 H2 GLY -5 H2 GLY -5 7.791 -74.639 6.847 3 H3 GLY -5 H3 GLY -5 6.966 -74.590 8.262 4 HA2 GLY -5 HA2 GLY -5 5.885 -73.812 5.633 5 HA3 GLY -5 HA3 GLY -5 5.521 -75.328 6.481 6 H SER -4 H SER -4 3.815 -72.994 5.631 7 HA SER -4 HA SER -4 2.137 -71.644 6.307 8 HB2 SER -4 HB2 SER -4 2.028 -73.363 8.804 9 HB3 SER -4 HB3 SER -4 0.768 -72.267 8.224 10 HG SER -4 HG SER -4 0.391 -74.437 7.569 11 H HIS -3 H HIS -3 1.244 -70.240 8.299 12 HA HIS -3 HA HIS -3 3.517 -68.977 9.732 13 HB2 HIS -3 HB2 HIS -3 2.797 -67.957 7.333 14 HB3 HIS -3 HB3 HIS -3 1.619 -67.124 8.338 15 HD2 HIS -3 HD2 HIS -3 2.564 -65.138 9.868 16 HE1 HIS -3 HE1 HIS -3 6.666 -65.431 8.730 17 HE2 HIS -3 HE2 HIS -3 4.932 -63.990 9.907 18 H MET -2 H MET -2 3.040 -68.265 11.702 19 HA MET -2 HA MET -2 0.213 -68.307 12.685 20 HB2 MET -2 HB2 MET -2 2.631 -69.737 13.856 21 HB3 MET -2 HB3 MET -2 1.069 -69.601 14.661 22 HG2 MET -2 HG2 MET -2 1.546 -70.969 11.995 23 HG3 MET -2 HG3 MET -2 1.408 -71.780 13.546 24 HE1 MET -2 HE1 MET -2 -1.063 -70.389 15.036 25 HE2 MET -2 HE2 MET -2 -2.358 -71.461 14.472 26 HE3 MET -2 HE3 MET -2 -0.774 -72.141 14.902 27 H ALA -1 H ALA -1 1.362 -65.917 12.124 28 HA ALA -1 HA ALA -1 1.603 -64.650 14.775 29 HB1 ALA -1 HB1 ALA -1 3.747 -64.332 12.635 30 HB2 ALA -1 HB2 ALA -1 3.617 -63.399 14.145 31 HB3 ALA -1 HB3 ALA -1 3.931 -65.143 14.209 32 H SER 0 H SER 0 -0.326 -63.761 14.433 33 HA SER 0 HA SER 0 -0.692 -61.774 12.228 34 HB2 SER 0 HB2 SER 0 -2.821 -63.233 13.829 35 HB3 SER 0 HB3 SER 0 -3.081 -62.184 12.423 36 HG SER 0 HG SER 0 -3.085 -64.420 11.873 37 H MET 1 H MET 1 0.290 -61.498 15.213 38 HA MET 1 HA MET 1 -0.886 -58.848 15.615 39 HB2 MET 1 HB2 MET 1 -1.791 -59.223 17.838 40 HB3 MET 1 HB3 MET 1 -2.578 -60.295 16.685 41 HG2 MET 1 HG2 MET 1 -1.120 -62.167 17.438 42 HG3 MET 1 HG3 MET 1 -0.350 -61.083 18.604 43 HE1 MET 1 HE1 MET 1 -0.791 -62.727 20.584 44 HE2 MET 1 HE2 MET 1 -2.375 -63.449 20.946 45 HE3 MET 1 HE3 MET 1 -1.526 -63.877 19.444 46 H ASP 2 H ASP 2 1.667 -60.931 16.034 47 HA ASP 2 HA ASP 2 3.185 -59.037 17.797 48 HB2 ASP 2 HB2 ASP 2 3.716 -61.934 17.039 49 HB3 ASP 2 HB3 ASP 2 4.813 -60.933 17.984 50 H GLN 3 H GLN 3 2.559 -59.370 14.654 51 HA GLN 3 HA GLN 3 5.250 -58.613 13.633 52 HB2 GLN 3 HB2 GLN 3 4.872 -61.082 13.615 53 HB3 GLN 3 HB3 GLN 3 3.453 -60.855 12.617 54 HG2 GLN 3 HG2 GLN 3 5.772 -59.573 11.350 55 HG3 GLN 3 HG3 GLN 3 6.191 -61.202 11.850 56 HE21 GLN 3 HE21 GLN 3 3.037 -60.912 9.185 57 HE22 GLN 3 HE22 GLN 3 3.290 -59.618 10.364 58 H LEU 4 H LEU 4 2.470 -57.246 14.012 59 HA LEU 4 HA LEU 4 2.148 -56.239 11.208 60 HB2 LEU 4 HB2 LEU 4 0.144 -56.725 13.394 61 HB3 LEU 4 HB3 LEU 4 -0.052 -55.296 12.389 62 HG LEU 4 HG LEU 4 -0.081 -56.649 10.344 63 HD11 LEU 4 HD11 LEU 4 0.057 -59.041 12.226 64 HD12 LEU 4 HD12 LEU 4 -0.422 -59.122 10.514 65 HD13 LEU 4 HD13 LEU 4 1.210 -58.617 10.938 66 HD21 LEU 4 HD21 LEU 4 -2.176 -56.087 11.533 67 HD22 LEU 4 HD22 LEU 4 -2.295 -57.637 10.687 68 HD23 LEU 4 HD23 LEU 4 -2.061 -57.606 12.450 69 H ASP 5 H ASP 5 2.631 -54.239 10.800 70 HA ASP 5 HA ASP 5 2.882 -52.159 12.903 71 HB2 ASP 5 HB2 ASP 5 5.068 -53.355 12.834 72 HB3 ASP 5 HB3 ASP 5 5.190 -53.024 11.108 73 H GLU 6 H GLU 6 3.044 -53.003 9.433 74 HA GLU 6 HA GLU 6 2.904 -50.262 8.536 75 HB2 GLU 6 HB2 GLU 6 4.176 -52.257 7.537 76 HB3 GLU 6 HB3 GLU 6 2.636 -52.769 6.845 77 HG2 GLU 6 HG2 GLU 6 2.488 -50.571 5.656 78 HG3 GLU 6 HG3 GLU 6 3.983 -50.060 6.436 79 H ILE 7 H ILE 7 0.725 -50.584 10.112 80 HA ILE 7 HA ILE 7 -1.657 -51.002 8.350 81 HB ILE 7 HB ILE 7 -1.460 -51.041 11.371 82 HG12 ILE 7 HG12 ILE 7 -0.285 -52.974 10.504 83 HG13 ILE 7 HG13 ILE 7 -1.787 -53.442 11.280 84 HG21 ILE 7 HG21 ILE 7 -3.795 -51.640 9.511 85 HG22 ILE 7 HG22 ILE 7 -3.757 -52.045 11.240 86 HG23 ILE 7 HG23 ILE 7 -3.685 -50.359 10.734 87 HD11 ILE 7 HD11 ILE 7 -1.337 -53.253 8.272 88 HD12 ILE 7 HD12 ILE 7 -1.408 -54.736 9.238 89 HD13 ILE 7 HD13 ILE 7 -2.859 -53.735 9.061 90 H ILE 8 H ILE 8 -3.068 -49.432 7.943 91 HA ILE 8 HA ILE 8 -2.458 -46.667 8.814 92 HB ILE 8 HB ILE 8 -4.368 -47.725 6.701 93 HG12 ILE 8 HG12 ILE 8 -1.644 -46.355 6.442 94 HG13 ILE 8 HG13 ILE 8 -1.952 -48.069 6.169 95 HG21 ILE 8 HG21 ILE 8 -3.546 -44.847 7.327 96 HG22 ILE 8 HG22 ILE 8 -4.582 -45.365 5.980 97 HG23 ILE 8 HG23 ILE 8 -5.151 -45.553 7.624 98 HD11 ILE 8 HD11 ILE 8 -2.971 -45.776 4.465 99 HD12 ILE 8 HD12 ILE 8 -1.809 -47.035 4.036 100 HD13 ILE 8 HD13 ILE 8 -3.510 -47.467 4.296 101 H GLU 9 H GLU 9 -3.739 -45.469 10.127 102 HA GLU 9 HA GLU 9 -6.303 -46.586 11.164 103 HB2 GLU 9 HB2 GLU 9 -3.966 -45.611 12.855 104 HB3 GLU 9 HB3 GLU 9 -5.592 -45.945 13.460 105 HG2 GLU 9 HG2 GLU 9 -5.372 -48.311 12.631 106 HG3 GLU 9 HG3 GLU 9 -3.686 -47.974 12.226 107 H GLN 10 H GLN 10 -7.521 -45.007 12.484 108 HA GLN 10 HA GLN 10 -7.248 -42.187 11.603 109 HB2 GLN 10 HB2 GLN 10 -8.800 -43.856 10.149 110 HB3 GLN 10 HB3 GLN 10 -9.944 -43.522 11.441 111 HG2 GLN 10 HG2 GLN 10 -10.345 -41.995 9.623 112 HG3 GLN 10 HG3 GLN 10 -9.679 -41.050 10.947 113 HE21 GLN 10 HE21 GLN 10 -7.454 -41.567 7.500 114 HE22 GLN 10 HE22 GLN 10 -8.807 -42.643 7.818 115 H ILE 11 H ILE 11 -8.786 -40.743 12.788 116 HA ILE 11 HA ILE 11 -9.411 -39.798 14.697 117 HB ILE 11 HB ILE 11 -11.378 -40.832 13.731 118 HG12 ILE 11 HG12 ILE 11 -11.591 -40.528 16.745 119 HG13 ILE 11 HG13 ILE 11 -11.428 -39.204 15.589 120 HG21 ILE 11 HG21 ILE 11 -11.122 -43.006 15.840 121 HG22 ILE 11 HG22 ILE 11 -12.513 -42.747 14.769 122 HG23 ILE 11 HG23 ILE 11 -10.966 -43.206 14.084 123 HD11 ILE 11 HD11 ILE 11 -13.757 -41.156 15.784 124 HD12 ILE 11 HD12 ILE 11 -13.751 -39.434 16.181 125 HD13 ILE 11 HD13 ILE 11 -13.560 -39.945 14.491 126 H GLN 12 H GLN 12 -7.055 -40.636 15.230 127 HA GLN 12 HA GLN 12 -7.003 -42.377 17.624 128 HB2 GLN 12 HB2 GLN 12 -4.618 -42.578 17.212 129 HB3 GLN 12 HB3 GLN 12 -5.609 -43.085 15.861 130 HG2 GLN 12 HG2 GLN 12 -4.791 -40.263 15.574 131 HG3 GLN 12 HG3 GLN 12 -3.410 -41.319 15.807 132 HE21 GLN 12 HE21 GLN 12 -5.348 -41.410 12.249 133 HE22 GLN 12 HE22 GLN 12 -5.884 -40.313 13.533 134 H LYS 13 H LYS 13 -8.116 -40.516 18.730 135 HA LYS 13 HA LYS 13 -8.191 -38.770 20.200 136 HB2 LYS 13 HB2 LYS 13 -6.798 -40.584 21.396 137 HB3 LYS 13 HB3 LYS 13 -5.403 -39.561 21.070 138 HG2 LYS 13 HG2 LYS 13 -6.942 -37.669 22.217 139 HG3 LYS 13 HG3 LYS 13 -7.829 -39.061 22.823 140 HD2 LYS 13 HD2 LYS 13 -6.266 -38.438 24.512 141 HD3 LYS 13 HD3 LYS 13 -5.632 -39.928 23.787 142 HE2 LYS 13 HE2 LYS 13 -4.091 -38.564 22.372 143 HE3 LYS 13 HE3 LYS 13 -4.767 -37.085 23.056 144 HZ1 LYS 13 HZ1 LYS 13 -3.303 -39.160 24.603 145 HZ2 LYS 13 HZ2 LYS 13 -2.702 -37.707 24.168 146 HZ3 LYS 13 HZ3 LYS 13 -3.930 -37.790 25.237 147 H GLU 14 H GLU 14 -7.710 -37.838 17.781 148 HA GLU 14 HA GLU 14 -5.359 -36.192 17.511 149 HB2 GLU 14 HB2 GLU 14 -7.876 -36.610 15.913 150 HB3 GLU 14 HB3 GLU 14 -6.767 -35.270 15.535 151 HG2 GLU 14 HG2 GLU 14 -4.979 -36.641 15.047 152 HG3 GLU 14 HG3 GLU 14 -5.612 -38.012 15.956 153 H ALA 15 H ALA 15 -5.059 -34.563 18.762 154 HA ALA 15 HA ALA 15 -7.141 -32.447 18.962 155 HB1 ALA 15 HB1 ALA 15 -5.133 -33.264 21.097 156 HB2 ALA 15 HB2 ALA 15 -6.243 -31.876 21.196 157 HB3 ALA 15 HB3 ALA 15 -6.887 -33.527 21.125 158 H ILE 16 H ILE 16 -3.728 -32.322 19.868 159 HA ILE 16 HA ILE 16 -3.445 -29.923 18.129 160 HB ILE 16 HB ILE 16 -2.593 -30.599 20.935 161 HG12 ILE 16 HG12 ILE 16 -4.087 -28.199 19.787 162 HG13 ILE 16 HG13 ILE 16 -4.845 -29.615 20.507 163 HG21 ILE 16 HG21 ILE 16 -1.529 -28.215 19.354 164 HG22 ILE 16 HG22 ILE 16 -1.294 -28.487 21.097 165 HG23 ILE 16 HG23 ILE 16 -0.571 -29.593 19.949 166 HD11 ILE 16 HD11 ILE 16 -3.144 -27.562 21.957 167 HD12 ILE 16 HD12 ILE 16 -4.868 -27.896 22.149 168 HD13 ILE 16 HD13 ILE 16 -3.680 -29.104 22.675 169 H ASN 17 H ASN 17 -2.292 -32.934 18.294 170 HA ASN 17 HA ASN 17 0.479 -32.369 17.737 171 HB2 ASN 17 HB2 ASN 17 -1.094 -34.952 17.289 172 HB3 ASN 17 HB3 ASN 17 0.661 -34.816 17.275 173 HD21 ASN 17 HD21 ASN 17 -1.150 -35.340 20.800 174 HD22 ASN 17 HD22 ASN 17 -1.959 -35.583 19.260 175 H SER 18 H SER 18 -2.267 -32.349 15.718 176 HA SER 18 HA SER 18 -0.878 -32.905 13.192 177 HB2 SER 18 HB2 SER 18 -3.237 -33.534 13.600 178 HB3 SER 18 HB3 SER 18 -3.671 -31.817 13.699 179 HG SER 18 HG SER 18 -4.005 -32.735 11.597 180 H ASN 19 H ASN 19 -2.127 -29.946 14.827 181 HA ASN 19 HA ASN 19 -1.313 -28.302 12.552 182 HB2 ASN 19 HB2 ASN 19 -2.411 -26.491 13.637 183 HB3 ASN 19 HB3 ASN 19 -3.438 -27.907 13.771 184 HD21 ASN 19 HD21 ASN 19 -3.493 -27.703 17.301 185 HD22 ASN 19 HD22 ASN 19 -4.144 -28.466 15.858 186 H VAL 20 H VAL 20 0.236 -29.272 15.420 187 HA VAL 20 HA VAL 20 2.156 -27.046 15.522 188 HB VAL 20 HB VAL 20 1.990 -29.695 16.997 189 HG11 VAL 20 HG11 VAL 20 4.002 -27.435 17.392 190 HG12 VAL 20 HG12 VAL 20 3.727 -28.773 18.530 191 HG13 VAL 20 HG13 VAL 20 4.369 -29.113 16.924 192 HG21 VAL 20 HG21 VAL 20 0.297 -27.956 17.600 193 HG22 VAL 20 HG22 VAL 20 1.433 -28.254 18.918 194 HG23 VAL 20 HG23 VAL 20 1.604 -26.802 17.907 195 H VAL 21 H VAL 21 2.057 -30.267 14.068 196 HA VAL 21 HA VAL 21 4.848 -29.918 13.039 197 HB VAL 21 HB VAL 21 3.374 -32.545 13.414 198 HG11 VAL 21 HG11 VAL 21 6.311 -31.872 12.877 199 HG12 VAL 21 HG12 VAL 21 5.644 -33.498 13.132 200 HG13 VAL 21 HG13 VAL 21 5.186 -32.578 11.698 201 HG21 VAL 21 HG21 VAL 21 3.789 -31.604 15.636 202 HG22 VAL 21 HG22 VAL 21 4.940 -32.900 15.323 203 HG23 VAL 21 HG23 VAL 21 5.464 -31.207 15.189 204 H LEU 22 H LEU 22 3.980 -28.520 11.439 205 HA LEU 22 HA LEU 22 2.738 -29.923 9.109 206 HB2 LEU 22 HB2 LEU 22 1.391 -28.185 10.608 207 HB3 LEU 22 HB3 LEU 22 2.256 -27.002 9.635 208 HG LEU 22 HG LEU 22 0.444 -29.218 8.564 209 HD11 LEU 22 HD11 LEU 22 -0.064 -26.229 8.887 210 HD12 LEU 22 HD12 LEU 22 -1.178 -27.415 8.166 211 HD13 LEU 22 HD13 LEU 22 -0.773 -27.520 9.884 212 HD21 LEU 22 HD21 LEU 22 1.943 -28.602 6.782 213 HD22 LEU 22 HD22 LEU 22 0.425 -27.782 6.478 214 HD23 LEU 22 HD23 LEU 22 1.780 -26.861 7.161 215 H LYS 23 H LYS 23 3.758 -29.731 7.258 216 HA LYS 23 HA LYS 23 6.099 -27.890 6.907 217 HB2 LYS 23 HB2 LYS 23 5.957 -30.898 6.477 218 HB3 LYS 23 HB3 LYS 23 7.274 -29.909 5.867 219 HG2 LYS 23 HG2 LYS 23 6.528 -30.069 8.810 220 HG3 LYS 23 HG3 LYS 23 7.711 -31.113 8.048 221 HD2 LYS 23 HD2 LYS 23 7.903 -28.072 8.209 222 HD3 LYS 23 HD3 LYS 23 8.728 -29.192 9.276 223 HE2 LYS 23 HE2 LYS 23 9.160 -29.044 6.255 224 HE3 LYS 23 HE3 LYS 23 10.165 -28.241 7.457 225 HZ1 LYS 23 HZ1 LYS 23 9.817 -31.185 7.253 226 HZ2 LYS 23 HZ2 LYS 23 11.140 -30.349 6.803 227 HZ3 LYS 23 HZ3 LYS 23 10.727 -30.423 8.377 228 H ASN 24 H ASN 24 3.735 -27.185 5.887 229 HA ASN 24 HA ASN 24 4.230 -27.415 2.947 230 HB2 ASN 24 HB2 ASN 24 2.219 -28.766 3.877 231 HB3 ASN 24 HB3 ASN 24 1.422 -27.202 4.062 232 HD21 ASN 24 HD21 ASN 24 1.049 -26.731 0.517 233 HD22 ASN 24 HD22 ASN 24 1.288 -25.853 2.037 234 HA PRO 25 HA PRO 25 3.958 -22.876 4.129 235 HB2 PRO 25 HB2 PRO 25 6.524 -22.056 3.813 236 HB3 PRO 25 HB3 PRO 25 5.927 -22.791 5.329 237 HG2 PRO 25 HG2 PRO 25 7.438 -24.162 3.080 238 HG3 PRO 25 HG3 PRO 25 7.758 -24.234 4.842 239 HD2 PRO 25 HD2 PRO 25 6.319 -26.156 3.523 240 HD3 PRO 25 HD3 PRO 25 5.971 -25.677 5.214 241 H ARG 26 H ARG 26 2.690 -22.915 2.281 242 HA ARG 26 HA ARG 26 4.022 -22.004 -0.244 243 HB2 ARG 26 HB2 ARG 26 1.879 -24.148 0.042 244 HB3 ARG 26 HB3 ARG 26 2.110 -23.261 -1.457 245 HG2 ARG 26 HG2 ARG 26 4.264 -24.958 -0.126 246 HG3 ARG 26 HG3 ARG 26 3.211 -25.463 -1.452 247 HD2 ARG 26 HD2 ARG 26 4.082 -23.465 -2.779 248 HD3 ARG 26 HD3 ARG 26 5.311 -23.253 -1.533 249 HE ARG 26 HE ARG 26 5.111 -25.389 -3.557 250 HH11 ARG 26 HH11 ARG 26 6.842 -26.709 -3.903 251 HH12 ARG 26 HH12 ARG 26 8.158 -26.747 -2.769 252 HH21 ARG 26 HH21 ARG 26 6.793 -24.417 -0.636 253 HH22 ARG 26 HH22 ARG 26 8.143 -25.474 -0.965 254 H VAL 27 H VAL 27 0.668 -22.380 0.978 255 HA VAL 27 HA VAL 27 0.127 -19.516 0.489 256 HB VAL 27 HB VAL 27 -1.362 -21.699 -1.022 257 HG11 VAL 27 HG11 VAL 27 -1.863 -18.691 -0.824 258 HG12 VAL 27 HG12 VAL 27 -2.645 -19.778 -1.995 259 HG13 VAL 27 HG13 VAL 27 -2.951 -19.985 -0.276 260 HG21 VAL 27 HG21 VAL 27 0.706 -21.127 -2.186 261 HG22 VAL 27 HG22 VAL 27 -0.663 -20.429 -3.043 262 HG23 VAL 27 HG23 VAL 27 0.355 -19.389 -2.022 263 HA PRO 28 HA PRO 28 -2.751 -20.804 3.813 264 HB2 PRO 28 HB2 PRO 28 -3.066 -18.384 4.990 265 HB3 PRO 28 HB3 PRO 28 -1.652 -19.441 5.316 266 HG2 PRO 28 HG2 PRO 28 -1.824 -17.051 3.462 267 HG3 PRO 28 HG3 PRO 28 -0.491 -17.506 4.576 268 HD2 PRO 28 HD2 PRO 28 -0.515 -18.014 1.864 269 HD3 PRO 28 HD3 PRO 28 0.389 -19.005 3.049 270 H THR 29 H THR 29 -4.935 -20.366 4.117 271 HA THR 29 HA THR 29 -6.387 -19.217 1.870 272 HB THR 29 HB THR 29 -8.328 -20.255 3.097 273 HG1 THR 29 HG1 THR 29 -7.820 -21.545 4.881 274 HG21 THR 29 HG21 THR 29 -5.997 -22.185 2.736 275 HG22 THR 29 HG22 THR 29 -7.729 -22.586 2.724 276 HG23 THR 29 HG23 THR 29 -7.042 -21.594 1.425 277 H GLN 30 H GLN 30 -5.059 -17.421 3.777 278 HA GLN 30 HA GLN 30 -7.444 -15.967 4.828 279 HB2 GLN 30 HB2 GLN 30 -4.645 -16.055 6.006 280 HB3 GLN 30 HB3 GLN 30 -6.012 -15.120 6.618 281 HG2 GLN 30 HG2 GLN 30 -6.520 -16.890 7.903 282 HG3 GLN 30 HG3 GLN 30 -7.120 -17.669 6.445 283 HE21 GLN 30 HE21 GLN 30 -4.597 -20.168 6.589 284 HE22 GLN 30 HE22 GLN 30 -6.105 -19.645 5.848 285 H LYS 31 H LYS 31 -7.721 -14.960 2.866 286 HA LYS 31 HA LYS 31 -6.017 -12.538 2.438 287 HB2 LYS 31 HB2 LYS 31 -5.828 -14.593 0.748 288 HB3 LYS 31 HB3 LYS 31 -7.353 -13.982 0.137 289 HG2 LYS 31 HG2 LYS 31 -5.916 -12.859 -1.245 290 HG3 LYS 31 HG3 LYS 31 -6.002 -11.656 0.037 291 HD2 LYS 31 HD2 LYS 31 -3.813 -13.737 -0.400 292 HD3 LYS 31 HD3 LYS 31 -3.698 -12.001 -0.710 293 HE2 LYS 31 HE2 LYS 31 -4.012 -11.557 1.727 294 HE3 LYS 31 HE3 LYS 31 -4.089 -13.298 2.024 295 HZ1 LYS 31 HZ1 LYS 31 -1.738 -11.870 0.894 296 HZ2 LYS 31 HZ2 LYS 31 -1.856 -12.443 2.419 297 HZ3 LYS 31 HZ3 LYS 31 -1.815 -13.482 1.160 298 H THR 32 H THR 32 -8.258 -12.619 4.049 299 HA THR 32 HA THR 32 -10.259 -10.928 2.603 300 HB THR 32 HB THR 32 -10.840 -13.335 2.595 301 HG1 THR 32 HG1 THR 32 -12.947 -13.062 3.268 302 HG21 THR 32 HG21 THR 32 -11.121 -13.052 5.615 303 HG22 THR 32 HG22 THR 32 -11.617 -14.447 4.632 304 HG23 THR 32 HG23 THR 32 -9.904 -14.028 4.759 305 H GLY 33 H GLY 33 -8.140 -10.550 4.895 306 HA2 GLY 33 HA2 GLY 33 -9.626 -9.933 7.288 307 HA3 GLY 33 HA3 GLY 33 -7.948 -9.513 6.951 308 H GLU 34 H GLU 34 -7.745 -7.690 5.227 309 HA GLU 34 HA GLU 34 -9.589 -5.429 5.964 310 HB2 GLU 34 HB2 GLU 34 -6.554 -5.538 5.822 311 HB3 GLU 34 HB3 GLU 34 -7.460 -4.045 5.991 312 HG2 GLU 34 HG2 GLU 34 -7.477 -6.351 7.979 313 HG3 GLU 34 HG3 GLU 34 -6.536 -4.876 8.123 314 H LEU 35 H LEU 35 -8.856 -7.177 3.290 315 HA LEU 35 HA LEU 35 -8.998 -4.875 1.459 316 HB2 LEU 35 HB2 LEU 35 -6.936 -7.110 1.293 317 HB3 LEU 35 HB3 LEU 35 -7.428 -6.116 -0.066 318 HG LEU 35 HG LEU 35 -6.814 -4.091 1.575 319 HD11 LEU 35 HD11 LEU 35 -4.940 -6.307 2.496 320 HD12 LEU 35 HD12 LEU 35 -4.797 -4.573 2.880 321 HD13 LEU 35 HD13 LEU 35 -6.151 -5.505 3.508 322 HD21 LEU 35 HD21 LEU 35 -5.816 -4.534 -0.647 323 HD22 LEU 35 HD22 LEU 35 -4.595 -4.045 0.534 324 HD23 LEU 35 HD23 LEU 35 -4.758 -5.758 0.076 325 H SER 36 H SER 36 -10.312 -5.078 -0.037 326 HA SER 36 HA SER 36 -11.859 -7.566 -0.610 327 HB2 SER 36 HB2 SER 36 -13.599 -6.000 -1.388 328 HB3 SER 36 HB3 SER 36 -13.184 -5.810 0.324 329 HG SER 36 HG SER 36 -13.296 -3.780 -0.667 330 H GLU 37 H GLU 37 -11.549 -4.762 -2.602 331 HA GLU 37 HA GLU 37 -10.241 -6.248 -4.819 332 HB2 GLU 37 HB2 GLU 37 -13.012 -6.310 -4.409 333 HB3 GLU 37 HB3 GLU 37 -12.832 -4.955 -5.528 334 HG2 GLU 37 HG2 GLU 37 -11.432 -6.462 -6.998 335 HG3 GLU 37 HG3 GLU 37 -11.735 -7.777 -5.851 336 H GLU 38 H GLU 38 -11.988 -3.288 -3.902 337 HA GLU 38 HA GLU 38 -10.596 -1.512 -5.722 338 HB2 GLU 38 HB2 GLU 38 -12.055 -0.978 -3.099 339 HB3 GLU 38 HB3 GLU 38 -11.457 0.276 -4.195 340 HG2 GLU 38 HG2 GLU 38 -12.896 -0.620 -6.011 341 HG3 GLU 38 HG3 GLU 38 -13.536 -1.839 -4.905 342 H GLN 39 H GLN 39 -9.840 -2.837 -2.571 343 HA GLN 39 HA GLN 39 -7.769 -0.975 -1.849 344 HB2 GLN 39 HB2 GLN 39 -8.191 -3.827 -0.898 345 HB3 GLN 39 HB3 GLN 39 -7.259 -2.564 -0.097 346 HG2 GLN 39 HG2 GLN 39 -10.268 -2.759 -0.388 347 HG3 GLN 39 HG3 GLN 39 -9.314 -2.707 1.085 348 HE21 GLN 39 HE21 GLN 39 -10.579 0.768 -0.528 349 HE22 GLN 39 HE22 GLN 39 -11.110 -0.792 -1.154 350 H LYS 40 H LYS 40 -7.702 -4.065 -3.629 351 HA LYS 40 HA LYS 40 -4.804 -4.022 -4.064 352 HB2 LYS 40 HB2 LYS 40 -7.147 -5.443 -5.371 353 HB3 LYS 40 HB3 LYS 40 -5.516 -5.602 -6.029 354 HG2 LYS 40 HG2 LYS 40 -4.699 -6.809 -4.307 355 HG3 LYS 40 HG3 LYS 40 -5.672 -6.005 -3.088 356 HD2 LYS 40 HD2 LYS 40 -7.481 -7.498 -4.806 357 HD3 LYS 40 HD3 LYS 40 -6.143 -8.561 -4.325 358 HE2 LYS 40 HE2 LYS 40 -6.490 -7.869 -1.949 359 HE3 LYS 40 HE3 LYS 40 -7.853 -6.855 -2.463 360 HZ1 LYS 40 HZ1 LYS 40 -7.785 -9.795 -2.938 361 HZ2 LYS 40 HZ2 LYS 40 -8.457 -9.139 -1.600 362 HZ3 LYS 40 HZ3 LYS 40 -9.085 -8.787 -3.052 363 H LYS 41 H LYS 41 -7.561 -2.760 -5.834 364 HA LYS 41 HA LYS 41 -6.010 -1.606 -7.991 365 HB2 LYS 41 HB2 LYS 41 -8.670 -0.621 -6.893 366 HB3 LYS 41 HB3 LYS 41 -7.932 -0.105 -8.402 367 HG2 LYS 41 HG2 LYS 41 -8.065 -2.374 -9.310 368 HG3 LYS 41 HG3 LYS 41 -8.763 -2.966 -7.795 369 HD2 LYS 41 HD2 LYS 41 -10.663 -1.340 -8.084 370 HD3 LYS 41 HD3 LYS 41 -10.025 -0.915 -9.673 371 HE2 LYS 41 HE2 LYS 41 -10.861 -3.723 -8.799 372 HE3 LYS 41 HE3 LYS 41 -11.905 -2.598 -9.671 373 HZ1 LYS 41 HZ1 LYS 41 -9.349 -3.693 -10.719 374 HZ2 LYS 41 HZ2 LYS 41 -10.844 -4.128 -11.201 375 HZ3 LYS 41 HZ3 LYS 41 -10.303 -2.622 -11.508 376 H ILE 42 H ILE 42 -5.776 -0.809 -4.766 377 HA ILE 42 HA ILE 42 -4.431 1.779 -5.435 378 HB ILE 42 HB ILE 42 -5.484 0.701 -2.824 379 HG12 ILE 42 HG12 ILE 42 -6.357 3.366 -3.903 380 HG13 ILE 42 HG13 ILE 42 -6.941 1.969 -4.784 381 HG21 ILE 42 HG21 ILE 42 -3.979 3.312 -3.295 382 HG22 ILE 42 HG22 ILE 42 -4.831 2.875 -1.800 383 HG23 ILE 42 HG23 ILE 42 -3.435 1.936 -2.314 384 HD11 ILE 42 HD11 ILE 42 -7.304 2.391 -1.805 385 HD12 ILE 42 HD12 ILE 42 -8.550 2.533 -3.078 386 HD13 ILE 42 HD13 ILE 42 -7.813 0.966 -2.724 387 H VAL 43 H VAL 43 -3.939 -1.265 -3.497 388 HA VAL 43 HA VAL 43 -1.128 -0.712 -3.101 389 HB VAL 43 HB VAL 43 -2.628 -3.339 -2.819 390 HG11 VAL 43 HG11 VAL 43 0.112 -2.500 -1.750 391 HG12 VAL 43 HG12 VAL 43 -0.729 -4.021 -1.377 392 HG13 VAL 43 HG13 VAL 43 -0.175 -3.723 -3.006 393 HG21 VAL 43 HG21 VAL 43 -3.447 -1.504 -1.312 394 HG22 VAL 43 HG22 VAL 43 -2.741 -2.869 -0.458 395 HG23 VAL 43 HG23 VAL 43 -1.807 -1.377 -0.645 396 H ALA 44 H ALA 44 -2.633 -3.321 -5.097 397 HA ALA 44 HA ALA 44 -0.107 -4.157 -6.183 398 HB1 ALA 44 HB1 ALA 44 -2.952 -4.702 -7.136 399 HB2 ALA 44 HB2 ALA 44 -1.494 -5.622 -7.566 400 HB3 ALA 44 HB3 ALA 44 -2.073 -5.628 -5.889 401 H ASP 45 H ASP 45 -2.646 -1.975 -7.297 402 HA ASP 45 HA ASP 45 -1.628 -1.350 -9.892 403 HB2 ASP 45 HB2 ASP 45 -3.842 -0.676 -8.987 404 HB3 ASP 45 HB3 ASP 45 -3.038 0.478 -7.916 405 H TYR 46 H TYR 46 -0.726 0.100 -6.689 406 HA TYR 46 HA TYR 46 1.096 2.007 -7.850 407 HB2 TYR 46 HB2 TYR 46 -0.144 2.084 -5.635 408 HB3 TYR 46 HB3 TYR 46 1.056 0.973 -4.990 409 HD1 TYR 46 HD1 TYR 46 2.842 3.164 -7.157 410 HD2 TYR 46 HD2 TYR 46 0.789 3.054 -3.375 411 HE1 TYR 46 HE1 TYR 46 4.050 5.170 -6.484 412 HE2 TYR 46 HE2 TYR 46 1.922 5.199 -2.714 413 HH TYR 46 HH TYR 46 4.275 6.831 -4.867 414 H ILE 47 H ILE 47 1.494 -1.239 -6.476 415 HA ILE 47 HA ILE 47 4.337 -1.510 -6.724 416 HB ILE 47 HB ILE 47 1.941 -3.280 -6.486 417 HG12 ILE 47 HG12 ILE 47 2.898 -4.075 -4.512 418 HG13 ILE 47 HG13 ILE 47 4.530 -3.622 -4.974 419 HG21 ILE 47 HG21 ILE 47 4.617 -4.445 -7.287 420 HG22 ILE 47 HG22 ILE 47 3.247 -5.359 -6.631 421 HG23 ILE 47 HG23 ILE 47 3.087 -4.550 -8.193 422 HD11 ILE 47 HD11 ILE 47 2.364 -1.621 -4.202 423 HD12 ILE 47 HD12 ILE 47 3.682 -2.210 -3.162 424 HD13 ILE 47 HD13 ILE 47 4.060 -1.271 -4.608 425 H SER 48 H SER 48 1.815 -1.622 -9.198 426 HA SER 48 HA SER 48 3.630 -2.516 -11.290 427 HB2 SER 48 HB2 SER 48 1.058 -2.740 -11.157 428 HB3 SER 48 HB3 SER 48 1.017 -1.068 -11.749 429 HG SER 48 HG SER 48 0.946 -2.641 -13.444 430 H GLU 49 H GLU 49 3.180 0.627 -9.789 431 HA GLU 49 HA GLU 49 4.104 2.095 -12.212 432 HB2 GLU 49 HB2 GLU 49 3.210 3.033 -9.463 433 HB3 GLU 49 HB3 GLU 49 3.705 4.096 -10.775 434 HG2 GLU 49 HG2 GLU 49 1.388 2.152 -10.966 435 HG3 GLU 49 HG3 GLU 49 1.226 3.806 -10.397 436 H VAL 50 H VAL 50 5.004 1.673 -8.791 437 HA VAL 50 HA VAL 50 7.747 2.690 -9.417 438 HB VAL 50 HB VAL 50 7.763 3.931 -7.423 439 HG11 VAL 50 HG11 VAL 50 4.999 4.382 -8.522 440 HG12 VAL 50 HG12 VAL 50 6.069 5.533 -7.698 441 HG13 VAL 50 HG13 VAL 50 6.502 4.924 -9.301 442 HG21 VAL 50 HG21 VAL 50 6.744 2.363 -5.863 443 HG22 VAL 50 HG22 VAL 50 5.970 3.943 -5.775 444 HG23 VAL 50 HG23 VAL 50 5.162 2.602 -6.626 445 H GLY 51 H GLY 51 6.187 -0.066 -8.219 446 HA2 GLY 51 HA2 GLY 51 7.633 -2.006 -8.526 447 HA3 GLY 51 HA3 GLY 51 8.894 -1.195 -7.596 448 H LEU 52 H LEU 52 8.306 -0.616 -5.404 449 HA LEU 52 HA LEU 52 6.352 -1.863 -3.774 450 HB2 LEU 52 HB2 LEU 52 7.466 -3.996 -4.368 451 HB3 LEU 52 HB3 LEU 52 9.030 -3.339 -3.905 452 HG LEU 52 HG LEU 52 8.345 -3.299 -1.542 453 HD11 LEU 52 HD11 LEU 52 5.712 -4.502 -2.509 454 HD12 LEU 52 HD12 LEU 52 6.246 -4.354 -0.817 455 HD13 LEU 52 HD13 LEU 52 5.909 -2.902 -1.758 456 HD21 LEU 52 HD21 LEU 52 9.344 -5.317 -2.521 457 HD22 LEU 52 HD22 LEU 52 8.233 -5.709 -1.203 458 HD23 LEU 52 HD23 LEU 52 7.728 -5.955 -2.888 459 H ASN 53 H ASN 53 9.619 -0.706 -4.099 460 HA ASN 53 HA ASN 53 9.766 0.161 -1.266 461 HB2 ASN 53 HB2 ASN 53 12.165 -0.154 -1.482 462 HB3 ASN 53 HB3 ASN 53 11.275 -1.598 -1.956 463 HD21 ASN 53 HD21 ASN 53 12.971 -1.745 -5.020 464 HD22 ASN 53 HD22 ASN 53 12.200 -2.610 -3.700 465 H ASN 54 H ASN 54 9.317 1.649 -4.238 466 HA ASN 54 HA ASN 54 10.607 4.186 -3.377 467 HB2 ASN 54 HB2 ASN 54 9.257 3.420 -5.972 468 HB3 ASN 54 HB3 ASN 54 10.052 4.960 -5.659 469 HD21 ASN 54 HD21 ASN 54 12.235 1.799 -6.842 470 HD22 ASN 54 HD22 ASN 54 10.470 1.862 -6.915 471 H LEU 55 H LEU 55 7.416 2.718 -3.490 472 HA LEU 55 HA LEU 55 5.916 5.174 -3.088 473 HB2 LEU 55 HB2 LEU 55 4.117 3.712 -2.414 474 HB3 LEU 55 HB3 LEU 55 4.830 3.165 -3.909 475 HG LEU 55 HG LEU 55 6.196 1.735 -1.836 476 HD11 LEU 55 HD11 LEU 55 3.172 1.703 -1.443 477 HD12 LEU 55 HD12 LEU 55 4.354 0.631 -0.661 478 HD13 LEU 55 HD13 LEU 55 4.357 2.369 -0.297 479 HD21 LEU 55 HD21 LEU 55 5.652 0.875 -4.086 480 HD22 LEU 55 HD22 LEU 55 5.039 -0.194 -2.811 481 HD23 LEU 55 HD23 LEU 55 3.924 0.889 -3.676 482 H ASN 56 H ASN 56 4.654 5.516 -1.014 483 HA ASN 56 HA ASN 56 6.197 4.799 1.411 484 HB2 ASN 56 HB2 ASN 56 6.176 7.014 2.275 485 HB3 ASN 56 HB3 ASN 56 6.859 7.078 0.663 486 HD21 ASN 56 HD21 ASN 56 4.713 9.840 0.189 487 HD22 ASN 56 HD22 ASN 56 6.377 9.269 0.301 488 H ALA 57 H ALA 57 4.973 5.380 3.385 489 HA ALA 57 HA ALA 57 2.541 3.816 3.393 490 HB1 ALA 57 HB1 ALA 57 4.112 5.381 5.485 491 HB2 ALA 57 HB2 ALA 57 2.789 4.253 5.852 492 HB3 ALA 57 HB3 ALA 57 4.281 3.650 5.102 493 H THR 58 H THR 58 3.281 7.287 3.637 494 HA THR 58 HA THR 58 0.817 8.234 4.663 495 HB THR 58 HB THR 58 2.710 9.670 2.757 496 HG1 THR 58 HG1 THR 58 3.751 10.326 4.642 497 HG21 THR 58 HG21 THR 58 0.813 10.705 4.911 498 HG22 THR 58 HG22 THR 58 1.992 11.692 4.013 499 HG23 THR 58 HG23 THR 58 0.649 10.934 3.154 500 H GLU 59 H GLU 59 1.922 8.022 1.241 501 HA GLU 59 HA GLU 59 -0.558 8.916 0.101 502 HB2 GLU 59 HB2 GLU 59 1.740 7.242 -1.007 503 HB3 GLU 59 HB3 GLU 59 0.416 7.819 -2.011 504 HG2 GLU 59 HG2 GLU 59 2.148 9.751 -0.416 505 HG3 GLU 59 HG3 GLU 59 2.624 9.136 -1.992 506 H LEU 60 H LEU 60 0.580 5.661 0.951 507 HA LEU 60 HA LEU 60 -1.683 4.301 -0.164 508 HB2 LEU 60 HB2 LEU 60 0.653 3.396 0.663 509 HB3 LEU 60 HB3 LEU 60 -0.110 3.346 2.249 510 HG LEU 60 HG LEU 60 -1.971 1.934 1.124 511 HD11 LEU 60 HD11 LEU 60 0.198 1.652 -1.014 512 HD12 LEU 60 HD12 LEU 60 -1.340 0.768 -0.945 513 HD13 LEU 60 HD13 LEU 60 -1.340 2.499 -1.251 514 HD21 LEU 60 HD21 LEU 60 -0.277 0.939 2.598 515 HD22 LEU 60 HD22 LEU 60 -0.623 -0.140 1.240 516 HD23 LEU 60 HD23 LEU 60 0.868 0.830 1.240 517 H SER 61 H SER 61 -1.063 5.482 3.183 518 HA SER 61 HA SER 61 -3.495 4.665 4.335 519 HB2 SER 61 HB2 SER 61 -2.931 6.042 6.158 520 HB3 SER 61 HB3 SER 61 -1.397 5.503 5.488 521 HG SER 61 HG SER 61 -1.459 7.619 4.299 522 H LYS 62 H LYS 62 -2.924 7.319 2.222 523 HA LYS 62 HA LYS 62 -5.336 8.870 2.918 524 HB2 LYS 62 HB2 LYS 62 -3.153 9.138 0.817 525 HB3 LYS 62 HB3 LYS 62 -4.542 10.227 0.880 526 HG2 LYS 62 HG2 LYS 62 -3.952 11.073 3.033 527 HG3 LYS 62 HG3 LYS 62 -2.786 9.795 3.321 528 HD2 LYS 62 HD2 LYS 62 -1.581 11.823 2.804 529 HD3 LYS 62 HD3 LYS 62 -1.328 10.648 1.522 530 HE2 LYS 62 HE2 LYS 62 -1.623 12.766 0.474 531 HE3 LYS 62 HE3 LYS 62 -3.080 11.832 0.143 532 HZ1 LYS 62 HZ1 LYS 62 -2.824 13.918 2.254 533 HZ2 LYS 62 HZ2 LYS 62 -3.591 14.116 0.830 534 HZ3 LYS 62 HZ3 LYS 62 -4.192 13.080 1.937 535 H ARG 63 H ARG 63 -4.677 6.250 0.838 536 HA ARG 63 HA ARG 63 -7.205 6.677 -0.758 537 HB2 ARG 63 HB2 ARG 63 -4.575 5.335 -1.500 538 HB3 ARG 63 HB3 ARG 63 -6.033 5.309 -2.506 539 HG2 ARG 63 HG2 ARG 63 -5.974 7.709 -2.813 540 HG3 ARG 63 HG3 ARG 63 -4.685 7.895 -1.616 541 HD2 ARG 63 HD2 ARG 63 -3.174 6.507 -3.063 542 HD3 ARG 63 HD3 ARG 63 -4.450 6.450 -4.281 543 HE ARG 63 HE ARG 63 -3.898 8.592 -4.944 544 HH11 ARG 63 HH11 ARG 63 -2.680 10.498 -4.984 545 HH12 ARG 63 HH12 ARG 63 -1.678 10.884 -3.606 546 HH21 ARG 63 HH21 ARG 63 -2.441 8.166 -1.748 547 HH22 ARG 63 HH22 ARG 63 -1.581 9.697 -1.900 548 H LEU 64 H LEU 64 -5.150 4.212 0.763 549 HA LEU 64 HA LEU 64 -7.166 2.121 0.689 550 HB2 LEU 64 HB2 LEU 64 -4.454 2.142 0.818 551 HB3 LEU 64 HB3 LEU 64 -4.797 2.071 2.538 552 HG LEU 64 HG LEU 64 -6.204 -0.028 2.024 553 HD11 LEU 64 HD11 LEU 64 -4.770 0.341 -0.651 554 HD12 LEU 64 HD12 LEU 64 -5.588 -1.140 -0.147 555 HD13 LEU 64 HD13 LEU 64 -6.527 0.341 -0.405 556 HD21 LEU 64 HD21 LEU 64 -3.877 -0.169 2.896 557 HD22 LEU 64 HD22 LEU 64 -4.237 -1.485 1.776 558 HD23 LEU 64 HD23 LEU 64 -3.254 -0.108 1.237 559 H ASN 65 H ASN 65 -6.612 4.830 2.717 560 HA ASN 65 HA ASN 65 -7.714 5.693 4.465 561 HB2 ASN 65 HB2 ASN 65 -9.583 5.194 2.856 562 HB3 ASN 65 HB3 ASN 65 -9.960 3.760 3.809 563 HD21 ASN 65 HD21 ASN 65 -11.268 5.698 6.575 564 HD22 ASN 65 HD22 ASN 65 -10.349 4.227 6.230 565 H ILE 66 H ILE 66 -5.935 4.696 5.580 566 HA ILE 66 HA ILE 66 -6.737 3.066 7.928 567 HB ILE 66 HB ILE 66 -4.536 1.808 7.703 568 HG12 ILE 66 HG12 ILE 66 -4.656 2.796 4.824 569 HG13 ILE 66 HG13 ILE 66 -3.491 3.327 6.049 570 HG21 ILE 66 HG21 ILE 66 -6.521 1.181 5.496 571 HG22 ILE 66 HG22 ILE 66 -5.447 0.056 6.354 572 HG23 ILE 66 HG23 ILE 66 -6.780 0.821 7.216 573 HD11 ILE 66 HD11 ILE 66 -3.714 0.489 4.996 574 HD12 ILE 66 HD12 ILE 66 -2.570 1.722 4.445 575 HD13 ILE 66 HD13 ILE 66 -2.499 1.121 6.126 576 H THR 67 H THR 67 -4.767 3.066 9.507 577 HA THR 67 HA THR 67 -3.633 5.789 9.757 578 HB THR 67 HB THR 67 -4.349 4.676 11.799 579 HG1 THR 67 HG1 THR 67 -2.500 5.187 12.916 580 HG21 THR 67 HG21 THR 67 -2.032 2.740 11.371 581 HG22 THR 67 HG22 THR 67 -3.088 2.846 12.790 582 HG23 THR 67 HG23 THR 67 -3.754 2.307 11.243 583 H VAL 68 H VAL 68 -1.374 6.209 9.738 584 HA VAL 68 HA VAL 68 -0.016 5.099 7.482 585 HB VAL 68 HB VAL 68 1.251 6.680 9.754 586 HG11 VAL 68 HG11 VAL 68 1.953 6.465 6.791 587 HG12 VAL 68 HG12 VAL 68 2.775 7.495 7.981 588 HG13 VAL 68 HG13 VAL 68 2.876 5.740 8.128 589 HG21 VAL 68 HG21 VAL 68 -0.703 7.953 8.962 590 HG22 VAL 68 HG22 VAL 68 0.781 8.705 8.380 591 HG23 VAL 68 HG23 VAL 68 -0.195 7.716 7.275 592 H ASP 69 H ASP 69 0.215 4.329 10.936 593 HA ASP 69 HA ASP 69 2.535 2.674 10.720 594 HB2 ASP 69 HB2 ASP 69 1.674 3.683 12.830 595 HB3 ASP 69 HB3 ASP 69 0.279 2.605 12.766 596 H LYS 70 H LYS 70 -0.863 1.905 10.133 597 HA LYS 70 HA LYS 70 -0.367 -0.980 9.890 598 HB2 LYS 70 HB2 LYS 70 -2.690 0.817 9.084 599 HB3 LYS 70 HB3 LYS 70 -2.597 -0.882 8.605 600 HG2 LYS 70 HG2 LYS 70 -2.406 -1.570 10.973 601 HG3 LYS 70 HG3 LYS 70 -2.561 0.119 11.482 602 HD2 LYS 70 HD2 LYS 70 -4.796 0.224 10.359 603 HD3 LYS 70 HD3 LYS 70 -4.654 -1.479 9.918 604 HE2 LYS 70 HE2 LYS 70 -4.629 -0.401 12.779 605 HE3 LYS 70 HE3 LYS 70 -6.066 -1.010 11.954 606 HZ1 LYS 70 HZ1 LYS 70 -3.645 -2.626 12.555 607 HZ2 LYS 70 HZ2 LYS 70 -5.081 -2.735 13.317 608 HZ3 LYS 70 HZ3 LYS 70 -4.962 -3.177 11.753 609 H ALA 71 H ALA 71 -0.169 1.808 7.734 610 HA ALA 71 HA ALA 71 0.122 0.197 5.303 611 HB1 ALA 71 HB1 ALA 71 0.899 3.091 5.896 612 HB2 ALA 71 HB2 ALA 71 0.857 2.331 4.295 613 HB3 ALA 71 HB3 ALA 71 -0.635 2.558 5.224 614 H LYS 72 H LYS 72 2.381 1.800 7.536 615 HA LYS 72 HA LYS 72 4.851 1.130 6.301 616 HB2 LYS 72 HB2 LYS 72 4.055 1.588 9.202 617 HB3 LYS 72 HB3 LYS 72 5.733 1.295 8.717 618 HG2 LYS 72 HG2 LYS 72 5.788 3.292 7.366 619 HG3 LYS 72 HG3 LYS 72 4.055 3.532 7.570 620 HD2 LYS 72 HD2 LYS 72 5.297 5.093 8.973 621 HD3 LYS 72 HD3 LYS 72 4.266 4.022 9.905 622 HE2 LYS 72 HE2 LYS 72 6.311 4.260 11.099 623 HE3 LYS 72 HE3 LYS 72 6.245 2.612 10.482 624 HZ1 LYS 72 HZ1 LYS 72 7.792 4.845 9.256 625 HZ2 LYS 72 HZ2 LYS 72 8.433 3.630 10.131 626 HZ3 LYS 72 HZ3 LYS 72 7.759 3.314 8.680 627 H THR 73 H THR 73 2.929 -0.871 8.587 628 HA THR 73 HA THR 73 4.966 -3.007 8.348 629 HB THR 73 HB THR 73 3.842 -2.478 10.518 630 HG1 THR 73 HG1 THR 73 3.849 -4.647 11.063 631 HG21 THR 73 HG21 THR 73 1.553 -4.180 9.439 632 HG22 THR 73 HG22 THR 73 1.733 -3.504 11.068 633 HG23 THR 73 HG23 THR 73 1.456 -2.420 9.699 634 H TYR 74 H TYR 74 1.595 -2.525 7.191 635 HA TYR 74 HA TYR 74 1.156 -5.039 6.040 636 HB2 TYR 74 HB2 TYR 74 -0.575 -3.377 6.192 637 HB3 TYR 74 HB3 TYR 74 0.342 -2.239 5.200 638 HD1 TYR 74 HD1 TYR 74 0.376 -2.336 2.824 639 HD2 TYR 74 HD2 TYR 74 -1.669 -5.357 5.132 640 HE1 TYR 74 HE1 TYR 74 -0.579 -3.254 0.754 641 HE2 TYR 74 HE2 TYR 74 -2.652 -6.280 3.031 642 HH TYR 74 HH TYR 74 -1.815 -5.006 -0.191 643 H ILE 75 H ILE 75 2.911 -2.260 4.610 644 HA ILE 75 HA ILE 75 3.389 -3.284 2.046 645 HB ILE 75 HB ILE 75 4.870 -1.352 3.839 646 HG12 ILE 75 HG12 ILE 75 3.471 -0.963 1.147 647 HG13 ILE 75 HG13 ILE 75 2.641 -0.814 2.687 648 HG21 ILE 75 HG21 ILE 75 5.708 -2.183 1.033 649 HG22 ILE 75 HG22 ILE 75 6.322 -0.743 1.889 650 HG23 ILE 75 HG23 ILE 75 6.654 -2.339 2.536 651 HD11 ILE 75 HD11 ILE 75 4.924 0.959 1.713 652 HD12 ILE 75 HD12 ILE 75 3.226 1.397 1.926 653 HD13 ILE 75 HD13 ILE 75 4.221 1.026 3.346 654 H LYS 76 H LYS 76 5.213 -4.135 5.029 655 HA LYS 76 HA LYS 76 6.909 -5.950 3.358 656 HB2 LYS 76 HB2 LYS 76 8.443 -6.085 5.079 657 HB3 LYS 76 HB3 LYS 76 7.914 -4.407 5.166 658 HG2 LYS 76 HG2 LYS 76 6.362 -5.083 7.065 659 HG3 LYS 76 HG3 LYS 76 7.026 -6.717 6.963 660 HD2 LYS 76 HD2 LYS 76 8.144 -5.728 8.749 661 HD3 LYS 76 HD3 LYS 76 9.320 -5.706 7.424 662 HE2 LYS 76 HE2 LYS 76 8.750 -3.321 6.978 663 HE3 LYS 76 HE3 LYS 76 7.511 -3.382 8.240 664 HZ1 LYS 76 HZ1 LYS 76 10.423 -3.763 8.725 665 HZ2 LYS 76 HZ2 LYS 76 9.585 -2.405 9.070 666 HZ3 LYS 76 HZ3 LYS 76 9.263 -3.786 9.875 667 H ASN 77 H ASN 77 4.360 -6.108 5.784 668 HA ASN 77 HA ASN 77 4.778 -8.871 6.372 669 HB2 ASN 77 HB2 ASN 77 3.619 -6.980 7.741 670 HB3 ASN 77 HB3 ASN 77 2.171 -7.357 6.803 671 HD21 ASN 77 HD21 ASN 77 3.588 -9.910 9.690 672 HD22 ASN 77 HD22 ASN 77 4.576 -8.581 9.097 673 H SER 78 H SER 78 2.703 -7.269 4.015 674 HA SER 78 HA SER 78 1.384 -9.741 3.133 675 HB2 SER 78 HB2 SER 78 1.354 -6.859 2.163 676 HB3 SER 78 HB3 SER 78 0.354 -8.160 1.472 677 HG SER 78 HG SER 78 -0.580 -6.855 3.274 678 H ASN 79 H ASN 79 4.016 -7.687 2.003 679 HA ASN 79 HA ASN 79 4.878 -9.701 0.048 680 HB2 ASN 79 HB2 ASN 79 5.009 -7.722 -1.706 681 HB3 ASN 79 HB3 ASN 79 3.587 -8.743 -1.546 682 HD21 ASN 79 HD21 ASN 79 3.258 -4.880 -0.195 683 HD22 ASN 79 HD22 ASN 79 4.802 -5.695 0.012 684 H ARG 80 H ARG 80 6.549 -9.819 1.597 685 HA ARG 80 HA ARG 80 8.447 -7.661 1.982 686 HB2 ARG 80 HB2 ARG 80 7.925 -9.716 3.475 687 HB3 ARG 80 HB3 ARG 80 8.940 -10.649 2.385 688 HG2 ARG 80 HG2 ARG 80 10.878 -9.305 2.938 689 HG3 ARG 80 HG3 ARG 80 9.868 -8.111 3.793 690 HD2 ARG 80 HD2 ARG 80 9.217 -9.859 5.438 691 HD3 ARG 80 HD3 ARG 80 10.321 -11.001 4.638 692 HE ARG 80 HE ARG 80 11.832 -8.699 5.262 693 HH11 ARG 80 HH11 ARG 80 13.104 -8.476 7.088 694 HH12 ARG 80 HH12 ARG 80 12.807 -9.482 8.470 695 HH21 ARG 80 HH21 ARG 80 10.126 -11.125 7.116 696 HH22 ARG 80 HH22 ARG 80 11.158 -10.925 8.507 697 H MET 81 H MET 81 7.958 -9.787 -0.596 698 HA MET 81 HA MET 81 10.660 -10.540 -1.080 699 HB2 MET 81 HB2 MET 81 8.117 -11.122 -2.603 700 HB3 MET 81 HB3 MET 81 9.676 -11.923 -2.876 701 HG2 MET 81 HG2 MET 81 9.696 -12.721 -0.549 702 HG3 MET 81 HG3 MET 81 8.127 -11.985 -0.255 703 HE1 MET 81 HE1 MET 81 6.295 -12.618 -2.711 704 HE2 MET 81 HE2 MET 81 5.624 -14.184 -2.210 705 HE3 MET 81 HE3 MET 81 5.851 -12.894 -1.010 706 H GLY 82 H GLY 82 10.793 -7.900 -1.335 707 HA2 GLY 82 HA2 GLY 82 12.281 -7.557 -3.752 708 HA3 GLY 82 HA3 GLY 82 10.724 -6.745 -3.941 709 H ARG 83 H ARG 83 12.033 -6.829 -0.722 710 HA ARG 83 HA ARG 83 12.265 -3.894 -0.674 711 HB2 ARG 83 HB2 ARG 83 12.174 -6.051 1.422 712 HB3 ARG 83 HB3 ARG 83 12.559 -4.361 1.807 713 HG2 ARG 83 HG2 ARG 83 10.459 -3.586 0.781 714 HG3 ARG 83 HG3 ARG 83 10.061 -5.237 0.289 715 HD2 ARG 83 HD2 ARG 83 8.807 -4.661 2.264 716 HD3 ARG 83 HD3 ARG 83 9.962 -5.958 2.593 717 HE ARG 83 HE ARG 83 11.090 -4.615 4.100 718 HH11 ARG 83 HH11 ARG 83 11.517 -2.839 5.347 719 HH12 ARG 83 HH12 ARG 83 10.708 -1.336 5.027 720 HH21 ARG 83 HH21 ARG 83 8.985 -2.472 2.295 721 HH22 ARG 83 HH22 ARG 83 9.311 -1.126 3.351 722 H THR 84 H THR 84 14.286 -6.539 0.370 723 HA THR 84 HA THR 84 16.798 -5.090 -0.299 724 HB THR 84 HB THR 84 16.266 -4.580 2.033 725 HG1 THR 84 HG1 THR 84 18.183 -5.126 2.932 726 HG21 THR 84 HG21 THR 84 16.245 -7.559 2.483 727 HG22 THR 84 HG22 THR 84 16.413 -6.363 3.784 728 HG23 THR 84 HG23 THR 84 14.949 -6.394 2.794 729 H ASN 85 H ASN 85 15.182 -7.547 -1.147 730 HA ASN 85 HA ASN 85 15.388 -9.684 -1.777 731 HB2 ASN 85 HB2 ASN 85 18.147 -8.657 -2.533 732 HB3 ASN 85 HB3 ASN 85 17.411 -10.116 -3.187 733 HD21 ASN 85 HD21 ASN 85 15.168 -8.391 -5.337 734 HD22 ASN 85 HD22 ASN 85 15.481 -9.923 -4.536 735 H ASN 86 H ASN 86 16.253 -9.316 1.094 736 HA ASN 86 HA ASN 86 18.200 -11.443 1.519 737 HB2 ASN 86 HB2 ASN 86 18.564 -10.489 3.512 738 HB3 ASN 86 HB3 ASN 86 17.785 -9.096 2.790 739 HD21 ASN 86 HD21 ASN 86 14.697 -9.899 4.746 740 HD22 ASN 86 HD22 ASN 86 15.046 -9.655 3.044 741 H PHE 87 H PHE 87 14.984 -11.645 0.908 742 HA PHE 87 HA PHE 87 13.985 -13.207 3.090 743 HB2 PHE 87 HB2 PHE 87 11.910 -13.199 1.809 744 HB3 PHE 87 HB3 PHE 87 12.628 -11.604 1.891 745 HD1 PHE 87 HD1 PHE 87 13.395 -10.450 -0.123 746 HD2 PHE 87 HD2 PHE 87 11.957 -14.510 -0.313 747 HE1 PHE 87 HE1 PHE 87 13.336 -10.318 -2.612 748 HE2 PHE 87 HE2 PHE 87 11.903 -14.372 -2.797 749 HZ PHE 87 HZ PHE 87 12.600 -12.278 -3.944 750 H LYS 88 H LYS 88 16.177 -14.370 1.182 751 HA LYS 88 HA LYS 88 14.867 -16.708 -0.039 752 HB2 LYS 88 HB2 LYS 88 16.924 -17.000 -1.202 753 HB3 LYS 88 HB3 LYS 88 16.564 -15.271 -1.177 754 HG2 LYS 88 HG2 LYS 88 18.160 -15.186 0.904 755 HG3 LYS 88 HG3 LYS 88 18.625 -16.822 0.421 756 HD2 LYS 88 HD2 LYS 88 20.262 -15.397 -0.490 757 HD3 LYS 88 HD3 LYS 88 19.246 -15.885 -1.858 758 HE2 LYS 88 HE2 LYS 88 17.998 -13.729 -1.680 759 HE3 LYS 88 HE3 LYS 88 18.959 -13.277 -0.278 760 HZ1 LYS 88 HZ1 LYS 88 20.041 -13.701 -3.015 761 HZ2 LYS 88 HZ2 LYS 88 19.814 -12.255 -2.288 762 HZ3 LYS 88 HZ3 LYS 88 20.938 -13.288 -1.710 763 H THR 89 H THR 89 16.017 -16.168 2.977 764 HA THR 89 HA THR 89 16.955 -18.951 3.528 765 HB THR 89 HB THR 89 18.336 -16.319 4.197 766 HG1 THR 89 HG1 THR 89 20.001 -17.264 2.987 767 HG21 THR 89 HG21 THR 89 19.022 -19.163 5.017 768 HG22 THR 89 HG22 THR 89 20.111 -17.756 5.174 769 HG23 THR 89 HG23 THR 89 18.600 -17.803 6.093 770 H ILE 90 H ILE 90 15.942 -15.774 4.909 771 HA ILE 90 HA ILE 90 15.116 -16.825 7.464 772 HB ILE 90 HB ILE 90 13.968 -14.706 7.711 773 HG12 ILE 90 HG12 ILE 90 14.932 -13.947 4.933 774 HG13 ILE 90 HG13 ILE 90 13.275 -14.469 5.270 775 HG21 ILE 90 HG21 ILE 90 16.767 -14.317 6.579 776 HG22 ILE 90 HG22 ILE 90 15.950 -13.325 7.798 777 HG23 ILE 90 HG23 ILE 90 16.406 -14.985 8.184 778 HD11 ILE 90 HD11 ILE 90 14.648 -12.017 6.425 779 HD12 ILE 90 HD12 ILE 90 13.320 -12.063 5.248 780 HD13 ILE 90 HD13 ILE 90 13.045 -12.614 6.916 781 H LYS 91 H LYS 91 12.801 -16.543 8.167 782 HA LYS 91 HA LYS 91 10.673 -17.227 8.262 783 HB2 LYS 91 HB2 LYS 91 10.609 -16.860 5.245 784 HB3 LYS 91 HB3 LYS 91 9.202 -17.037 6.257 785 HG2 LYS 91 HG2 LYS 91 11.097 -14.741 6.833 786 HG3 LYS 91 HG3 LYS 91 10.072 -14.681 5.411 787 HD2 LYS 91 HD2 LYS 91 8.996 -13.528 7.250 788 HD3 LYS 91 HD3 LYS 91 8.049 -14.936 6.766 789 HE2 LYS 91 HE2 LYS 91 8.937 -16.215 8.691 790 HE3 LYS 91 HE3 LYS 91 9.937 -14.830 9.164 791 HZ1 LYS 91 HZ1 LYS 91 6.962 -14.853 9.077 792 HZ2 LYS 91 HZ2 LYS 91 7.865 -14.919 10.433 793 HZ3 LYS 91 HZ3 LYS 91 7.873 -13.569 9.520 794 H MET 92 H MET 92 12.710 -19.240 6.264 795 HA MET 92 HA MET 92 10.812 -21.507 6.833 796 HB2 MET 92 HB2 MET 92 11.472 -22.545 4.800 797 HB3 MET 92 HB3 MET 92 10.986 -20.891 4.467 798 HG2 MET 92 HG2 MET 92 12.852 -21.165 3.131 799 HG3 MET 92 HG3 MET 92 13.508 -20.304 4.517 800 HE1 MET 92 HE1 MET 92 15.984 -20.889 3.893 801 HE2 MET 92 HE2 MET 92 16.537 -22.507 3.415 802 HE3 MET 92 HE3 MET 92 15.364 -21.635 2.401 803 H PHE 93 H PHE 93 13.947 -20.352 7.528 804 HA PHE 93 HA PHE 93 15.113 -23.039 7.848 805 HB2 PHE 93 HB2 PHE 93 16.080 -21.197 6.473 806 HB3 PHE 93 HB3 PHE 93 16.352 -20.271 7.948 807 HD1 PHE 93 HD1 PHE 93 18.311 -20.682 9.268 808 HD2 PHE 93 HD2 PHE 93 17.205 -23.361 6.091 809 HE1 PHE 93 HE1 PHE 93 20.528 -21.814 9.461 810 HE2 PHE 93 HE2 PHE 93 19.426 -24.502 6.273 811 HZ PHE 93 HZ PHE 93 21.081 -23.723 7.962 812 H GLU 94 H GLU 94 14.037 -20.425 9.951 813 HA GLU 94 HA GLU 94 15.743 -21.237 12.176 814 HB2 GLU 94 HB2 GLU 94 14.821 -19.406 13.388 815 HB3 GLU 94 HB3 GLU 94 15.292 -18.920 11.779 816 HG2 GLU 94 HG2 GLU 94 13.342 -17.757 12.066 817 HG3 GLU 94 HG3 GLU 94 12.833 -19.116 11.084 818 H ASP 95 H ASP 95 15.344 -22.587 13.797 819 HA ASP 95 HA ASP 95 12.663 -23.297 14.697 820 HB2 ASP 95 HB2 ASP 95 12.878 -24.774 12.723 821 HB3 ASP 95 HB3 ASP 95 14.425 -25.374 13.319 822 H ASP 96 H ASP 96 12.735 -23.740 16.824 823 HA ASP 96 HA ASP 96 14.971 -25.164 18.098 824 HB2 ASP 96 HB2 ASP 96 14.130 -22.347 18.918 825 HB3 ASP 96 HB3 ASP 96 14.929 -23.466 20.012 826 H VAL 97 H VAL 97 14.285 -26.387 19.800 827 HA VAL 97 HA VAL 97 11.516 -26.023 20.865 828 HB VAL 97 HB VAL 97 12.660 -28.705 19.985 829 HG11 VAL 97 HG11 VAL 97 9.923 -27.969 21.117 830 HG12 VAL 97 HG12 VAL 97 10.381 -29.563 20.477 831 HG13 VAL 97 HG13 VAL 97 11.167 -28.949 21.928 832 HG21 VAL 97 HG21 VAL 97 11.977 -27.433 18.003 833 HG22 VAL 97 HG22 VAL 97 10.819 -28.724 18.317 834 HG23 VAL 97 HG23 VAL 97 10.413 -27.050 18.758 835 H SER 98 H SER 98 14.544 -27.873 21.324 836 HA SER 98 HA SER 98 14.049 -27.873 24.267 837 HB2 SER 98 HB2 SER 98 15.811 -29.694 22.602 838 HB3 SER 98 HB3 SER 98 15.449 -29.856 24.331 839 HG SER 98 HG SER 98 14.116 -31.206 23.030 840 H SER 99 H SER 99 15.764 -25.995 22.259 841 HA SER 99 HA SER 99 18.308 -26.069 23.754 842 HB2 SER 99 HB2 SER 99 17.770 -25.129 20.930 843 HB3 SER 99 HB3 SER 99 19.358 -25.287 21.704 844 HG SER 99 HG SER 99 18.839 -27.113 20.406 845 H ALA 100 H ALA 100 15.676 -24.053 23.690 846 HA ALA 100 HA ALA 100 17.131 -21.496 23.606 847 HB1 ALA 100 HB1 ALA 100 14.184 -22.123 24.017 848 HB2 ALA 100 HB2 ALA 100 14.892 -20.512 23.770 849 HB3 ALA 100 HB3 ALA 100 14.970 -21.720 22.473 850 H SER 101 H SER 101 17.803 -20.332 25.302 851 HA SER 101 HA SER 101 16.467 -20.378 27.891 852 HB2 SER 101 HB2 SER 101 18.161 -22.243 28.059 853 HB3 SER 101 HB3 SER 101 19.435 -21.053 27.735 854 HG SER 101 HG SER 101 19.093 -21.408 29.988 855 H ALA 102 H ALA 102 17.578 -18.648 29.333 856 HA ALA 102 HA ALA 102 17.889 -16.196 27.859 857 HB1 ALA 102 HB1 ALA 102 18.528 -16.853 30.767 858 HB2 ALA 102 HB2 ALA 102 18.366 -15.221 30.082 859 HB3 ALA 102 HB3 ALA 102 16.955 -16.294 30.150 860 H GLN 103 H GLN 103 20.115 -18.490 29.099 861 HA GLN 103 HA GLN 103 22.214 -17.588 27.340 862 HB2 GLN 103 HB2 GLN 103 23.928 -17.298 29.101 863 HB3 GLN 103 HB3 GLN 103 22.599 -16.146 29.259 864 HG2 GLN 103 HG2 GLN 103 21.635 -17.434 31.114 865 HG3 GLN 103 HG3 GLN 103 22.880 -18.666 30.938 866 HE21 GLN 103 HE21 GLN 103 24.164 -16.705 33.709 867 HE22 GLN 103 HE22 GLN 103 23.015 -17.992 33.364 868 HA PRO 104 HA PRO 104 22.982 -21.935 27.360 869 HB2 PRO 104 HB2 PRO 104 25.305 -22.165 25.999 870 HB3 PRO 104 HB3 PRO 104 23.863 -21.398 25.276 871 HG2 PRO 104 HG2 PRO 104 26.209 -20.006 26.621 872 HG3 PRO 104 HG3 PRO 104 25.497 -19.665 25.011 873 HD2 PRO 104 HD2 PRO 104 24.794 -18.281 27.275 874 HD3 PRO 104 HD3 PRO 104 23.637 -18.604 25.950 875 H ASN 105 H ASN 105 23.092 -21.732 29.813 876 HA ASN 105 HA ASN 105 25.753 -22.632 30.876 877 HB2 ASN 105 HB2 ASN 105 23.787 -20.617 32.020 878 HB3 ASN 105 HB3 ASN 105 25.025 -21.407 32.989 879 HD21 ASN 105 HD21 ASN 105 27.703 -19.487 31.710 880 HD22 ASN 105 HD22 ASN 105 27.238 -20.863 32.702 881 H LEU 106 H LEU 106 25.145 -24.762 30.575 882 HA LEU 106 HA LEU 106 23.003 -26.004 32.045 883 HB2 LEU 106 HB2 LEU 106 25.483 -27.072 30.695 884 HB3 LEU 106 HB3 LEU 106 24.402 -28.118 31.608 885 HG LEU 106 HG LEU 106 23.492 -26.403 29.256 886 HD11 LEU 106 HD11 LEU 106 24.256 -29.353 29.338 887 HD12 LEU 106 HD12 LEU 106 23.548 -28.494 27.950 888 HD13 LEU 106 HD13 LEU 106 25.164 -28.057 28.527 889 HD21 LEU 106 HD21 LEU 106 21.635 -27.081 30.742 890 HD22 LEU 106 HD22 LEU 106 21.568 -27.980 29.225 891 HD23 LEU 106 HD23 LEU 106 22.193 -28.768 30.691 892 HA PRO 107 HA PRO 107 26.083 -26.893 35.575 893 HB2 PRO 107 HB2 PRO 107 28.553 -25.731 35.651 894 HB3 PRO 107 HB3 PRO 107 28.217 -27.271 34.802 895 HG2 PRO 107 HG2 PRO 107 28.358 -24.481 33.614 896 HG3 PRO 107 HG3 PRO 107 29.141 -25.980 33.019 897 HD2 PRO 107 HD2 PRO 107 26.777 -25.083 31.994 898 HD3 PRO 107 HD3 PRO 107 27.097 -26.827 32.187 Start of MODEL 15 1 H1 GLY -5 H1 GLY -5 -51.441 -4.804 15.822 2 H2 GLY -5 H2 GLY -5 -52.443 -5.457 14.701 3 H3 GLY -5 H3 GLY -5 -53.030 -5.001 16.162 4 HA2 GLY -5 HA2 GLY -5 -51.931 -3.172 14.126 5 HA3 GLY -5 HA3 GLY -5 -53.656 -3.406 14.464 6 H SER -4 H SER -4 -52.521 -0.902 14.583 7 HA SER -4 HA SER -4 -52.271 0.968 15.841 8 HB2 SER -4 HB2 SER -4 -54.345 -0.415 17.564 9 HB3 SER -4 HB3 SER -4 -54.030 1.329 17.483 10 HG SER -4 HG SER -4 -55.782 0.688 16.133 11 H HIS -3 H HIS -3 -50.096 -0.598 16.426 12 HA HIS -3 HA HIS -3 -49.787 -1.082 19.251 13 HB2 HIS -3 HB2 HIS -3 -48.692 -2.350 17.372 14 HB3 HIS -3 HB3 HIS -3 -47.596 -0.989 17.151 15 HD2 HIS -3 HD2 HIS -3 -45.925 -0.441 19.356 16 HE1 HIS -3 HE1 HIS -3 -46.367 -4.298 21.124 17 HE2 HIS -3 HE2 HIS -3 -45.018 -2.157 21.166 18 H MET -2 H MET -2 -49.638 0.448 20.702 19 HA MET -2 HA MET -2 -47.568 2.597 20.469 20 HB2 MET -2 HB2 MET -2 -50.471 2.938 21.332 21 HB3 MET -2 HB3 MET -2 -49.174 4.052 21.804 22 HG2 MET -2 HG2 MET -2 -48.670 4.539 19.457 23 HG3 MET -2 HG3 MET -2 -49.898 3.384 18.929 24 HE1 MET -2 HE1 MET -2 -49.220 6.784 20.778 25 HE2 MET -2 HE2 MET -2 -50.856 7.437 21.006 26 HE3 MET -2 HE3 MET -2 -50.327 6.039 21.956 27 H ALA -1 H ALA -1 -46.174 1.403 21.611 28 HA ALA -1 HA ALA -1 -46.330 1.589 24.461 29 HB1 ALA -1 HB1 ALA -1 -46.221 -1.198 23.193 30 HB2 ALA -1 HB2 ALA -1 -45.896 -0.831 24.900 31 HB3 ALA -1 HB3 ALA -1 -47.516 -0.570 24.232 32 H SER 0 H SER 0 -44.520 2.548 24.664 33 HA SER 0 HA SER 0 -41.975 1.155 23.894 34 HB2 SER 0 HB2 SER 0 -42.319 3.033 22.336 35 HB3 SER 0 HB3 SER 0 -42.432 4.155 23.702 36 HG SER 0 HG SER 0 -40.317 4.062 22.767 37 H MET 1 H MET 1 -43.355 3.684 25.998 38 HA MET 1 HA MET 1 -41.053 3.753 27.709 39 HB2 MET 1 HB2 MET 1 -43.852 4.886 28.103 40 HB3 MET 1 HB3 MET 1 -42.432 5.321 29.068 41 HG2 MET 1 HG2 MET 1 -41.315 6.139 26.986 42 HG3 MET 1 HG3 MET 1 -42.813 5.825 26.094 43 HE1 MET 1 HE1 MET 1 -42.636 8.376 25.233 44 HE2 MET 1 HE2 MET 1 -42.560 9.773 26.330 45 HE3 MET 1 HE3 MET 1 -41.194 8.641 26.242 46 H ASP 2 H ASP 2 -43.643 1.674 27.730 47 HA ASP 2 HA ASP 2 -43.043 0.647 30.479 48 HB2 ASP 2 HB2 ASP 2 -45.354 1.564 30.046 49 HB3 ASP 2 HB3 ASP 2 -45.577 0.309 28.832 50 H GLN 3 H GLN 3 -41.877 0.170 27.627 51 HA GLN 3 HA GLN 3 -41.947 -2.788 27.477 52 HB2 GLN 3 HB2 GLN 3 -43.974 -1.826 26.356 53 HB3 GLN 3 HB3 GLN 3 -42.930 -0.878 25.324 54 HG2 GLN 3 HG2 GLN 3 -42.109 -3.635 25.036 55 HG3 GLN 3 HG3 GLN 3 -43.866 -3.624 25.049 56 HE21 GLN 3 HE21 GLN 3 -42.082 -1.305 22.132 57 HE22 GLN 3 HE22 GLN 3 -41.235 -1.584 23.659 58 H LEU 4 H LEU 4 -39.758 -1.194 28.220 59 HA LEU 4 HA LEU 4 -37.914 -1.697 25.926 60 HB2 LEU 4 HB2 LEU 4 -38.739 0.856 26.918 61 HB3 LEU 4 HB3 LEU 4 -37.109 0.624 27.496 62 HG LEU 4 HG LEU 4 -36.335 0.194 25.166 63 HD11 LEU 4 HD11 LEU 4 -39.249 0.750 24.463 64 HD12 LEU 4 HD12 LEU 4 -37.916 0.839 23.286 65 HD13 LEU 4 HD13 LEU 4 -38.308 -0.694 24.064 66 HD21 LEU 4 HD21 LEU 4 -36.323 2.479 26.127 67 HD22 LEU 4 HD22 LEU 4 -36.595 2.507 24.377 68 HD23 LEU 4 HD23 LEU 4 -37.961 2.751 25.488 69 H ASP 5 H ASP 5 -38.472 -2.773 28.932 70 HA ASP 5 HA ASP 5 -35.886 -2.242 30.134 71 HB2 ASP 5 HB2 ASP 5 -38.291 -3.841 31.078 72 HB3 ASP 5 HB3 ASP 5 -36.863 -3.512 32.055 73 H GLU 6 H GLU 6 -37.346 -5.142 28.707 74 HA GLU 6 HA GLU 6 -34.766 -6.615 29.076 75 HB2 GLU 6 HB2 GLU 6 -35.974 -8.605 29.605 76 HB3 GLU 6 HB3 GLU 6 -36.441 -7.335 30.717 77 HG2 GLU 6 HG2 GLU 6 -38.112 -8.149 28.290 78 HG3 GLU 6 HG3 GLU 6 -38.290 -8.851 29.888 79 H ILE 7 H ILE 7 -36.056 -5.146 26.716 80 HA ILE 7 HA ILE 7 -36.864 -7.141 24.810 81 HB ILE 7 HB ILE 7 -36.008 -4.283 24.274 82 HG12 ILE 7 HG12 ILE 7 -37.675 -4.131 25.996 83 HG13 ILE 7 HG13 ILE 7 -38.332 -3.603 24.459 84 HG21 ILE 7 HG21 ILE 7 -37.788 -6.195 22.707 85 HG22 ILE 7 HG22 ILE 7 -37.600 -4.466 22.353 86 HG23 ILE 7 HG23 ILE 7 -36.213 -5.543 22.214 87 HD11 ILE 7 HD11 ILE 7 -38.852 -6.314 25.748 88 HD12 ILE 7 HD12 ILE 7 -39.961 -4.932 25.721 89 HD13 ILE 7 HD13 ILE 7 -39.539 -5.748 24.206 90 H ILE 8 H ILE 8 -35.748 -8.311 23.383 91 HA ILE 8 HA ILE 8 -33.251 -7.359 22.235 92 HB ILE 8 HB ILE 8 -32.381 -8.494 24.190 93 HG12 ILE 8 HG12 ILE 8 -30.890 -10.166 23.172 94 HG13 ILE 8 HG13 ILE 8 -31.864 -10.175 21.703 95 HG21 ILE 8 HG21 ILE 8 -33.723 -11.067 23.272 96 HG22 ILE 8 HG22 ILE 8 -32.647 -10.854 24.662 97 HG23 ILE 8 HG23 ILE 8 -34.232 -10.078 24.660 98 HD11 ILE 8 HD11 ILE 8 -30.398 -7.741 22.829 99 HD12 ILE 8 HD12 ILE 8 -29.802 -8.786 21.525 100 HD13 ILE 8 HD13 ILE 8 -31.260 -7.815 21.273 101 H GLU 9 H GLU 9 -33.242 -7.759 20.122 102 HA GLU 9 HA GLU 9 -34.287 -10.159 18.881 103 HB2 GLU 9 HB2 GLU 9 -36.000 -9.039 17.495 104 HB3 GLU 9 HB3 GLU 9 -36.430 -9.082 19.196 105 HG2 GLU 9 HG2 GLU 9 -35.750 -6.696 19.440 106 HG3 GLU 9 HG3 GLU 9 -35.299 -6.656 17.734 107 H GLN 10 H GLN 10 -33.916 -10.219 16.562 108 HA GLN 10 HA GLN 10 -31.842 -8.343 15.572 109 HB2 GLN 10 HB2 GLN 10 -31.295 -9.800 13.930 110 HB3 GLN 10 HB3 GLN 10 -31.443 -10.802 15.369 111 HG2 GLN 10 HG2 GLN 10 -33.620 -10.543 13.233 112 HG3 GLN 10 HG3 GLN 10 -32.309 -11.696 13.140 113 HE21 GLN 10 HE21 GLN 10 -34.370 -14.054 14.751 114 HE22 GLN 10 HE22 GLN 10 -33.383 -13.671 13.341 115 H ILE 11 H ILE 11 -32.033 -8.003 13.135 116 HA ILE 11 HA ILE 11 -34.586 -6.650 12.576 117 HB ILE 11 HB ILE 11 -32.506 -5.407 13.181 118 HG12 ILE 11 HG12 ILE 11 -32.529 -3.760 11.466 119 HG13 ILE 11 HG13 ILE 11 -33.391 -4.846 10.376 120 HG21 ILE 11 HG21 ILE 11 -31.409 -6.387 10.504 121 HG22 ILE 11 HG22 ILE 11 -30.660 -5.200 11.584 122 HG23 ILE 11 HG23 ILE 11 -30.809 -6.876 12.104 123 HD11 ILE 11 HD11 ILE 11 -34.497 -3.819 13.034 124 HD12 ILE 11 HD12 ILE 11 -34.859 -3.100 11.452 125 HD13 ILE 11 HD13 ILE 11 -35.394 -4.748 11.807 126 H GLN 12 H GLN 12 -33.719 -9.495 11.765 127 HA GLN 12 HA GLN 12 -34.298 -9.344 8.855 128 HB2 GLN 12 HB2 GLN 12 -32.401 -10.818 8.373 129 HB3 GLN 12 HB3 GLN 12 -31.879 -9.280 9.074 130 HG2 GLN 12 HG2 GLN 12 -31.571 -10.366 11.278 131 HG3 GLN 12 HG3 GLN 12 -32.115 -11.909 10.614 132 HE21 GLN 12 HE21 GLN 12 -28.479 -12.176 10.675 133 HE22 GLN 12 HE22 GLN 12 -29.836 -12.207 11.792 134 H LYS 13 H LYS 13 -34.873 -11.407 7.903 135 HA LYS 13 HA LYS 13 -36.605 -12.996 9.672 136 HB2 LYS 13 HB2 LYS 13 -36.203 -13.078 6.656 137 HB3 LYS 13 HB3 LYS 13 -37.406 -14.005 7.561 138 HG2 LYS 13 HG2 LYS 13 -38.404 -11.861 8.400 139 HG3 LYS 13 HG3 LYS 13 -37.252 -10.964 7.405 140 HD2 LYS 13 HD2 LYS 13 -39.326 -11.025 6.232 141 HD3 LYS 13 HD3 LYS 13 -38.193 -12.067 5.362 142 HE2 LYS 13 HE2 LYS 13 -39.222 -14.070 6.410 143 HE3 LYS 13 HE3 LYS 13 -40.304 -13.033 7.349 144 HZ1 LYS 13 HZ1 LYS 13 -40.279 -13.221 4.382 145 HZ2 LYS 13 HZ2 LYS 13 -41.401 -13.889 5.360 146 HZ3 LYS 13 HZ3 LYS 13 -41.282 -12.267 5.252 147 H GLU 14 H GLU 14 -33.486 -13.289 9.492 148 HA GLU 14 HA GLU 14 -33.328 -16.235 9.188 149 HB2 GLU 14 HB2 GLU 14 -31.225 -14.052 9.012 150 HB3 GLU 14 HB3 GLU 14 -30.819 -15.737 9.335 151 HG2 GLU 14 HG2 GLU 14 -30.551 -15.414 7.012 152 HG3 GLU 14 HG3 GLU 14 -31.943 -16.453 7.272 153 H ALA 15 H ALA 15 -32.746 -17.434 10.758 154 HA ALA 15 HA ALA 15 -31.652 -16.461 13.299 155 HB1 ALA 15 HB1 ALA 15 -34.327 -17.923 13.183 156 HB2 ALA 15 HB2 ALA 15 -33.393 -17.597 14.666 157 HB3 ALA 15 HB3 ALA 15 -34.051 -16.255 13.711 158 H ILE 16 H ILE 16 -33.259 -19.529 12.679 159 HA ILE 16 HA ILE 16 -30.673 -20.994 12.909 160 HB ILE 16 HB ILE 16 -33.346 -21.375 14.251 161 HG12 ILE 16 HG12 ILE 16 -30.549 -21.003 15.416 162 HG13 ILE 16 HG13 ILE 16 -31.762 -19.738 15.260 163 HG21 ILE 16 HG21 ILE 16 -31.023 -23.349 14.316 164 HG22 ILE 16 HG22 ILE 16 -32.420 -23.408 15.416 165 HG23 ILE 16 HG23 ILE 16 -32.671 -23.653 13.711 166 HD11 ILE 16 HD11 ILE 16 -31.898 -22.116 17.124 167 HD12 ILE 16 HD12 ILE 16 -31.801 -20.398 17.515 168 HD13 ILE 16 HD13 ILE 16 -33.281 -21.043 16.780 169 H ASN 17 H ASN 17 -32.697 -20.265 10.677 170 HA ASN 17 HA ASN 17 -33.293 -22.961 9.648 171 HB2 ASN 17 HB2 ASN 17 -34.161 -20.218 8.640 172 HB3 ASN 17 HB3 ASN 17 -34.738 -21.758 8.012 173 HD21 ASN 17 HD21 ASN 17 -36.709 -20.229 11.083 174 HD22 ASN 17 HD22 ASN 17 -35.674 -19.304 10.009 175 H SER 18 H SER 18 -30.663 -21.071 9.405 176 HA SER 18 HA SER 18 -29.996 -21.852 6.575 177 HB2 SER 18 HB2 SER 18 -28.565 -19.816 6.561 178 HB3 SER 18 HB3 SER 18 -30.298 -19.480 6.716 179 HG SER 18 HG SER 18 -29.000 -18.260 8.201 180 H ASN 19 H ASN 19 -28.441 -21.120 9.719 181 HA ASN 19 HA ASN 19 -25.961 -22.375 9.119 182 HB2 ASN 19 HB2 ASN 19 -25.548 -22.124 11.551 183 HB3 ASN 19 HB3 ASN 19 -26.190 -20.652 10.833 184 HD21 ASN 19 HD21 ASN 19 -28.024 -21.106 13.994 185 HD22 ASN 19 HD22 ASN 19 -26.327 -20.881 13.566 186 H VAL 20 H VAL 20 -28.886 -23.741 10.340 187 HA VAL 20 HA VAL 20 -27.668 -26.384 10.884 188 HB VAL 20 HB VAL 20 -30.555 -25.453 11.018 189 HG11 VAL 20 HG11 VAL 20 -29.311 -28.082 11.937 190 HG12 VAL 20 HG12 VAL 20 -30.940 -27.518 12.373 191 HG13 VAL 20 HG13 VAL 20 -30.566 -27.878 10.691 192 HG21 VAL 20 HG21 VAL 20 -29.136 -24.408 12.746 193 HG22 VAL 20 HG22 VAL 20 -30.203 -25.602 13.475 194 HG23 VAL 20 HG23 VAL 20 -28.492 -25.998 13.205 195 H VAL 21 H VAL 21 -29.288 -24.792 8.232 196 HA VAL 21 HA VAL 21 -29.464 -27.349 6.686 197 HB VAL 21 HB VAL 21 -31.477 -25.085 6.486 198 HG11 VAL 21 HG11 VAL 21 -31.498 -27.974 5.482 199 HG12 VAL 21 HG12 VAL 21 -32.801 -26.784 5.275 200 HG13 VAL 21 HG13 VAL 21 -31.251 -26.538 4.467 201 HG21 VAL 21 HG21 VAL 21 -31.769 -26.072 8.700 202 HG22 VAL 21 HG22 VAL 21 -33.058 -26.628 7.638 203 HG23 VAL 21 HG23 VAL 21 -31.699 -27.712 8.014 204 H LEU 22 H LEU 22 -27.309 -26.758 6.052 205 HA LEU 22 HA LEU 22 -27.208 -24.768 3.831 206 HB2 LEU 22 HB2 LEU 22 -25.750 -24.789 6.298 207 HB3 LEU 22 HB3 LEU 22 -24.602 -25.220 5.047 208 HG LEU 22 HG LEU 22 -26.406 -22.757 4.958 209 HD11 LEU 22 HD11 LEU 22 -23.458 -23.009 5.699 210 HD12 LEU 22 HD12 LEU 22 -24.381 -21.494 5.554 211 HD13 LEU 22 HD13 LEU 22 -24.790 -22.657 6.823 212 HD21 LEU 22 HD21 LEU 22 -25.671 -23.410 2.707 213 HD22 LEU 22 HD22 LEU 22 -24.811 -21.967 3.229 214 HD23 LEU 22 HD23 LEU 22 -23.983 -23.535 3.273 215 H LYS 23 H LYS 23 -26.162 -25.314 1.982 216 HA LYS 23 HA LYS 23 -25.324 -28.165 1.631 217 HB2 LYS 23 HB2 LYS 23 -26.766 -26.267 -0.259 218 HB3 LYS 23 HB3 LYS 23 -26.095 -27.826 -0.758 219 HG2 LYS 23 HG2 LYS 23 -27.485 -29.004 0.903 220 HG3 LYS 23 HG3 LYS 23 -28.224 -27.464 1.391 221 HD2 LYS 23 HD2 LYS 23 -29.133 -27.138 -0.863 222 HD3 LYS 23 HD3 LYS 23 -28.306 -28.601 -1.442 223 HE2 LYS 23 HE2 LYS 23 -29.605 -29.982 0.151 224 HE3 LYS 23 HE3 LYS 23 -30.431 -28.537 0.750 225 HZ1 LYS 23 HZ1 LYS 23 -30.588 -29.544 -2.046 226 HZ2 LYS 23 HZ2 LYS 23 -31.759 -29.709 -0.923 227 HZ3 LYS 23 HZ3 LYS 23 -31.369 -28.225 -1.477 228 H ASN 24 H ASN 24 -23.655 -25.696 2.253 229 HA ASN 24 HA ASN 24 -21.466 -26.485 0.415 230 HB2 ASN 24 HB2 ASN 24 -22.465 -24.434 -0.530 231 HB3 ASN 24 HB3 ASN 24 -22.221 -23.590 1.002 232 HD21 ASN 24 HD21 ASN 24 -18.874 -24.477 -1.246 233 HD22 ASN 24 HD22 ASN 24 -20.211 -25.616 -1.248 234 HA PRO 25 HA PRO 25 -19.996 -26.200 4.796 235 HB2 PRO 25 HB2 PRO 25 -19.923 -28.759 5.668 236 HB3 PRO 25 HB3 PRO 25 -21.475 -27.883 5.529 237 HG2 PRO 25 HG2 PRO 25 -20.238 -29.770 3.479 238 HG3 PRO 25 HG3 PRO 25 -21.888 -29.839 4.178 239 HD2 PRO 25 HD2 PRO 25 -21.347 -28.592 1.789 240 HD3 PRO 25 HD3 PRO 25 -22.610 -28.021 2.923 241 H ARG 26 H ARG 26 -18.478 -25.600 2.878 242 HA ARG 26 HA ARG 26 -16.014 -27.317 2.932 243 HB2 ARG 26 HB2 ARG 26 -17.492 -26.280 0.496 244 HB3 ARG 26 HB3 ARG 26 -15.807 -26.848 0.452 245 HG2 ARG 26 HG2 ARG 26 -16.563 -29.058 1.355 246 HG3 ARG 26 HG3 ARG 26 -18.244 -28.495 1.262 247 HD2 ARG 26 HD2 ARG 26 -18.000 -28.165 -1.179 248 HD3 ARG 26 HD3 ARG 26 -16.323 -28.747 -1.084 249 HE ARG 26 HE ARG 26 -18.019 -30.708 0.090 250 HH11 ARG 26 HH11 ARG 26 -18.603 -32.575 -0.961 251 HH12 ARG 26 HH12 ARG 26 -18.512 -32.663 -2.695 252 HH21 ARG 26 HH21 ARG 26 -17.360 -29.460 -3.119 253 HH22 ARG 26 HH22 ARG 26 -17.828 -30.951 -3.892 254 H VAL 27 H VAL 27 -16.667 -24.331 1.108 255 HA VAL 27 HA VAL 27 -14.613 -22.883 2.727 256 HB VAL 27 HB VAL 27 -14.473 -23.120 -0.301 257 HG11 VAL 27 HG11 VAL 27 -12.625 -21.772 1.727 258 HG12 VAL 27 HG12 VAL 27 -12.326 -21.918 -0.018 259 HG13 VAL 27 HG13 VAL 27 -13.666 -20.930 0.559 260 HG21 VAL 27 HG21 VAL 27 -13.686 -25.218 0.667 261 HG22 VAL 27 HG22 VAL 27 -12.314 -24.275 0.094 262 HG23 VAL 27 HG23 VAL 27 -12.672 -24.334 1.833 263 HA PRO 28 HA PRO 28 -17.958 -19.935 1.700 264 HB2 PRO 28 HB2 PRO 28 -18.000 -18.478 3.984 265 HB3 PRO 28 HB3 PRO 28 -18.781 -20.085 3.832 266 HG2 PRO 28 HG2 PRO 28 -16.087 -19.424 5.041 267 HG3 PRO 28 HG3 PRO 28 -17.346 -20.520 5.682 268 HD2 PRO 28 HD2 PRO 28 -15.151 -21.399 4.258 269 HD3 PRO 28 HD3 PRO 28 -16.725 -22.245 4.228 270 H THR 29 H THR 29 -18.031 -17.707 1.345 271 HA THR 29 HA THR 29 -15.595 -16.618 0.244 272 HB THR 29 HB THR 29 -17.304 -14.867 -0.576 273 HG1 THR 29 HG1 THR 29 -19.443 -15.522 -0.436 274 HG21 THR 29 HG21 THR 29 -17.752 -17.799 -1.284 275 HG22 THR 29 HG22 THR 29 -18.208 -16.396 -2.276 276 HG23 THR 29 HG23 THR 29 -16.499 -16.745 -1.974 277 H GLN 30 H GLN 30 -14.817 -16.545 2.554 278 HA GLN 30 HA GLN 30 -15.606 -14.219 4.056 279 HB2 GLN 30 HB2 GLN 30 -14.288 -15.208 5.848 280 HB3 GLN 30 HB3 GLN 30 -15.169 -16.486 5.015 281 HG2 GLN 30 HG2 GLN 30 -12.904 -16.655 3.570 282 HG3 GLN 30 HG3 GLN 30 -12.209 -15.863 4.979 283 HE21 GLN 30 HE21 GLN 30 -13.373 -19.793 5.165 284 HE22 GLN 30 HE22 GLN 30 -13.861 -18.801 3.790 285 H LYS 31 H LYS 31 -14.091 -13.775 1.551 286 HA LYS 31 HA LYS 31 -11.405 -12.931 2.330 287 HB2 LYS 31 HB2 LYS 31 -12.317 -14.313 0.291 288 HB3 LYS 31 HB3 LYS 31 -12.546 -12.757 -0.469 289 HG2 LYS 31 HG2 LYS 31 -9.935 -13.974 0.562 290 HG3 LYS 31 HG3 LYS 31 -10.459 -13.859 -1.105 291 HD2 LYS 31 HD2 LYS 31 -9.012 -12.117 -1.126 292 HD3 LYS 31 HD3 LYS 31 -10.458 -11.247 -0.660 293 HE2 LYS 31 HE2 LYS 31 -8.757 -10.450 0.775 294 HE3 LYS 31 HE3 LYS 31 -9.691 -11.548 1.789 295 HZ1 LYS 31 HZ1 LYS 31 -7.126 -12.217 0.430 296 HZ2 LYS 31 HZ2 LYS 31 -7.293 -11.923 2.023 297 HZ3 LYS 31 HZ3 LYS 31 -7.968 -13.254 1.368 298 H THR 32 H THR 32 -12.569 -11.262 3.734 299 HA THR 32 HA THR 32 -12.591 -8.618 2.338 300 HB THR 32 HB THR 32 -14.863 -9.667 2.463 301 HG1 THR 32 HG1 THR 32 -15.858 -7.769 3.083 302 HG21 THR 32 HG21 THR 32 -14.704 -9.059 5.443 303 HG22 THR 32 HG22 THR 32 -16.121 -9.626 4.537 304 HG23 THR 32 HG23 THR 32 -14.716 -10.684 4.723 305 H GLY 33 H GLY 33 -10.891 -10.109 4.520 306 HA2 GLY 33 HA2 GLY 33 -11.229 -8.737 6.984 307 HA3 GLY 33 HA3 GLY 33 -9.804 -9.648 6.492 308 H GLU 34 H GLU 34 -8.837 -8.117 4.385 309 HA GLU 34 HA GLU 34 -8.252 -5.399 5.532 310 HB2 GLU 34 HB2 GLU 34 -6.275 -7.490 4.559 311 HB3 GLU 34 HB3 GLU 34 -5.858 -5.792 4.742 312 HG2 GLU 34 HG2 GLU 34 -6.911 -7.463 7.062 313 HG3 GLU 34 HG3 GLU 34 -5.215 -7.384 6.629 314 H LEU 35 H LEU 35 -7.676 -7.418 2.634 315 HA LEU 35 HA LEU 35 -8.206 -5.125 0.845 316 HB2 LEU 35 HB2 LEU 35 -6.292 -7.465 0.802 317 HB3 LEU 35 HB3 LEU 35 -7.013 -6.966 -0.720 318 HG LEU 35 HG LEU 35 -6.175 -4.742 -0.508 319 HD11 LEU 35 HD11 LEU 35 -4.867 -5.593 2.098 320 HD12 LEU 35 HD12 LEU 35 -4.470 -4.111 1.202 321 HD13 LEU 35 HD13 LEU 35 -6.084 -4.310 1.879 322 HD21 LEU 35 HD21 LEU 35 -4.832 -6.482 -1.596 323 HD22 LEU 35 HD22 LEU 35 -3.831 -5.210 -0.883 324 HD23 LEU 35 HD23 LEU 35 -3.992 -6.781 -0.060 325 H SER 36 H SER 36 -10.152 -5.184 0.147 326 HA SER 36 HA SER 36 -11.490 -7.763 -0.528 327 HB2 SER 36 HB2 SER 36 -13.603 -6.681 -0.539 328 HB3 SER 36 HB3 SER 36 -12.793 -6.439 1.015 329 HG SER 36 HG SER 36 -13.767 -4.521 0.253 330 H GLU 37 H GLU 37 -11.578 -4.566 -1.973 331 HA GLU 37 HA GLU 37 -10.852 -5.701 -4.622 332 HB2 GLU 37 HB2 GLU 37 -13.007 -5.489 -5.592 333 HB3 GLU 37 HB3 GLU 37 -13.253 -6.328 -4.048 334 HG2 GLU 37 HG2 GLU 37 -13.984 -4.175 -3.023 335 HG3 GLU 37 HG3 GLU 37 -13.840 -3.398 -4.604 336 H GLU 38 H GLU 38 -11.755 -2.870 -2.733 337 HA GLU 38 HA GLU 38 -10.905 -1.051 -4.901 338 HB2 GLU 38 HB2 GLU 38 -12.812 -0.632 -3.242 339 HB3 GLU 38 HB3 GLU 38 -11.577 -0.440 -2.002 340 HG2 GLU 38 HG2 GLU 38 -12.169 1.729 -2.712 341 HG3 GLU 38 HG3 GLU 38 -10.578 1.424 -3.393 342 H GLN 39 H GLN 39 -9.557 -2.642 -2.053 343 HA GLN 39 HA GLN 39 -7.498 -0.660 -1.574 344 HB2 GLN 39 HB2 GLN 39 -7.845 -3.481 -0.530 345 HB3 GLN 39 HB3 GLN 39 -6.706 -2.296 0.106 346 HG2 GLN 39 HG2 GLN 39 -8.555 -2.249 1.589 347 HG3 GLN 39 HG3 GLN 39 -8.737 -0.804 0.595 348 HE21 GLN 39 HE21 GLN 39 -12.095 -1.923 0.243 349 HE22 GLN 39 HE22 GLN 39 -11.026 -0.738 1.029 350 H LYS 40 H LYS 40 -7.520 -3.849 -3.136 351 HA LYS 40 HA LYS 40 -4.703 -3.820 -3.835 352 HB2 LYS 40 HB2 LYS 40 -5.219 -5.751 -5.211 353 HB3 LYS 40 HB3 LYS 40 -5.986 -5.877 -3.630 354 HG2 LYS 40 HG2 LYS 40 -8.122 -4.921 -4.792 355 HG3 LYS 40 HG3 LYS 40 -7.260 -5.198 -6.306 356 HD2 LYS 40 HD2 LYS 40 -8.819 -7.022 -5.789 357 HD3 LYS 40 HD3 LYS 40 -7.153 -7.616 -5.818 358 HE2 LYS 40 HE2 LYS 40 -7.069 -7.665 -3.364 359 HE3 LYS 40 HE3 LYS 40 -8.637 -6.864 -3.247 360 HZ1 LYS 40 HZ1 LYS 40 -8.244 -9.546 -4.470 361 HZ2 LYS 40 HZ2 LYS 40 -8.788 -9.285 -2.948 362 HZ3 LYS 40 HZ3 LYS 40 -9.681 -8.789 -4.208 363 H LYS 41 H LYS 41 -7.600 -2.529 -5.431 364 HA LYS 41 HA LYS 41 -6.236 -1.623 -7.820 365 HB2 LYS 41 HB2 LYS 41 -8.738 -0.553 -6.463 366 HB3 LYS 41 HB3 LYS 41 -8.140 -0.017 -8.030 367 HG2 LYS 41 HG2 LYS 41 -8.355 -2.282 -8.944 368 HG3 LYS 41 HG3 LYS 41 -8.912 -2.879 -7.373 369 HD2 LYS 41 HD2 LYS 41 -10.860 -1.312 -7.487 370 HD3 LYS 41 HD3 LYS 41 -10.313 -0.779 -9.092 371 HE2 LYS 41 HE2 LYS 41 -10.515 -3.131 -9.911 372 HE3 LYS 41 HE3 LYS 41 -11.086 -3.627 -8.310 373 HZ1 LYS 41 HZ1 LYS 41 -12.468 -1.681 -10.083 374 HZ2 LYS 41 HZ2 LYS 41 -12.941 -3.221 -9.830 375 HZ3 LYS 41 HZ3 LYS 41 -12.996 -2.142 -8.607 376 H ILE 42 H ILE 42 -5.743 -0.605 -4.645 377 HA ILE 42 HA ILE 42 -4.333 1.853 -5.610 378 HB ILE 42 HB ILE 42 -5.120 0.976 -2.827 379 HG12 ILE 42 HG12 ILE 42 -5.997 3.614 -3.956 380 HG13 ILE 42 HG13 ILE 42 -6.712 2.220 -4.739 381 HG21 ILE 42 HG21 ILE 42 -3.601 3.486 -3.647 382 HG22 ILE 42 HG22 ILE 42 -4.250 3.143 -2.027 383 HG23 ILE 42 HG23 ILE 42 -2.969 2.132 -2.692 384 HD11 ILE 42 HD11 ILE 42 -6.778 2.726 -1.757 385 HD12 ILE 42 HD12 ILE 42 -8.132 2.906 -2.909 386 HD13 ILE 42 HD13 ILE 42 -7.438 1.307 -2.589 387 H VAL 43 H VAL 43 -3.738 -1.033 -3.460 388 HA VAL 43 HA VAL 43 -0.931 -0.517 -3.336 389 HB VAL 43 HB VAL 43 -2.371 -3.148 -2.870 390 HG11 VAL 43 HG11 VAL 43 0.379 -2.195 -1.939 391 HG12 VAL 43 HG12 VAL 43 -0.419 -3.701 -1.437 392 HG13 VAL 43 HG13 VAL 43 0.071 -3.496 -3.110 393 HG21 VAL 43 HG21 VAL 43 -3.219 -1.341 -1.396 394 HG22 VAL 43 HG22 VAL 43 -2.311 -2.543 -0.485 395 HG23 VAL 43 HG23 VAL 43 -1.557 -0.983 -0.879 396 H ALA 44 H ALA 44 -2.649 -3.020 -5.325 397 HA ALA 44 HA ALA 44 -0.166 -3.958 -6.473 398 HB1 ALA 44 HB1 ALA 44 -3.018 -4.397 -7.450 399 HB2 ALA 44 HB2 ALA 44 -1.583 -5.344 -7.877 400 HB3 ALA 44 HB3 ALA 44 -2.193 -5.375 -6.211 401 H ASP 45 H ASP 45 -2.681 -1.674 -7.542 402 HA ASP 45 HA ASP 45 -1.564 -0.984 -10.081 403 HB2 ASP 45 HB2 ASP 45 -3.812 -0.324 -9.241 404 HB3 ASP 45 HB3 ASP 45 -3.045 0.783 -8.098 405 H TYR 46 H TYR 46 -0.778 0.394 -6.826 406 HA TYR 46 HA TYR 46 1.099 2.311 -7.802 407 HB2 TYR 46 HB2 TYR 46 -0.163 2.212 -5.603 408 HB3 TYR 46 HB3 TYR 46 0.995 1.008 -5.048 409 HD1 TYR 46 HD1 TYR 46 0.725 2.938 -3.265 410 HD2 TYR 46 HD2 TYR 46 2.904 3.315 -6.942 411 HE1 TYR 46 HE1 TYR 46 1.857 4.985 -2.389 412 HE2 TYR 46 HE2 TYR 46 4.123 5.226 -6.062 413 HH TYR 46 HH TYR 46 3.337 6.697 -2.856 414 H ILE 47 H ILE 47 1.471 -1.060 -6.689 415 HA ILE 47 HA ILE 47 4.312 -1.182 -6.807 416 HB ILE 47 HB ILE 47 1.979 -3.049 -6.712 417 HG12 ILE 47 HG12 ILE 47 3.241 -4.186 -4.998 418 HG13 ILE 47 HG13 ILE 47 4.713 -3.351 -5.461 419 HG21 ILE 47 HG21 ILE 47 4.569 -4.141 -7.833 420 HG22 ILE 47 HG22 ILE 47 3.223 -5.104 -7.198 421 HG23 ILE 47 HG23 ILE 47 2.979 -4.113 -8.639 422 HD11 ILE 47 HD11 ILE 47 2.284 -2.157 -4.070 423 HD12 ILE 47 HD12 ILE 47 3.940 -2.341 -3.455 424 HD13 ILE 47 HD13 ILE 47 3.587 -1.170 -4.738 425 H SER 48 H SER 48 1.940 -1.470 -9.452 426 HA SER 48 HA SER 48 3.909 -2.039 -11.477 427 HB2 SER 48 HB2 SER 48 1.137 -0.820 -11.713 428 HB3 SER 48 HB3 SER 48 2.137 -1.365 -13.069 429 HG SER 48 HG SER 48 0.642 -2.973 -12.371 430 H GLU 49 H GLU 49 3.401 0.953 -9.757 431 HA GLU 49 HA GLU 49 4.378 2.617 -12.015 432 HB2 GLU 49 HB2 GLU 49 3.627 3.303 -9.146 433 HB3 GLU 49 HB3 GLU 49 4.093 4.468 -10.384 434 HG2 GLU 49 HG2 GLU 49 1.698 2.621 -10.488 435 HG3 GLU 49 HG3 GLU 49 1.652 4.294 -9.961 436 H VAL 50 H VAL 50 5.399 1.569 -8.775 437 HA VAL 50 HA VAL 50 8.133 2.628 -9.340 438 HB VAL 50 HB VAL 50 7.418 2.749 -6.490 439 HG11 VAL 50 HG11 VAL 50 8.153 4.926 -8.495 440 HG12 VAL 50 HG12 VAL 50 8.332 4.984 -6.727 441 HG13 VAL 50 HG13 VAL 50 9.351 3.898 -7.689 442 HG21 VAL 50 HG21 VAL 50 5.203 3.098 -7.127 443 HG22 VAL 50 HG22 VAL 50 5.999 4.571 -6.511 444 HG23 VAL 50 HG23 VAL 50 5.687 4.417 -8.257 445 H GLY 51 H GLY 51 6.596 -0.258 -8.360 446 HA2 GLY 51 HA2 GLY 51 8.214 -2.126 -8.774 447 HA3 GLY 51 HA3 GLY 51 9.277 -1.380 -7.573 448 H LEU 52 H LEU 52 8.441 -1.070 -5.464 449 HA LEU 52 HA LEU 52 6.255 -2.476 -4.285 450 HB2 LEU 52 HB2 LEU 52 7.565 -4.468 -4.967 451 HB3 LEU 52 HB3 LEU 52 8.995 -3.870 -4.158 452 HG LEU 52 HG LEU 52 6.555 -4.121 -2.466 453 HD11 LEU 52 HD11 LEU 52 8.026 -6.543 -3.599 454 HD12 LEU 52 HD12 LEU 52 6.873 -6.612 -2.255 455 HD13 LEU 52 HD13 LEU 52 6.316 -6.127 -3.859 456 HD21 LEU 52 HD21 LEU 52 8.706 -3.543 -1.424 457 HD22 LEU 52 HD22 LEU 52 8.146 -5.096 -0.844 458 HD23 LEU 52 HD23 LEU 52 9.434 -5.039 -2.061 459 H ASN 53 H ASN 53 9.540 -1.551 -3.851 460 HA ASN 53 HA ASN 53 9.141 -0.714 -1.053 461 HB2 ASN 53 HB2 ASN 53 11.460 -1.158 -0.767 462 HB3 ASN 53 HB3 ASN 53 10.796 -2.475 -1.729 463 HD21 ASN 53 HD21 ASN 53 12.974 -1.878 -4.441 464 HD22 ASN 53 HD22 ASN 53 11.711 -2.891 -3.771 465 H ASN 54 H ASN 54 9.445 0.896 -4.021 466 HA ASN 54 HA ASN 54 10.885 3.225 -2.929 467 HB2 ASN 54 HB2 ASN 54 9.716 2.727 -5.681 468 HB3 ASN 54 HB3 ASN 54 10.765 4.072 -5.239 469 HD21 ASN 54 HD21 ASN 54 12.402 0.557 -6.269 470 HD22 ASN 54 HD22 ASN 54 10.714 0.985 -6.554 471 H LEU 55 H LEU 55 7.566 2.313 -3.473 472 HA LEU 55 HA LEU 55 6.321 4.898 -3.302 473 HB2 LEU 55 HB2 LEU 55 4.340 3.609 -2.765 474 HB3 LEU 55 HB3 LEU 55 5.207 2.917 -4.124 475 HG LEU 55 HG LEU 55 6.209 1.365 -2.104 476 HD11 LEU 55 HD11 LEU 55 3.378 2.110 -1.220 477 HD12 LEU 55 HD12 LEU 55 4.333 0.749 -0.603 478 HD13 LEU 55 HD13 LEU 55 4.869 2.404 -0.300 479 HD21 LEU 55 HD21 LEU 55 5.113 0.555 -4.145 480 HD22 LEU 55 HD22 LEU 55 4.489 -0.268 -2.710 481 HD23 LEU 55 HD23 LEU 55 3.521 1.004 -3.491 482 H ASN 56 H ASN 56 4.927 5.590 -1.410 483 HA ASN 56 HA ASN 56 6.225 4.999 1.196 484 HB2 ASN 56 HB2 ASN 56 6.042 7.190 1.932 485 HB3 ASN 56 HB3 ASN 56 6.712 7.303 0.318 486 HD21 ASN 56 HD21 ASN 56 4.363 9.978 0.140 487 HD22 ASN 56 HD22 ASN 56 6.048 9.574 0.451 488 H ALA 57 H ALA 57 4.850 5.358 3.047 489 HA ALA 57 HA ALA 57 2.457 3.731 2.812 490 HB1 ALA 57 HB1 ALA 57 3.873 5.153 5.103 491 HB2 ALA 57 HB2 ALA 57 2.583 3.951 5.294 492 HB3 ALA 57 HB3 ALA 57 4.133 3.473 4.571 493 H THR 58 H THR 58 3.103 7.184 3.274 494 HA THR 58 HA THR 58 0.632 8.095 4.264 495 HB THR 58 HB THR 58 2.505 9.518 2.330 496 HG1 THR 58 HG1 THR 58 3.537 10.219 4.214 497 HG21 THR 58 HG21 THR 58 0.588 10.579 4.448 498 HG22 THR 58 HG22 THR 58 1.788 11.559 3.568 499 HG23 THR 58 HG23 THR 58 0.466 10.789 2.685 500 H GLU 59 H GLU 59 1.673 7.716 0.842 501 HA GLU 59 HA GLU 59 -0.829 8.562 -0.256 502 HB2 GLU 59 HB2 GLU 59 1.469 6.889 -1.332 503 HB3 GLU 59 HB3 GLU 59 0.106 7.354 -2.346 504 HG2 GLU 59 HG2 GLU 59 1.893 9.379 -0.922 505 HG3 GLU 59 HG3 GLU 59 2.198 8.770 -2.543 506 H LEU 60 H LEU 60 0.070 5.432 1.049 507 HA LEU 60 HA LEU 60 -2.273 4.059 -0.094 508 HB2 LEU 60 HB2 LEU 60 -0.428 3.292 2.204 509 HB3 LEU 60 HB3 LEU 60 -1.716 2.289 1.556 510 HG LEU 60 HG LEU 60 0.792 3.149 0.051 511 HD11 LEU 60 HD11 LEU 60 -0.117 0.427 1.090 512 HD12 LEU 60 HD12 LEU 60 1.397 0.787 0.230 513 HD13 LEU 60 HD13 LEU 60 1.117 1.452 1.849 514 HD21 LEU 60 HD21 LEU 60 -1.000 2.898 -1.560 515 HD22 LEU 60 HD22 LEU 60 -0.008 1.432 -1.627 516 HD23 LEU 60 HD23 LEU 60 -1.568 1.404 -0.776 517 H SER 61 H SER 61 -1.418 5.409 3.162 518 HA SER 61 HA SER 61 -3.885 4.772 4.390 519 HB2 SER 61 HB2 SER 61 -3.294 6.481 6.060 520 HB3 SER 61 HB3 SER 61 -1.967 5.355 5.713 521 HG SER 61 HG SER 61 -1.489 7.705 5.815 522 H LYS 62 H LYS 62 -3.097 7.377 2.241 523 HA LYS 62 HA LYS 62 -5.408 9.085 2.822 524 HB2 LYS 62 HB2 LYS 62 -3.310 8.996 0.627 525 HB3 LYS 62 HB3 LYS 62 -4.654 10.139 0.578 526 HG2 LYS 62 HG2 LYS 62 -3.979 11.238 2.586 527 HG3 LYS 62 HG3 LYS 62 -2.840 9.966 3.009 528 HD2 LYS 62 HD2 LYS 62 -1.603 11.867 2.182 529 HD3 LYS 62 HD3 LYS 62 -1.441 10.538 1.026 530 HE2 LYS 62 HE2 LYS 62 -3.310 11.610 -0.329 531 HE3 LYS 62 HE3 LYS 62 -3.279 12.974 0.798 532 HZ1 LYS 62 HZ1 LYS 62 -1.013 12.045 -0.891 533 HZ2 LYS 62 HZ2 LYS 62 -1.897 13.400 -1.158 534 HZ3 LYS 62 HZ3 LYS 62 -0.928 13.311 0.157 535 H ARG 63 H ARG 63 -4.923 6.371 0.692 536 HA ARG 63 HA ARG 63 -7.492 6.940 -0.789 537 HB2 ARG 63 HB2 ARG 63 -5.010 5.358 -1.563 538 HB3 ARG 63 HB3 ARG 63 -6.483 5.462 -2.540 539 HG2 ARG 63 HG2 ARG 63 -6.200 7.851 -2.866 540 HG3 ARG 63 HG3 ARG 63 -4.844 7.897 -1.728 541 HD2 ARG 63 HD2 ARG 63 -3.573 6.325 -3.225 542 HD3 ARG 63 HD3 ARG 63 -4.910 6.384 -4.372 543 HE ARG 63 HE ARG 63 -4.086 8.372 -5.177 544 HH11 ARG 63 HH11 ARG 63 -2.568 10.034 -5.386 545 HH12 ARG 63 HH12 ARG 63 -1.423 10.284 -4.088 546 HH21 ARG 63 HH21 ARG 63 -2.697 8.007 -1.959 547 HH22 ARG 63 HH22 ARG 63 -1.761 9.494 -2.151 548 H LEU 64 H LEU 64 -5.682 4.370 0.823 549 HA LEU 64 HA LEU 64 -7.794 2.362 0.513 550 HB2 LEU 64 HB2 LEU 64 -5.214 2.207 0.443 551 HB3 LEU 64 HB3 LEU 64 -5.277 2.221 2.201 552 HG LEU 64 HG LEU 64 -6.627 0.155 0.435 553 HD11 LEU 64 HD11 LEU 64 -3.887 0.082 1.767 554 HD12 LEU 64 HD12 LEU 64 -4.651 -1.262 0.889 555 HD13 LEU 64 HD13 LEU 64 -4.203 0.215 0.025 556 HD21 LEU 64 HD21 LEU 64 -7.511 0.018 2.706 557 HD22 LEU 64 HD22 LEU 64 -6.362 -1.298 2.502 558 HD23 LEU 64 HD23 LEU 64 -5.877 0.156 3.392 559 H ASN 65 H ASN 65 -6.933 4.813 2.792 560 HA ASN 65 HA ASN 65 -7.697 5.534 4.745 561 HB2 ASN 65 HB2 ASN 65 -9.839 5.638 3.620 562 HB3 ASN 65 HB3 ASN 65 -10.199 3.962 4.046 563 HD21 ASN 65 HD21 ASN 65 -10.272 6.729 7.101 564 HD22 ASN 65 HD22 ASN 65 -9.130 6.968 5.787 565 H ILE 66 H ILE 66 -5.938 4.449 5.557 566 HA ILE 66 HA ILE 66 -6.555 2.583 7.770 567 HB ILE 66 HB ILE 66 -4.218 1.547 7.332 568 HG12 ILE 66 HG12 ILE 66 -4.764 2.547 4.508 569 HG13 ILE 66 HG13 ILE 66 -3.481 3.086 5.608 570 HG21 ILE 66 HG21 ILE 66 -6.555 0.791 5.566 571 HG22 ILE 66 HG22 ILE 66 -5.183 -0.256 6.025 572 HG23 ILE 66 HG23 ILE 66 -6.288 0.329 7.267 573 HD11 ILE 66 HD11 ILE 66 -3.730 0.338 4.355 574 HD12 ILE 66 HD12 ILE 66 -2.565 1.616 3.974 575 HD13 ILE 66 HD13 ILE 66 -2.518 0.812 5.571 576 H THR 67 H THR 67 -4.859 2.584 9.391 577 HA THR 67 HA THR 67 -3.761 5.151 10.135 578 HB THR 67 HB THR 67 -3.441 2.277 11.053 579 HG1 THR 67 HG1 THR 67 -4.580 3.102 12.822 580 HG21 THR 67 HG21 THR 67 -2.100 4.727 12.229 581 HG22 THR 67 HG22 THR 67 -2.344 3.189 13.102 582 HG23 THR 67 HG23 THR 67 -1.352 3.210 11.650 583 H VAL 68 H VAL 68 -1.682 5.954 9.787 584 HA VAL 68 HA VAL 68 -0.217 5.166 7.508 585 HB VAL 68 HB VAL 68 0.981 6.603 9.908 586 HG11 VAL 68 HG11 VAL 68 1.584 6.752 6.913 587 HG12 VAL 68 HG12 VAL 68 2.347 7.749 8.171 588 HG13 VAL 68 HG13 VAL 68 2.619 6.007 8.151 589 HG21 VAL 68 HG21 VAL 68 -1.103 7.782 9.343 590 HG22 VAL 68 HG22 VAL 68 0.285 8.724 8.807 591 HG23 VAL 68 HG23 VAL 68 -0.651 7.791 7.624 592 H ASP 69 H ASP 69 0.268 4.222 10.887 593 HA ASP 69 HA ASP 69 2.677 2.700 10.331 594 HB2 ASP 69 HB2 ASP 69 0.826 2.799 12.739 595 HB3 ASP 69 HB3 ASP 69 2.303 1.835 12.679 596 H LYS 70 H LYS 70 -0.741 1.893 10.155 597 HA LYS 70 HA LYS 70 -0.241 -0.987 9.909 598 HB2 LYS 70 HB2 LYS 70 -2.663 0.734 9.240 599 HB3 LYS 70 HB3 LYS 70 -2.544 -0.984 8.854 600 HG2 LYS 70 HG2 LYS 70 -2.122 -1.498 11.258 601 HG3 LYS 70 HG3 LYS 70 -2.374 0.212 11.654 602 HD2 LYS 70 HD2 LYS 70 -4.687 0.084 10.769 603 HD3 LYS 70 HD3 LYS 70 -4.418 -1.605 10.286 604 HE2 LYS 70 HE2 LYS 70 -3.974 -2.200 12.669 605 HE3 LYS 70 HE3 LYS 70 -4.311 -0.530 13.141 606 HZ1 LYS 70 HZ1 LYS 70 -6.260 -2.360 11.835 607 HZ2 LYS 70 HZ2 LYS 70 -6.265 -1.952 13.413 608 HZ3 LYS 70 HZ3 LYS 70 -6.579 -0.820 12.282 609 H ALA 71 H ALA 71 -0.365 1.810 7.733 610 HA ALA 71 HA ALA 71 -0.108 0.240 5.290 611 HB1 ALA 71 HB1 ALA 71 0.617 3.156 5.852 612 HB2 ALA 71 HB2 ALA 71 0.435 2.408 4.257 613 HB3 ALA 71 HB3 ALA 71 -0.961 2.606 5.333 614 H LYS 72 H LYS 72 2.300 1.931 7.310 615 HA LYS 72 HA LYS 72 4.664 1.168 5.905 616 HB2 LYS 72 HB2 LYS 72 4.151 1.706 8.868 617 HB3 LYS 72 HB3 LYS 72 5.766 1.465 8.194 618 HG2 LYS 72 HG2 LYS 72 5.638 3.455 6.866 619 HG3 LYS 72 HG3 LYS 72 3.914 3.630 7.176 620 HD2 LYS 72 HD2 LYS 72 5.167 5.262 8.477 621 HD3 LYS 72 HD3 LYS 72 4.252 4.158 9.488 622 HE2 LYS 72 HE2 LYS 72 6.334 4.488 10.560 623 HE3 LYS 72 HE3 LYS 72 6.342 2.844 9.929 624 HZ1 LYS 72 HZ1 LYS 72 7.669 5.185 8.648 625 HZ2 LYS 72 HZ2 LYS 72 8.436 4.008 9.468 626 HZ3 LYS 72 HZ3 LYS 72 7.704 3.662 8.052 627 H THR 73 H THR 73 2.992 -0.625 8.545 628 HA THR 73 HA THR 73 5.012 -2.746 8.348 629 HB THR 73 HB THR 73 3.893 -1.918 10.485 630 HG1 THR 73 HG1 THR 73 4.217 -3.949 11.355 631 HG21 THR 73 HG21 THR 73 1.843 -4.073 9.807 632 HG22 THR 73 HG22 THR 73 1.948 -3.079 11.276 633 HG23 THR 73 HG23 THR 73 1.505 -2.331 9.736 634 H TYR 74 H TYR 74 1.640 -2.397 7.224 635 HA TYR 74 HA TYR 74 1.135 -5.038 6.394 636 HB2 TYR 74 HB2 TYR 74 -0.641 -3.460 6.292 637 HB3 TYR 74 HB3 TYR 74 0.314 -2.326 5.330 638 HD1 TYR 74 HD1 TYR 74 0.457 -2.392 2.996 639 HD2 TYR 74 HD2 TYR 74 -1.565 -5.540 5.150 640 HE1 TYR 74 HE1 TYR 74 -0.238 -3.388 0.856 641 HE2 TYR 74 HE2 TYR 74 -2.301 -6.536 2.972 642 HH TYR 74 HH TYR 74 -1.210 -5.218 -0.167 643 H ILE 75 H ILE 75 2.758 -2.415 4.549 644 HA ILE 75 HA ILE 75 3.257 -3.655 2.124 645 HB ILE 75 HB ILE 75 4.861 -1.711 3.803 646 HG12 ILE 75 HG12 ILE 75 3.484 -1.281 1.119 647 HG13 ILE 75 HG13 ILE 75 2.655 -1.085 2.654 648 HG21 ILE 75 HG21 ILE 75 5.612 -2.602 0.981 649 HG22 ILE 75 HG22 ILE 75 6.328 -1.232 1.864 650 HG23 ILE 75 HG23 ILE 75 6.582 -2.853 2.453 651 HD11 ILE 75 HD11 ILE 75 5.058 0.545 1.709 652 HD12 ILE 75 HD12 ILE 75 3.399 1.096 1.909 653 HD13 ILE 75 HD13 ILE 75 4.347 0.647 3.336 654 H LYS 76 H LYS 76 5.560 -3.790 4.877 655 HA LYS 76 HA LYS 76 7.041 -5.883 3.503 656 HB2 LYS 76 HB2 LYS 76 8.750 -5.497 5.200 657 HB3 LYS 76 HB3 LYS 76 8.148 -3.958 4.580 658 HG2 LYS 76 HG2 LYS 76 6.679 -3.745 6.613 659 HG3 LYS 76 HG3 LYS 76 7.372 -5.254 7.238 660 HD2 LYS 76 HD2 LYS 76 9.632 -4.215 7.212 661 HD3 LYS 76 HD3 LYS 76 8.923 -2.704 6.596 662 HE2 LYS 76 HE2 LYS 76 7.502 -2.546 8.630 663 HE3 LYS 76 HE3 LYS 76 8.205 -4.050 9.242 664 HZ1 LYS 76 HZ1 LYS 76 9.724 -1.543 8.727 665 HZ2 LYS 76 HZ2 LYS 76 9.311 -2.113 10.199 666 HZ3 LYS 76 HZ3 LYS 76 10.378 -2.935 9.282 667 H ASN 77 H ASN 77 4.435 -6.225 5.553 668 HA ASN 77 HA ASN 77 5.357 -8.942 6.429 669 HB2 ASN 77 HB2 ASN 77 3.041 -7.184 7.298 670 HB3 ASN 77 HB3 ASN 77 3.099 -8.909 7.646 671 HD21 ASN 77 HD21 ASN 77 5.520 -6.408 9.752 672 HD22 ASN 77 HD22 ASN 77 4.643 -5.814 8.349 673 H SER 78 H SER 78 2.961 -7.354 4.351 674 HA SER 78 HA SER 78 1.834 -9.932 3.478 675 HB2 SER 78 HB2 SER 78 1.217 -7.063 2.698 676 HB3 SER 78 HB3 SER 78 0.319 -8.491 2.149 677 HG SER 78 HG SER 78 -0.529 -7.381 4.068 678 H ASN 79 H ASN 79 4.078 -7.524 2.212 679 HA ASN 79 HA ASN 79 4.820 -9.360 0.025 680 HB2 ASN 79 HB2 ASN 79 4.726 -7.480 -1.620 681 HB3 ASN 79 HB3 ASN 79 3.177 -8.138 -1.118 682 HD21 ASN 79 HD21 ASN 79 4.068 -4.232 -0.317 683 HD22 ASN 79 HD22 ASN 79 5.376 -5.392 -0.556 684 H ARG 80 H ARG 80 6.573 -9.511 1.715 685 HA ARG 80 HA ARG 80 8.204 -7.241 2.266 686 HB2 ARG 80 HB2 ARG 80 8.008 -9.407 3.604 687 HB3 ARG 80 HB3 ARG 80 9.145 -10.135 2.461 688 HG2 ARG 80 HG2 ARG 80 10.866 -8.528 3.028 689 HG3 ARG 80 HG3 ARG 80 9.710 -7.507 3.890 690 HD2 ARG 80 HD2 ARG 80 10.804 -8.508 5.652 691 HD3 ARG 80 HD3 ARG 80 9.366 -9.498 5.499 692 HE ARG 80 HE ARG 80 10.663 -11.307 4.716 693 HH11 ARG 80 HH11 ARG 80 12.549 -12.485 4.761 694 HH12 ARG 80 HH12 ARG 80 14.077 -11.676 4.943 695 HH21 ARG 80 HH21 ARG 80 12.760 -8.519 5.109 696 HH22 ARG 80 HH22 ARG 80 14.202 -9.495 5.139 697 H MET 81 H MET 81 8.641 -9.712 -0.194 698 HA MET 81 HA MET 81 10.687 -7.959 -1.528 699 HB2 MET 81 HB2 MET 81 10.764 -10.989 -1.287 700 HB3 MET 81 HB3 MET 81 11.868 -10.004 -2.253 701 HG2 MET 81 HG2 MET 81 12.558 -8.799 -0.164 702 HG3 MET 81 HG3 MET 81 11.578 -9.938 0.771 703 HE1 MET 81 HE1 MET 81 13.634 -10.510 2.273 704 HE2 MET 81 HE2 MET 81 15.219 -11.027 1.657 705 HE3 MET 81 HE3 MET 81 14.647 -9.372 1.355 706 H GLY 82 H GLY 82 7.858 -10.029 -1.950 707 HA2 GLY 82 HA2 GLY 82 7.283 -8.837 -4.518 708 HA3 GLY 82 HA3 GLY 82 7.943 -10.459 -4.739 709 H ARG 83 H ARG 83 6.425 -11.962 -4.927 710 HA ARG 83 HA ARG 83 3.779 -11.835 -3.603 711 HB2 ARG 83 HB2 ARG 83 5.135 -14.017 -5.225 712 HB3 ARG 83 HB3 ARG 83 3.568 -14.196 -4.410 713 HG2 ARG 83 HG2 ARG 83 2.696 -12.232 -5.694 714 HG3 ARG 83 HG3 ARG 83 4.224 -12.167 -6.593 715 HD2 ARG 83 HD2 ARG 83 3.858 -14.462 -7.414 716 HD3 ARG 83 HD3 ARG 83 2.369 -14.590 -6.480 717 HE ARG 83 HE ARG 83 2.792 -13.136 -9.002 718 HH11 ARG 83 HH11 ARG 83 1.044 -12.314 -10.089 719 HH12 ARG 83 HH12 ARG 83 -0.499 -12.197 -9.298 720 HH21 ARG 83 HH21 ARG 83 0.561 -13.513 -6.318 721 HH22 ARG 83 HH22 ARG 83 -0.773 -12.855 -7.224 722 H THR 84 H THR 84 5.715 -14.707 -3.330 723 HA THR 84 HA THR 84 6.387 -14.126 -0.523 724 HB THR 84 HB THR 84 4.954 -16.748 -0.796 725 HG1 THR 84 HG1 THR 84 2.987 -15.799 -0.400 726 HG21 THR 84 HG21 THR 84 5.097 -14.492 1.257 727 HG22 THR 84 HG22 THR 84 4.340 -16.094 1.522 728 HG23 THR 84 HG23 THR 84 6.096 -15.963 1.261 729 H ASN 85 H ASN 85 8.247 -14.269 -2.361 730 HA ASN 85 HA ASN 85 10.264 -15.180 -2.836 731 HB2 ASN 85 HB2 ASN 85 9.808 -15.881 0.090 732 HB3 ASN 85 HB3 ASN 85 11.369 -16.093 -0.683 733 HD21 ASN 85 HD21 ASN 85 12.159 -12.671 -0.874 734 HD22 ASN 85 HD22 ASN 85 12.464 -14.236 -1.608 735 H ASN 86 H ASN 86 8.089 -17.133 -3.550 736 HA ASN 86 HA ASN 86 9.772 -19.590 -3.685 737 HB2 ASN 86 HB2 ASN 86 7.662 -20.789 -4.177 738 HB3 ASN 86 HB3 ASN 86 7.677 -19.993 -2.609 739 HD21 ASN 86 HD21 ASN 86 5.058 -17.755 -3.366 740 HD22 ASN 86 HD22 ASN 86 6.438 -18.088 -2.304 741 H PHE 87 H PHE 87 9.288 -16.982 -5.584 742 HA PHE 87 HA PHE 87 8.731 -18.199 -8.131 743 HB2 PHE 87 HB2 PHE 87 8.764 -16.040 -9.005 744 HB3 PHE 87 HB3 PHE 87 8.091 -15.872 -7.395 745 HD1 PHE 87 HD1 PHE 87 9.743 -15.113 -5.482 746 HD2 PHE 87 HD2 PHE 87 10.575 -14.720 -9.696 747 HE1 PHE 87 HE1 PHE 87 11.557 -13.510 -4.969 748 HE2 PHE 87 HE2 PHE 87 12.379 -13.088 -9.180 749 HZ PHE 87 HZ PHE 87 12.883 -12.491 -6.816 750 H LYS 88 H LYS 88 11.205 -19.160 -6.730 751 HA LYS 88 HA LYS 88 13.519 -18.010 -8.143 752 HB2 LYS 88 HB2 LYS 88 13.376 -20.070 -5.907 753 HB3 LYS 88 HB3 LYS 88 14.805 -19.152 -6.410 754 HG2 LYS 88 HG2 LYS 88 13.656 -17.035 -5.793 755 HG3 LYS 88 HG3 LYS 88 12.252 -17.955 -5.232 756 HD2 LYS 88 HD2 LYS 88 15.045 -18.223 -4.047 757 HD3 LYS 88 HD3 LYS 88 13.752 -17.198 -3.405 758 HE2 LYS 88 HE2 LYS 88 12.279 -19.274 -3.259 759 HE3 LYS 88 HE3 LYS 88 13.703 -20.239 -3.675 760 HZ1 LYS 88 HZ1 LYS 88 13.455 -18.464 -1.303 761 HZ2 LYS 88 HZ2 LYS 88 13.411 -20.090 -1.271 762 HZ3 LYS 88 HZ3 LYS 88 14.796 -19.327 -1.675 763 H THR 89 H THR 89 11.539 -20.396 -8.926 764 HA THR 89 HA THR 89 13.427 -22.096 -10.474 765 HB THR 89 HB THR 89 11.596 -22.976 -8.206 766 HG1 THR 89 HG1 THR 89 13.477 -24.014 -7.535 767 HG21 THR 89 HG21 THR 89 12.818 -24.720 -10.381 768 HG22 THR 89 HG22 THR 89 12.159 -25.330 -8.839 769 HG23 THR 89 HG23 THR 89 11.090 -24.527 -9.990 770 H ILE 90 H ILE 90 10.032 -21.462 -9.452 771 HA ILE 90 HA ILE 90 8.894 -22.195 -12.031 772 HB ILE 90 HB ILE 90 6.833 -21.357 -11.109 773 HG12 ILE 90 HG12 ILE 90 8.453 -20.607 -8.642 774 HG13 ILE 90 HG13 ILE 90 7.682 -19.482 -9.763 775 HG21 ILE 90 HG21 ILE 90 8.249 -23.172 -9.123 776 HG22 ILE 90 HG22 ILE 90 6.514 -23.113 -9.497 777 HG23 ILE 90 HG23 ILE 90 7.651 -23.686 -10.716 778 HD11 ILE 90 HD11 ILE 90 6.320 -21.427 -7.875 779 HD12 ILE 90 HD12 ILE 90 6.258 -19.653 -7.864 780 HD13 ILE 90 HD13 ILE 90 5.465 -20.562 -9.174 781 H LYS 91 H LYS 91 7.645 -20.669 -13.326 782 HA LYS 91 HA LYS 91 7.641 -18.994 -14.848 783 HB2 LYS 91 HB2 LYS 91 8.351 -17.295 -12.421 784 HB3 LYS 91 HB3 LYS 91 8.031 -16.637 -14.013 785 HG2 LYS 91 HG2 LYS 91 6.013 -16.405 -13.009 786 HG3 LYS 91 HG3 LYS 91 5.803 -17.857 -13.990 787 HD2 LYS 91 HD2 LYS 91 6.227 -19.174 -11.783 788 HD3 LYS 91 HD3 LYS 91 6.079 -17.601 -10.969 789 HE2 LYS 91 HE2 LYS 91 3.855 -17.354 -12.253 790 HE3 LYS 91 HE3 LYS 91 4.054 -19.051 -12.730 791 HZ1 LYS 91 HZ1 LYS 91 3.868 -18.096 -9.916 792 HZ2 LYS 91 HZ2 LYS 91 2.650 -18.789 -10.746 793 HZ3 LYS 91 HZ3 LYS 91 3.973 -19.665 -10.386 794 H MET 92 H MET 92 10.262 -20.458 -14.309 795 HA MET 92 HA MET 92 11.885 -18.765 -16.198 796 HB2 MET 92 HB2 MET 92 12.958 -20.707 -14.125 797 HB3 MET 92 HB3 MET 92 13.903 -19.726 -15.253 798 HG2 MET 92 HG2 MET 92 12.997 -17.671 -14.153 799 HG3 MET 92 HG3 MET 92 12.132 -18.708 -13.011 800 HE1 MET 92 HE1 MET 92 12.890 -18.285 -10.833 801 HE2 MET 92 HE2 MET 92 14.502 -17.687 -10.383 802 HE3 MET 92 HE3 MET 92 13.493 -16.765 -11.516 803 H PHE 93 H PHE 93 11.190 -22.135 -15.209 804 HA PHE 93 HA PHE 93 12.013 -23.112 -17.907 805 HB2 PHE 93 HB2 PHE 93 11.920 -24.708 -15.340 806 HB3 PHE 93 HB3 PHE 93 12.710 -25.132 -16.854 807 HD1 PHE 93 HD1 PHE 93 14.713 -23.651 -17.626 808 HD2 PHE 93 HD2 PHE 93 13.061 -23.541 -13.653 809 HE1 PHE 93 HE1 PHE 93 16.795 -22.570 -16.795 810 HE2 PHE 93 HE2 PHE 93 15.147 -22.460 -12.812 811 HZ PHE 93 HZ PHE 93 17.011 -21.972 -14.388 812 H GLU 94 H GLU 94 9.389 -22.058 -17.299 813 HA GLU 94 HA GLU 94 7.595 -24.410 -17.623 814 HB2 GLU 94 HB2 GLU 94 7.830 -22.515 -15.343 815 HB3 GLU 94 HB3 GLU 94 6.191 -22.643 -15.967 816 HG2 GLU 94 HG2 GLU 94 7.936 -24.950 -15.032 817 HG3 GLU 94 HG3 GLU 94 6.631 -24.190 -14.120 818 H ASP 95 H ASP 95 5.409 -23.824 -18.271 819 HA ASP 95 HA ASP 95 5.473 -21.757 -20.413 820 HB2 ASP 95 HB2 ASP 95 3.574 -24.056 -19.846 821 HB3 ASP 95 HB3 ASP 95 3.331 -22.865 -21.121 822 H ASP 96 H ASP 96 3.806 -20.250 -20.732 823 HA ASP 96 HA ASP 96 1.865 -19.719 -18.594 824 HB2 ASP 96 HB2 ASP 96 2.560 -17.313 -18.448 825 HB3 ASP 96 HB3 ASP 96 3.636 -18.467 -17.683 826 H VAL 97 H VAL 97 0.165 -18.432 -19.157 827 HA VAL 97 HA VAL 97 -0.078 -17.381 -21.925 828 HB VAL 97 HB VAL 97 -2.191 -19.208 -20.701 829 HG11 VAL 97 HG11 VAL 97 -2.018 -17.892 -23.449 830 HG12 VAL 97 HG12 VAL 97 -3.260 -19.056 -22.934 831 HG13 VAL 97 HG13 VAL 97 -3.170 -17.475 -22.158 832 HG21 VAL 97 HG21 VAL 97 -0.325 -20.600 -21.454 833 HG22 VAL 97 HG22 VAL 97 -1.687 -20.770 -22.559 834 HG23 VAL 97 HG23 VAL 97 -0.299 -19.760 -23.022 835 H SER 98 H SER 98 -1.858 -17.775 -18.843 836 HA SER 98 HA SER 98 -2.732 -14.917 -18.994 837 HB2 SER 98 HB2 SER 98 -4.176 -17.265 -17.724 838 HB3 SER 98 HB3 SER 98 -4.765 -15.596 -17.850 839 HG SER 98 HG SER 98 -5.619 -16.945 -19.499 840 H SER 99 H SER 99 -0.289 -16.120 -17.655 841 HA SER 99 HA SER 99 -0.668 -14.975 -14.972 842 HB2 SER 99 HB2 SER 99 -1.054 -17.525 -15.051 843 HB3 SER 99 HB3 SER 99 0.697 -17.660 -15.281 844 HG SER 99 HG SER 99 -0.003 -17.762 -13.057 845 H ALA 100 H ALA 100 0.627 -13.844 -17.202 846 HA ALA 100 HA ALA 100 3.307 -13.339 -16.100 847 HB1 ALA 100 HB1 ALA 100 2.884 -14.328 -18.959 848 HB2 ALA 100 HB2 ALA 100 4.415 -13.754 -18.265 849 HB3 ALA 100 HB3 ALA 100 3.673 -15.231 -17.642 850 H SER 101 H SER 101 4.392 -11.517 -17.237 851 HA SER 101 HA SER 101 2.604 -9.507 -18.501 852 HB2 SER 101 HB2 SER 101 4.183 -9.019 -15.940 853 HB3 SER 101 HB3 SER 101 3.349 -7.782 -16.895 854 HG SER 101 HG SER 101 2.095 -8.514 -15.107 855 H ALA 102 H ALA 102 3.709 -8.100 -19.838 856 HA ALA 102 HA ALA 102 5.272 -7.600 -21.389 857 HB1 ALA 102 HB1 ALA 102 7.138 -7.515 -19.005 858 HB2 ALA 102 HB2 ALA 102 7.349 -6.675 -20.556 859 HB3 ALA 102 HB3 ALA 102 6.004 -6.227 -19.485 860 H GLN 103 H GLN 103 4.773 -10.305 -21.174 861 HA GLN 103 HA GLN 103 7.330 -11.647 -21.961 862 HB2 GLN 103 HB2 GLN 103 4.977 -12.570 -20.335 863 HB3 GLN 103 HB3 GLN 103 5.952 -13.735 -21.216 864 HG2 GLN 103 HG2 GLN 103 7.135 -11.756 -19.228 865 HG3 GLN 103 HG3 GLN 103 6.647 -13.397 -18.820 866 HE21 GLN 103 HE21 GLN 103 10.206 -12.823 -20.699 867 HE22 GLN 103 HE22 GLN 103 9.155 -11.457 -20.344 868 HA PRO 104 HA PRO 104 4.768 -11.899 -25.759 869 HB2 PRO 104 HB2 PRO 104 6.656 -11.399 -27.628 870 HB3 PRO 104 HB3 PRO 104 6.052 -10.116 -26.542 871 HG2 PRO 104 HG2 PRO 104 8.566 -11.790 -26.190 872 HG3 PRO 104 HG3 PRO 104 8.414 -10.004 -26.142 873 HD2 PRO 104 HD2 PRO 104 8.375 -11.557 -23.883 874 HD3 PRO 104 HD3 PRO 104 7.425 -10.047 -24.019 875 H ASN 105 H ASN 105 5.012 -14.155 -24.483 876 HA ASN 105 HA ASN 105 6.834 -16.089 -25.711 877 HB2 ASN 105 HB2 ASN 105 4.793 -16.287 -23.462 878 HB3 ASN 105 HB3 ASN 105 5.830 -17.616 -23.974 879 HD21 ASN 105 HD21 ASN 105 7.466 -15.827 -21.113 880 HD22 ASN 105 HD22 ASN 105 5.872 -16.562 -21.316 881 H LEU 106 H LEU 106 5.685 -15.479 -27.818 882 HA LEU 106 HA LEU 106 3.496 -17.424 -28.431 883 HB2 LEU 106 HB2 LEU 106 2.854 -15.028 -28.496 884 HB3 LEU 106 HB3 LEU 106 4.104 -14.738 -29.701 885 HG LEU 106 HG LEU 106 2.915 -16.408 -31.222 886 HD11 LEU 106 HD11 LEU 106 0.728 -16.158 -29.105 887 HD12 LEU 106 HD12 LEU 106 0.529 -16.876 -30.719 888 HD13 LEU 106 HD13 LEU 106 1.596 -17.648 -29.544 889 HD21 LEU 106 HD21 LEU 106 2.642 -13.979 -31.481 890 HD22 LEU 106 HD22 LEU 106 1.133 -14.828 -31.848 891 HD23 LEU 106 HD23 LEU 106 1.319 -13.984 -30.292 892 HA PRO 107 HA PRO 107 7.137 -18.872 -30.875 893 HB2 PRO 107 HB2 PRO 107 6.578 -21.543 -30.889 894 HB3 PRO 107 HB3 PRO 107 7.315 -20.701 -29.491 895 HG2 PRO 107 HG2 PRO 107 4.393 -21.400 -29.918 896 HG3 PRO 107 HG3 PRO 107 5.395 -21.672 -28.458 897 HD2 PRO 107 HD2 PRO 107 3.740 -19.522 -28.709 898 HD3 PRO 107 HD3 PRO 107 5.309 -19.398 -27.857 Start of MODEL 16 1 H1 GLY -5 H1 GLY -5 -26.071 -17.314 0.384 2 H2 GLY -5 H2 GLY -5 -24.596 -16.714 0.765 3 H3 GLY -5 H3 GLY -5 -24.851 -17.388 -0.707 4 HA2 GLY -5 HA2 GLY -5 -26.121 -14.914 0.275 5 HA3 GLY -5 HA3 GLY -5 -24.779 -14.984 -0.880 6 H SER -4 H SER -4 -27.819 -14.191 -0.905 7 HA SER -4 HA SER -4 -28.315 -15.115 -3.666 8 HB2 SER -4 HB2 SER -4 -30.711 -15.612 -3.104 9 HB3 SER -4 HB3 SER -4 -29.542 -16.789 -2.473 10 HG SER -4 HG SER -4 -31.103 -16.212 -0.899 11 H HIS -3 H HIS -3 -29.890 -13.887 -4.792 12 HA HIS -3 HA HIS -3 -31.129 -11.558 -3.518 13 HB2 HIS -3 HB2 HIS -3 -28.864 -10.756 -4.310 14 HB3 HIS -3 HB3 HIS -3 -29.355 -11.155 -5.958 15 HD2 HIS -3 HD2 HIS -3 -30.251 -9.063 -7.214 16 HE1 HIS -3 HE1 HIS -3 -31.869 -6.849 -3.948 17 HE2 HIS -3 HE2 HIS -3 -31.429 -6.836 -6.456 18 H MET -2 H MET -2 -32.985 -10.928 -4.510 19 HA MET -2 HA MET -2 -33.860 -12.324 -7.015 20 HB2 MET -2 HB2 MET -2 -35.410 -12.013 -4.417 21 HB3 MET -2 HB3 MET -2 -36.127 -12.489 -5.966 22 HG2 MET -2 HG2 MET -2 -34.600 -14.439 -6.070 23 HG3 MET -2 HG3 MET -2 -33.935 -13.996 -4.494 24 HE1 MET -2 HE1 MET -2 -34.377 -16.459 -3.645 25 HE2 MET -2 HE2 MET -2 -35.955 -17.269 -3.736 26 HE3 MET -2 HE3 MET -2 -35.069 -16.887 -5.227 27 H ALA -1 H ALA -1 -33.622 -10.649 -8.367 28 HA ALA -1 HA ALA -1 -35.636 -8.548 -8.309 29 HB1 ALA -1 HB1 ALA -1 -32.672 -7.834 -8.345 30 HB2 ALA -1 HB2 ALA -1 -34.015 -6.713 -8.661 31 HB3 ALA -1 HB3 ALA -1 -33.839 -7.445 -7.057 32 H SER 0 H SER 0 -36.492 -9.343 -10.119 33 HA SER 0 HA SER 0 -34.829 -9.754 -12.567 34 HB2 SER 0 HB2 SER 0 -36.248 -11.596 -11.438 35 HB3 SER 0 HB3 SER 0 -37.641 -10.777 -12.162 36 HG SER 0 HG SER 0 -36.772 -12.446 -13.499 37 H MET 1 H MET 1 -36.624 -7.296 -11.386 38 HA MET 1 HA MET 1 -37.669 -6.417 -14.053 39 HB2 MET 1 HB2 MET 1 -39.212 -6.459 -11.426 40 HB3 MET 1 HB3 MET 1 -39.759 -5.648 -12.900 41 HG2 MET 1 HG2 MET 1 -39.678 -7.805 -14.116 42 HG3 MET 1 HG3 MET 1 -39.254 -8.624 -12.608 43 HE1 MET 1 HE1 MET 1 -41.277 -10.299 -13.111 44 HE2 MET 1 HE2 MET 1 -42.956 -9.767 -13.355 45 HE3 MET 1 HE3 MET 1 -41.717 -9.375 -14.566 46 H ASP 2 H ASP 2 -35.810 -5.528 -11.483 47 HA ASP 2 HA ASP 2 -35.984 -2.621 -12.183 48 HB2 ASP 2 HB2 ASP 2 -37.043 -3.243 -9.971 49 HB3 ASP 2 HB3 ASP 2 -35.460 -3.791 -9.424 50 H GLN 3 H GLN 3 -34.200 -5.107 -12.816 51 HA GLN 3 HA GLN 3 -31.498 -3.943 -12.402 52 HB2 GLN 3 HB2 GLN 3 -32.304 -5.151 -10.332 53 HB3 GLN 3 HB3 GLN 3 -32.470 -6.600 -11.292 54 HG2 GLN 3 HG2 GLN 3 -29.756 -5.667 -11.617 55 HG3 GLN 3 HG3 GLN 3 -30.156 -5.511 -9.913 56 HE21 GLN 3 HE21 GLN 3 -30.457 -9.301 -11.545 57 HE22 GLN 3 HE22 GLN 3 -30.697 -7.881 -12.570 58 H LEU 4 H LEU 4 -33.084 -4.487 -14.826 59 HA LEU 4 HA LEU 4 -31.432 -6.591 -16.130 60 HB2 LEU 4 HB2 LEU 4 -34.144 -6.909 -15.274 61 HB3 LEU 4 HB3 LEU 4 -34.229 -6.681 -17.000 62 HG LEU 4 HG LEU 4 -32.331 -8.480 -17.147 63 HD11 LEU 4 HD11 LEU 4 -33.392 -8.968 -14.322 64 HD12 LEU 4 HD12 LEU 4 -32.346 -10.083 -15.228 65 HD13 LEU 4 HD13 LEU 4 -31.742 -8.491 -14.740 66 HD21 LEU 4 HD21 LEU 4 -34.637 -8.905 -17.861 67 HD22 LEU 4 HD22 LEU 4 -33.965 -10.320 -17.036 68 HD23 LEU 4 HD23 LEU 4 -35.110 -9.259 -16.187 69 H ASP 5 H ASP 5 -31.556 -3.535 -16.407 70 HA ASP 5 HA ASP 5 -32.100 -3.412 -19.365 71 HB2 ASP 5 HB2 ASP 5 -34.076 -2.714 -17.992 72 HB3 ASP 5 HB3 ASP 5 -33.088 -1.455 -17.255 73 H GLU 6 H GLU 6 -30.068 -2.394 -16.774 74 HA GLU 6 HA GLU 6 -28.907 -0.119 -18.220 75 HB2 GLU 6 HB2 GLU 6 -27.645 0.249 -16.144 76 HB3 GLU 6 HB3 GLU 6 -29.378 0.232 -15.923 77 HG2 GLU 6 HG2 GLU 6 -27.805 -2.308 -15.417 78 HG3 GLU 6 HG3 GLU 6 -27.775 -1.008 -14.233 79 H ILE 7 H ILE 7 -28.461 -2.708 -19.464 80 HA ILE 7 HA ILE 7 -25.676 -3.449 -18.999 81 HB ILE 7 HB ILE 7 -27.429 -4.339 -21.318 82 HG12 ILE 7 HG12 ILE 7 -27.451 -6.491 -19.664 83 HG13 ILE 7 HG13 ILE 7 -27.425 -5.230 -18.437 84 HG21 ILE 7 HG21 ILE 7 -24.973 -5.567 -19.983 85 HG22 ILE 7 HG22 ILE 7 -25.880 -6.256 -21.347 86 HG23 ILE 7 HG23 ILE 7 -24.993 -4.749 -21.561 87 HD11 ILE 7 HD11 ILE 7 -29.464 -5.548 -20.692 88 HD12 ILE 7 HD12 ILE 7 -29.709 -5.953 -18.982 89 HD13 ILE 7 HD13 ILE 7 -29.501 -4.263 -19.470 90 H ILE 8 H ILE 8 -24.318 -1.797 -19.403 91 HA ILE 8 HA ILE 8 -23.985 -0.826 -22.202 92 HB ILE 8 HB ILE 8 -23.976 0.950 -19.724 93 HG12 ILE 8 HG12 ILE 8 -25.936 0.864 -22.065 94 HG13 ILE 8 HG13 ILE 8 -26.276 0.370 -20.405 95 HG21 ILE 8 HG21 ILE 8 -23.513 1.670 -22.659 96 HG22 ILE 8 HG22 ILE 8 -23.583 2.820 -21.307 97 HG23 ILE 8 HG23 ILE 8 -22.278 1.669 -21.379 98 HD11 ILE 8 HD11 ILE 8 -25.789 3.199 -21.363 99 HD12 ILE 8 HD12 ILE 8 -27.264 2.496 -20.693 100 HD13 ILE 8 HD13 ILE 8 -25.849 2.723 -19.646 101 H GLU 9 H GLU 9 -21.879 -0.631 -22.839 102 HA GLU 9 HA GLU 9 -19.699 -1.204 -20.868 103 HB2 GLU 9 HB2 GLU 9 -19.957 -2.854 -22.707 104 HB3 GLU 9 HB3 GLU 9 -19.743 -1.564 -23.886 105 HG2 GLU 9 HG2 GLU 9 -17.665 -2.713 -23.698 106 HG3 GLU 9 HG3 GLU 9 -17.442 -1.143 -22.943 107 H GLN 10 H GLN 10 -18.744 0.613 -20.179 108 HA GLN 10 HA GLN 10 -17.731 2.627 -22.007 109 HB2 GLN 10 HB2 GLN 10 -20.297 3.150 -21.334 110 HB3 GLN 10 HB3 GLN 10 -19.546 3.731 -19.858 111 HG2 GLN 10 HG2 GLN 10 -19.766 5.617 -21.284 112 HG3 GLN 10 HG3 GLN 10 -18.053 5.211 -21.349 113 HE21 GLN 10 HE21 GLN 10 -20.379 4.702 -24.720 114 HE22 GLN 10 HE22 GLN 10 -21.161 4.878 -23.156 115 H ILE 11 H ILE 11 -16.611 4.451 -20.636 116 HA ILE 11 HA ILE 11 -15.355 3.292 -18.217 117 HB ILE 11 HB ILE 11 -13.242 4.310 -18.881 118 HG12 ILE 11 HG12 ILE 11 -14.492 4.734 -21.642 119 HG13 ILE 11 HG13 ILE 11 -14.078 6.027 -20.517 120 HG21 ILE 11 HG21 ILE 11 -14.374 2.341 -20.913 121 HG22 ILE 11 HG22 ILE 11 -12.679 2.464 -20.375 122 HG23 ILE 11 HG23 ILE 11 -13.930 1.916 -19.251 123 HD11 ILE 11 HD11 ILE 11 -12.098 4.134 -21.831 124 HD12 ILE 11 HD12 ILE 11 -12.337 5.857 -22.161 125 HD13 ILE 11 HD13 ILE 11 -11.693 5.345 -20.589 126 H GLN 12 H GLN 12 -15.695 4.288 -16.576 127 HA GLN 12 HA GLN 12 -16.326 7.208 -16.354 128 HB2 GLN 12 HB2 GLN 12 -17.954 4.828 -15.366 129 HB3 GLN 12 HB3 GLN 12 -18.318 6.500 -14.968 130 HG2 GLN 12 HG2 GLN 12 -19.124 7.015 -17.102 131 HG3 GLN 12 HG3 GLN 12 -18.279 5.689 -17.889 132 HE21 GLN 12 HE21 GLN 12 -20.652 3.166 -16.937 133 HE22 GLN 12 HE22 GLN 12 -18.927 3.394 -17.196 134 H LYS 13 H LYS 13 -16.617 7.774 -13.951 135 HA LYS 13 HA LYS 13 -14.578 6.558 -12.195 136 HB2 LYS 13 HB2 LYS 13 -16.607 8.775 -11.726 137 HB3 LYS 13 HB3 LYS 13 -15.448 8.192 -10.520 138 HG2 LYS 13 HG2 LYS 13 -13.573 8.741 -12.091 139 HG3 LYS 13 HG3 LYS 13 -14.741 9.492 -13.186 140 HD2 LYS 13 HD2 LYS 13 -14.218 10.325 -10.294 141 HD3 LYS 13 HD3 LYS 13 -13.559 11.124 -11.729 142 HE2 LYS 13 HE2 LYS 13 -15.854 11.657 -12.505 143 HE3 LYS 13 HE3 LYS 13 -16.529 10.867 -11.074 144 HZ1 LYS 13 HZ1 LYS 13 -14.749 13.245 -11.012 145 HZ2 LYS 13 HZ2 LYS 13 -16.360 13.269 -10.764 146 HZ3 LYS 13 HZ3 LYS 13 -15.386 12.515 -9.696 147 H GLU 14 H GLU 14 -15.623 4.434 -12.593 148 HA GLU 14 HA GLU 14 -18.039 3.678 -11.194 149 HB2 GLU 14 HB2 GLU 14 -15.773 2.223 -12.539 150 HB3 GLU 14 HB3 GLU 14 -16.776 1.340 -11.374 151 HG2 GLU 14 HG2 GLU 14 -18.802 1.928 -12.532 152 HG3 GLU 14 HG3 GLU 14 -17.906 2.898 -13.711 153 H ALA 15 H ALA 15 -18.152 4.135 -9.135 154 HA ALA 15 HA ALA 15 -16.101 3.031 -7.281 155 HB1 ALA 15 HB1 ALA 15 -18.055 5.319 -6.833 156 HB2 ALA 15 HB2 ALA 15 -16.919 4.668 -5.629 157 HB3 ALA 15 HB3 ALA 15 -16.307 5.442 -7.101 158 H ILE 16 H ILE 16 -19.522 3.774 -6.730 159 HA ILE 16 HA ILE 16 -19.861 1.040 -5.604 160 HB ILE 16 HB ILE 16 -20.658 3.793 -4.694 161 HG12 ILE 16 HG12 ILE 16 -19.313 1.469 -3.246 162 HG13 ILE 16 HG13 ILE 16 -18.466 2.801 -4.030 163 HG21 ILE 16 HG21 ILE 16 -21.874 1.222 -3.587 164 HG22 ILE 16 HG22 ILE 16 -22.062 2.842 -2.874 165 HG23 ILE 16 HG23 ILE 16 -22.745 2.509 -4.454 166 HD11 ILE 16 HD11 ILE 16 -20.242 3.007 -1.577 167 HD12 ILE 16 HD12 ILE 16 -18.498 3.262 -1.697 168 HD13 ILE 16 HD13 ILE 16 -19.605 4.410 -2.474 169 H ASN 17 H ASN 17 -20.890 2.748 -8.125 170 HA ASN 17 HA ASN 17 -23.654 1.827 -8.124 171 HB2 ASN 17 HB2 ASN 17 -22.016 3.064 -10.388 172 HB3 ASN 17 HB3 ASN 17 -23.764 2.873 -10.372 173 HD21 ASN 17 HD21 ASN 17 -22.227 6.162 -8.714 174 HD22 ASN 17 HD22 ASN 17 -21.308 5.088 -9.757 175 H SER 18 H SER 18 -20.748 0.301 -8.932 176 HA SER 18 HA SER 18 -21.798 -1.257 -11.203 177 HB2 SER 18 HB2 SER 18 -19.525 -0.160 -11.088 178 HB3 SER 18 HB3 SER 18 -19.043 -1.427 -9.947 179 HG SER 18 HG SER 18 -18.863 -1.549 -12.474 180 H ASN 19 H ASN 19 -20.724 -1.958 -7.852 181 HA ASN 19 HA ASN 19 -21.043 -4.813 -8.126 182 HB2 ASN 19 HB2 ASN 19 -20.601 -4.898 -5.744 183 HB3 ASN 19 HB3 ASN 19 -19.492 -3.766 -6.503 184 HD21 ASN 19 HD21 ASN 19 -20.652 -1.039 -4.552 185 HD22 ASN 19 HD22 ASN 19 -19.449 -1.632 -5.690 186 H VAL 20 H VAL 20 -23.347 -2.378 -7.729 187 HA VAL 20 HA VAL 20 -25.417 -3.889 -6.347 188 HB VAL 20 HB VAL 20 -25.499 -1.333 -7.995 189 HG11 VAL 20 HG11 VAL 20 -27.656 -2.527 -6.198 190 HG12 VAL 20 HG12 VAL 20 -27.668 -0.874 -6.850 191 HG13 VAL 20 HG13 VAL 20 -27.776 -2.245 -7.951 192 HG21 VAL 20 HG21 VAL 20 -24.164 -1.167 -5.904 193 HG22 VAL 20 HG22 VAL 20 -25.647 -0.219 -5.797 194 HG23 VAL 20 HG23 VAL 20 -25.539 -1.793 -4.978 195 H VAL 21 H VAL 21 -24.392 -3.634 -9.694 196 HA VAL 21 HA VAL 21 -26.525 -5.561 -10.510 197 HB VAL 21 HB VAL 21 -25.577 -3.239 -12.235 198 HG11 VAL 21 HG11 VAL 21 -27.716 -5.387 -12.646 199 HG12 VAL 21 HG12 VAL 21 -27.460 -3.987 -13.704 200 HG13 VAL 21 HG13 VAL 21 -26.211 -5.219 -13.567 201 HG21 VAL 21 HG21 VAL 21 -27.035 -2.362 -10.481 202 HG22 VAL 21 HG22 VAL 21 -27.914 -2.413 -12.005 203 HG23 VAL 21 HG23 VAL 21 -28.220 -3.655 -10.773 204 H LEU 22 H LEU 22 -24.969 -7.127 -9.989 205 HA LEU 22 HA LEU 22 -22.822 -7.500 -12.023 206 HB2 LEU 22 HB2 LEU 22 -22.015 -6.636 -9.758 207 HB3 LEU 22 HB3 LEU 22 -22.606 -8.138 -9.058 208 HG LEU 22 HG LEU 22 -21.016 -9.377 -10.633 209 HD11 LEU 22 HD11 LEU 22 -19.898 -6.569 -11.042 210 HD12 LEU 22 HD12 LEU 22 -19.113 -8.083 -11.544 211 HD13 LEU 22 HD13 LEU 22 -20.628 -7.584 -12.302 212 HD21 LEU 22 HD21 LEU 22 -20.488 -9.018 -8.268 213 HD22 LEU 22 HD22 LEU 22 -19.031 -8.910 -9.267 214 HD23 LEU 22 HD23 LEU 22 -19.793 -7.425 -8.650 215 H LYS 23 H LYS 23 -22.474 -9.535 -12.742 216 HA LYS 23 HA LYS 23 -24.355 -11.718 -11.917 217 HB2 LYS 23 HB2 LYS 23 -23.308 -10.907 -14.649 218 HB3 LYS 23 HB3 LYS 23 -24.117 -12.443 -14.369 219 HG2 LYS 23 HG2 LYS 23 -25.432 -9.775 -13.726 220 HG3 LYS 23 HG3 LYS 23 -25.550 -10.589 -15.289 221 HD2 LYS 23 HD2 LYS 23 -26.542 -12.595 -14.179 222 HD3 LYS 23 HD3 LYS 23 -26.449 -11.772 -12.623 223 HE2 LYS 23 HE2 LYS 23 -28.696 -11.594 -13.388 224 HE3 LYS 23 HE3 LYS 23 -27.966 -9.987 -13.467 225 HZ1 LYS 23 HZ1 LYS 23 -28.305 -11.817 -15.793 226 HZ2 LYS 23 HZ2 LYS 23 -29.258 -10.536 -15.470 227 HZ3 LYS 23 HZ3 LYS 23 -27.695 -10.301 -15.869 228 H ASN 24 H ASN 24 -21.715 -11.216 -10.803 229 HA ASN 24 HA ASN 24 -20.526 -13.910 -11.304 230 HB2 ASN 24 HB2 ASN 24 -19.322 -11.846 -12.386 231 HB3 ASN 24 HB3 ASN 24 -18.796 -11.487 -10.738 232 HD21 ASN 24 HD21 ASN 24 -16.525 -14.240 -10.633 233 HD22 ASN 24 HD22 ASN 24 -17.537 -13.194 -9.623 234 HA PRO 25 HA PRO 25 -21.208 -12.892 -6.758 235 HB2 PRO 25 HB2 PRO 25 -23.353 -14.362 -6.030 236 HB3 PRO 25 HB3 PRO 25 -23.517 -12.877 -7.007 237 HG2 PRO 25 HG2 PRO 25 -23.378 -15.740 -8.042 238 HG3 PRO 25 HG3 PRO 25 -24.644 -14.511 -8.377 239 HD2 PRO 25 HD2 PRO 25 -22.538 -14.885 -10.067 240 HD3 PRO 25 HD3 PRO 25 -23.224 -13.264 -9.738 241 H ARG 26 H ARG 26 -19.125 -14.250 -7.456 242 HA ARG 26 HA ARG 26 -18.984 -16.946 -6.227 243 HB2 ARG 26 HB2 ARG 26 -16.836 -15.086 -7.327 244 HB3 ARG 26 HB3 ARG 26 -16.524 -16.688 -6.650 245 HG2 ARG 26 HG2 ARG 26 -17.960 -17.712 -8.414 246 HG3 ARG 26 HG3 ARG 26 -18.200 -16.099 -9.124 247 HD2 ARG 26 HD2 ARG 26 -15.690 -15.886 -9.295 248 HD3 ARG 26 HD3 ARG 26 -15.547 -17.570 -8.776 249 HE ARG 26 HE ARG 26 -17.138 -17.976 -10.843 250 HH11 ARG 26 HH11 ARG 26 -16.803 -18.056 -13.030 251 HH12 ARG 26 HH12 ARG 26 -15.507 -17.146 -13.750 252 HH21 ARG 26 HH21 ARG 26 -14.338 -15.849 -10.803 253 HH22 ARG 26 HH22 ARG 26 -14.181 -15.895 -12.533 254 H VAL 27 H VAL 27 -17.711 -13.755 -5.517 255 HA VAL 27 HA VAL 27 -16.500 -12.846 -3.881 256 HB VAL 27 HB VAL 27 -18.633 -14.124 -2.209 257 HG11 VAL 27 HG11 VAL 27 -16.753 -11.773 -1.613 258 HG12 VAL 27 HG12 VAL 27 -18.168 -12.213 -0.629 259 HG13 VAL 27 HG13 VAL 27 -16.793 -13.313 -0.738 260 HG21 VAL 27 HG21 VAL 27 -19.550 -12.709 -3.977 261 HG22 VAL 27 HG22 VAL 27 -19.722 -11.904 -2.416 262 HG23 VAL 27 HG23 VAL 27 -18.440 -11.390 -3.533 263 HA PRO 28 HA PRO 28 -13.697 -16.184 -2.664 264 HB2 PRO 28 HB2 PRO 28 -11.380 -14.803 -2.461 265 HB3 PRO 28 HB3 PRO 28 -12.128 -15.200 -4.035 266 HG2 PRO 28 HG2 PRO 28 -12.376 -12.597 -2.482 267 HG3 PRO 28 HG3 PRO 28 -11.946 -12.812 -4.210 268 HD2 PRO 28 HD2 PRO 28 -14.485 -12.252 -3.405 269 HD3 PRO 28 HD3 PRO 28 -14.176 -13.348 -4.787 270 H THR 29 H THR 29 -12.230 -16.626 -0.855 271 HA THR 29 HA THR 29 -13.642 -16.144 1.589 272 HB THR 29 HB THR 29 -11.961 -17.881 2.423 273 HG1 THR 29 HG1 THR 29 -10.742 -18.884 0.838 274 HG21 THR 29 HG21 THR 29 -13.536 -18.583 -0.091 275 HG22 THR 29 HG22 THR 29 -12.971 -19.710 1.162 276 HG23 THR 29 HG23 THR 29 -14.197 -18.496 1.558 277 H GLN 30 H GLN 30 -12.592 -13.704 1.007 278 HA GLN 30 HA GLN 30 -10.727 -13.278 3.268 279 HB2 GLN 30 HB2 GLN 30 -9.245 -11.865 1.930 280 HB3 GLN 30 HB3 GLN 30 -9.414 -13.442 1.166 281 HG2 GLN 30 HG2 GLN 30 -11.333 -12.280 -0.241 282 HG3 GLN 30 HG3 GLN 30 -10.581 -10.777 0.293 283 HE21 GLN 30 HE21 GLN 30 -8.674 -13.205 -2.430 284 HE22 GLN 30 HE22 GLN 30 -10.019 -13.831 -1.483 285 H LYS 31 H LYS 31 -13.566 -12.789 2.869 286 HA LYS 31 HA LYS 31 -13.943 -9.910 3.239 287 HB2 LYS 31 HB2 LYS 31 -15.613 -12.410 3.416 288 HB3 LYS 31 HB3 LYS 31 -16.310 -10.858 3.901 289 HG2 LYS 31 HG2 LYS 31 -15.114 -11.263 1.128 290 HG3 LYS 31 HG3 LYS 31 -16.757 -11.739 1.529 291 HD2 LYS 31 HD2 LYS 31 -16.911 -9.626 0.501 292 HD3 LYS 31 HD3 LYS 31 -17.285 -9.393 2.209 293 HE2 LYS 31 HE2 LYS 31 -15.026 -8.467 2.592 294 HE3 LYS 31 HE3 LYS 31 -14.581 -8.812 0.913 295 HZ1 LYS 31 HZ1 LYS 31 -16.639 -6.868 1.816 296 HZ2 LYS 31 HZ2 LYS 31 -15.183 -6.519 1.145 297 HZ3 LYS 31 HZ3 LYS 31 -16.348 -7.230 0.246 298 H THR 32 H THR 32 -12.132 -10.010 4.830 299 HA THR 32 HA THR 32 -13.188 -10.302 7.617 300 HB THR 32 HB THR 32 -11.346 -11.836 6.893 301 HG1 THR 32 HG1 THR 32 -10.310 -11.658 8.847 302 HG21 THR 32 HG21 THR 32 -9.572 -9.369 7.145 303 HG22 THR 32 HG22 THR 32 -9.052 -11.046 6.893 304 HG23 THR 32 HG23 THR 32 -9.952 -10.209 5.622 305 H GLY 33 H GLY 33 -13.016 -7.968 5.525 306 HA2 GLY 33 HA2 GLY 33 -13.429 -5.731 5.869 307 HA3 GLY 33 HA3 GLY 33 -12.993 -5.906 7.563 308 H GLU 34 H GLU 34 -10.315 -7.037 5.870 309 HA GLU 34 HA GLU 34 -8.943 -4.429 6.221 310 HB2 GLU 34 HB2 GLU 34 -7.817 -7.210 5.779 311 HB3 GLU 34 HB3 GLU 34 -6.868 -5.727 5.947 312 HG2 GLU 34 HG2 GLU 34 -8.102 -5.363 8.185 313 HG3 GLU 34 HG3 GLU 34 -8.614 -7.046 8.046 314 H LEU 35 H LEU 35 -9.349 -6.797 3.570 315 HA LEU 35 HA LEU 35 -8.947 -4.661 1.591 316 HB2 LEU 35 HB2 LEU 35 -7.083 -7.058 1.861 317 HB3 LEU 35 HB3 LEU 35 -7.413 -6.303 0.319 318 HG LEU 35 HG LEU 35 -6.776 -4.076 1.783 319 HD11 LEU 35 HD11 LEU 35 -4.890 -6.298 2.686 320 HD12 LEU 35 HD12 LEU 35 -4.694 -4.558 2.993 321 HD13 LEU 35 HD13 LEU 35 -6.035 -5.441 3.734 322 HD21 LEU 35 HD21 LEU 35 -5.964 -4.631 -0.467 323 HD22 LEU 35 HD22 LEU 35 -4.614 -4.176 0.584 324 HD23 LEU 35 HD23 LEU 35 -4.916 -5.888 0.203 325 H SER 36 H SER 36 -10.429 -4.795 0.165 326 HA SER 36 HA SER 36 -11.866 -7.358 -0.432 327 HB2 SER 36 HB2 SER 36 -12.844 -4.519 -0.730 328 HB3 SER 36 HB3 SER 36 -13.710 -5.983 -1.222 329 HG SER 36 HG SER 36 -12.870 -5.283 1.411 330 H GLU 37 H GLU 37 -11.265 -4.426 -2.314 331 HA GLU 37 HA GLU 37 -10.006 -5.941 -4.468 332 HB2 GLU 37 HB2 GLU 37 -12.786 -6.115 -4.324 333 HB3 GLU 37 HB3 GLU 37 -12.571 -4.735 -5.414 334 HG2 GLU 37 HG2 GLU 37 -10.950 -6.141 -6.738 335 HG3 GLU 37 HG3 GLU 37 -11.292 -7.483 -5.637 336 H GLU 38 H GLU 38 -11.811 -3.009 -3.626 337 HA GLU 38 HA GLU 38 -10.413 -1.165 -5.353 338 HB2 GLU 38 HB2 GLU 38 -11.779 -0.805 -2.650 339 HB3 GLU 38 HB3 GLU 38 -11.160 0.533 -3.613 340 HG2 GLU 38 HG2 GLU 38 -13.305 -1.417 -4.566 341 HG3 GLU 38 HG3 GLU 38 -13.624 0.146 -3.828 342 H GLN 39 H GLN 39 -9.654 -2.543 -2.183 343 HA GLN 39 HA GLN 39 -7.509 -0.762 -1.506 344 HB2 GLN 39 HB2 GLN 39 -8.137 -3.570 -0.526 345 HB3 GLN 39 HB3 GLN 39 -6.972 -2.447 0.181 346 HG2 GLN 39 HG2 GLN 39 -8.913 -2.265 1.528 347 HG3 GLN 39 HG3 GLN 39 -8.832 -0.798 0.564 348 HE21 GLN 39 HE21 GLN 39 -12.299 -1.411 0.090 349 HE22 GLN 39 HE22 GLN 39 -11.111 -0.458 0.977 350 H LYS 40 H LYS 40 -7.531 -3.887 -3.243 351 HA LYS 40 HA LYS 40 -4.646 -3.972 -3.595 352 HB2 LYS 40 HB2 LYS 40 -6.991 -5.277 -5.038 353 HB3 LYS 40 HB3 LYS 40 -5.342 -5.505 -5.605 354 HG2 LYS 40 HG2 LYS 40 -4.783 -6.943 -4.012 355 HG3 LYS 40 HG3 LYS 40 -5.456 -5.971 -2.725 356 HD2 LYS 40 HD2 LYS 40 -7.643 -7.184 -4.263 357 HD3 LYS 40 HD3 LYS 40 -6.465 -8.420 -3.780 358 HE2 LYS 40 HE2 LYS 40 -6.545 -7.523 -1.440 359 HE3 LYS 40 HE3 LYS 40 -7.797 -6.378 -1.954 360 HZ1 LYS 40 HZ1 LYS 40 -8.070 -9.357 -2.007 361 HZ2 LYS 40 HZ2 LYS 40 -8.749 -8.380 -0.913 362 HZ3 LYS 40 HZ3 LYS 40 -9.233 -8.288 -2.466 363 H LYS 41 H LYS 41 -7.243 -2.530 -5.482 364 HA LYS 41 HA LYS 41 -5.541 -1.512 -7.583 365 HB2 LYS 41 HB2 LYS 41 -8.240 -0.504 -6.608 366 HB3 LYS 41 HB3 LYS 41 -7.420 0.072 -8.055 367 HG2 LYS 41 HG2 LYS 41 -7.464 -2.161 -9.043 368 HG3 LYS 41 HG3 LYS 41 -8.244 -2.821 -7.594 369 HD2 LYS 41 HD2 LYS 41 -10.184 -1.359 -7.919 370 HD3 LYS 41 HD3 LYS 41 -9.451 -0.632 -9.352 371 HE2 LYS 41 HE2 LYS 41 -10.110 -3.602 -9.064 372 HE3 LYS 41 HE3 LYS 41 -11.207 -2.414 -9.773 373 HZ1 LYS 41 HZ1 LYS 41 -8.512 -3.068 -10.841 374 HZ2 LYS 41 HZ2 LYS 41 -9.934 -3.523 -11.497 375 HZ3 LYS 41 HZ3 LYS 41 -9.523 -1.945 -11.470 376 H ILE 42 H ILE 42 -5.354 -0.682 -4.391 377 HA ILE 42 HA ILE 42 -4.055 1.947 -4.989 378 HB ILE 42 HB ILE 42 -5.298 0.795 -2.482 379 HG12 ILE 42 HG12 ILE 42 -6.116 3.413 -3.771 380 HG13 ILE 42 HG13 ILE 42 -6.672 1.928 -4.511 381 HG21 ILE 42 HG21 ILE 42 -3.814 3.429 -2.768 382 HG22 ILE 42 HG22 ILE 42 -4.896 3.020 -1.415 383 HG23 ILE 42 HG23 ILE 42 -3.439 2.080 -1.670 384 HD11 ILE 42 HD11 ILE 42 -7.185 2.706 -1.634 385 HD12 ILE 42 HD12 ILE 42 -8.356 2.611 -2.978 386 HD13 ILE 42 HD13 ILE 42 -7.578 1.142 -2.369 387 H VAL 43 H VAL 43 -3.337 -1.333 -4.218 388 HA VAL 43 HA VAL 43 -0.594 -0.567 -3.273 389 HB VAL 43 HB VAL 43 -2.133 -3.005 -2.318 390 HG11 VAL 43 HG11 VAL 43 0.531 -1.714 -1.513 391 HG12 VAL 43 HG12 VAL 43 -0.229 -3.068 -0.665 392 HG13 VAL 43 HG13 VAL 43 0.333 -3.286 -2.316 393 HG21 VAL 43 HG21 VAL 43 -3.206 -1.071 -1.361 394 HG22 VAL 43 HG22 VAL 43 -2.148 -1.736 -0.121 395 HG23 VAL 43 HG23 VAL 43 -1.654 -0.294 -1.038 396 H ALA 44 H ALA 44 -2.318 -3.426 -4.721 397 HA ALA 44 HA ALA 44 0.100 -4.518 -5.849 398 HB1 ALA 44 HB1 ALA 44 -2.824 -4.875 -6.655 399 HB2 ALA 44 HB2 ALA 44 -1.464 -5.920 -7.125 400 HB3 ALA 44 HB3 ALA 44 -1.956 -5.828 -5.422 401 H ASP 45 H ASP 45 -2.407 -2.307 -7.072 402 HA ASP 45 HA ASP 45 -1.300 -1.849 -9.684 403 HB2 ASP 45 HB2 ASP 45 -3.592 -1.237 -8.916 404 HB3 ASP 45 HB3 ASP 45 -2.891 0.027 -7.901 405 H TYR 46 H TYR 46 -0.426 -0.478 -6.515 406 HA TYR 46 HA TYR 46 1.226 1.637 -7.632 407 HB2 TYR 46 HB2 TYR 46 -0.050 1.542 -5.384 408 HB3 TYR 46 HB3 TYR 46 1.313 0.616 -4.772 409 HD1 TYR 46 HD1 TYR 46 0.718 2.814 -3.243 410 HD2 TYR 46 HD2 TYR 46 2.912 2.819 -6.952 411 HE1 TYR 46 HE1 TYR 46 1.642 5.089 -2.718 412 HE2 TYR 46 HE2 TYR 46 3.912 4.963 -6.408 413 HH TYR 46 HH TYR 46 2.997 6.805 -3.434 414 H ILE 47 H ILE 47 1.796 -1.571 -6.197 415 HA ILE 47 HA ILE 47 4.644 -1.680 -6.501 416 HB ILE 47 HB ILE 47 2.373 -3.594 -6.100 417 HG12 ILE 47 HG12 ILE 47 3.657 -4.317 -4.188 418 HG13 ILE 47 HG13 ILE 47 5.094 -3.482 -4.752 419 HG21 ILE 47 HG21 ILE 47 5.110 -4.573 -6.960 420 HG22 ILE 47 HG22 ILE 47 3.838 -5.569 -6.224 421 HG23 ILE 47 HG23 ILE 47 3.563 -4.839 -7.809 422 HD11 ILE 47 HD11 ILE 47 2.564 -2.186 -3.663 423 HD12 ILE 47 HD12 ILE 47 4.171 -2.255 -2.910 424 HD13 ILE 47 HD13 ILE 47 3.922 -1.288 -4.369 425 H SER 48 H SER 48 2.014 -2.210 -8.829 426 HA SER 48 HA SER 48 3.728 -2.932 -11.030 427 HB2 SER 48 HB2 SER 48 1.150 -3.199 -10.703 428 HB3 SER 48 HB3 SER 48 1.064 -1.547 -11.350 429 HG SER 48 HG SER 48 0.901 -3.180 -12.980 430 H GLU 49 H GLU 49 3.294 0.200 -9.498 431 HA GLU 49 HA GLU 49 3.851 1.650 -12.031 432 HB2 GLU 49 HB2 GLU 49 1.816 2.142 -10.636 433 HB3 GLU 49 HB3 GLU 49 2.889 2.670 -9.343 434 HG2 GLU 49 HG2 GLU 49 2.115 4.604 -10.469 435 HG3 GLU 49 HG3 GLU 49 3.810 4.426 -10.896 436 H VAL 50 H VAL 50 5.097 1.390 -8.651 437 HA VAL 50 HA VAL 50 7.572 2.823 -9.558 438 HB VAL 50 HB VAL 50 7.678 4.042 -7.517 439 HG11 VAL 50 HG11 VAL 50 4.825 4.267 -8.493 440 HG12 VAL 50 HG12 VAL 50 5.821 5.507 -7.698 441 HG13 VAL 50 HG13 VAL 50 6.242 4.948 -9.323 442 HG21 VAL 50 HG21 VAL 50 6.863 2.415 -5.913 443 HG22 VAL 50 HG22 VAL 50 5.991 3.942 -5.785 444 HG23 VAL 50 HG23 VAL 50 5.224 2.542 -6.579 445 H GLY 51 H GLY 51 6.456 -0.040 -8.012 446 HA2 GLY 51 HA2 GLY 51 8.297 -1.741 -8.377 447 HA3 GLY 51 HA3 GLY 51 9.277 -0.766 -7.280 448 H LEU 52 H LEU 52 8.498 -0.435 -5.155 449 HA LEU 52 HA LEU 52 6.535 -2.022 -3.801 450 HB2 LEU 52 HB2 LEU 52 8.024 -3.882 -4.444 451 HB3 LEU 52 HB3 LEU 52 9.424 -3.081 -3.761 452 HG LEU 52 HG LEU 52 7.103 -3.541 -1.935 453 HD11 LEU 52 HD11 LEU 52 8.924 -5.763 -2.961 454 HD12 LEU 52 HD12 LEU 52 7.844 -5.922 -1.561 455 HD13 LEU 52 HD13 LEU 52 7.167 -5.655 -3.180 456 HD21 LEU 52 HD21 LEU 52 9.110 -2.596 -0.935 457 HD22 LEU 52 HD22 LEU 52 8.894 -4.228 -0.336 458 HD23 LEU 52 HD23 LEU 52 10.102 -3.915 -1.602 459 H ASN 53 H ASN 53 9.719 -0.736 -3.580 460 HA ASN 53 HA ASN 53 9.291 0.339 -0.858 461 HB2 ASN 53 HB2 ASN 53 11.432 -0.220 -0.337 462 HB3 ASN 53 HB3 ASN 53 11.056 -1.475 -1.513 463 HD21 ASN 53 HD21 ASN 53 13.438 -0.261 -3.890 464 HD22 ASN 53 HD22 ASN 53 11.966 -1.199 -3.746 465 H ASN 54 H ASN 54 9.344 1.641 -3.882 466 HA ASN 54 HA ASN 54 10.659 4.182 -3.128 467 HB2 ASN 54 HB2 ASN 54 9.385 3.316 -5.744 468 HB3 ASN 54 HB3 ASN 54 10.399 4.739 -5.491 469 HD21 ASN 54 HD21 ASN 54 12.152 1.242 -6.328 470 HD22 ASN 54 HD22 ASN 54 10.463 1.629 -6.652 471 H LEU 55 H LEU 55 7.449 2.865 -3.373 472 HA LEU 55 HA LEU 55 5.953 5.349 -3.156 473 HB2 LEU 55 HB2 LEU 55 4.132 3.862 -2.464 474 HB3 LEU 55 HB3 LEU 55 4.887 3.340 -3.947 475 HG LEU 55 HG LEU 55 6.277 1.849 -2.036 476 HD11 LEU 55 HD11 LEU 55 3.344 1.977 -1.229 477 HD12 LEU 55 HD12 LEU 55 4.548 0.813 -0.639 478 HD13 LEU 55 HD13 LEU 55 4.717 2.534 -0.248 479 HD21 LEU 55 HD21 LEU 55 5.401 1.022 -4.192 480 HD22 LEU 55 HD22 LEU 55 4.947 -0.022 -2.842 481 HD23 LEU 55 HD23 LEU 55 3.747 1.085 -3.544 482 H ASN 56 H ASN 56 4.641 5.830 -1.146 483 HA ASN 56 HA ASN 56 6.120 5.195 1.356 484 HB2 ASN 56 HB2 ASN 56 5.798 7.400 2.188 485 HB3 ASN 56 HB3 ASN 56 6.550 7.523 0.610 486 HD21 ASN 56 HD21 ASN 56 4.119 9.999 -0.040 487 HD22 ASN 56 HD22 ASN 56 5.832 9.637 0.169 488 H ALA 57 H ALA 57 4.703 5.698 3.266 489 HA ALA 57 HA ALA 57 2.415 3.900 3.163 490 HB1 ALA 57 HB1 ALA 57 3.748 5.606 5.307 491 HB2 ALA 57 HB2 ALA 57 2.472 4.407 5.624 492 HB3 ALA 57 HB3 ALA 57 4.034 3.883 4.959 493 H THR 58 H THR 58 2.914 7.389 3.389 494 HA THR 58 HA THR 58 0.401 8.183 4.411 495 HB THR 58 HB THR 58 2.262 9.776 2.605 496 HG1 THR 58 HG1 THR 58 3.266 10.366 4.538 497 HG21 THR 58 HG21 THR 58 0.311 10.626 4.791 498 HG22 THR 58 HG22 THR 58 1.479 11.701 3.982 499 HG23 THR 58 HG23 THR 58 0.178 10.959 3.048 500 H GLU 59 H GLU 59 1.517 8.083 0.995 501 HA GLU 59 HA GLU 59 -0.994 8.990 -0.127 502 HB2 GLU 59 HB2 GLU 59 1.306 7.327 -1.285 503 HB3 GLU 59 HB3 GLU 59 -0.015 7.965 -2.256 504 HG2 GLU 59 HG2 GLU 59 1.924 9.693 -0.660 505 HG3 GLU 59 HG3 GLU 59 2.093 9.298 -2.361 506 H LEU 60 H LEU 60 0.153 5.852 0.830 507 HA LEU 60 HA LEU 60 -1.948 4.318 -0.465 508 HB2 LEU 60 HB2 LEU 60 0.454 3.687 0.083 509 HB3 LEU 60 HB3 LEU 60 -0.022 3.521 1.764 510 HG LEU 60 HG LEU 60 -1.314 1.964 -0.517 511 HD11 LEU 60 HD11 LEU 60 1.078 1.268 1.235 512 HD12 LEU 60 HD12 LEU 60 0.244 0.114 0.181 513 HD13 LEU 60 HD13 LEU 60 1.068 1.510 -0.531 514 HD21 LEU 60 HD21 LEU 60 -2.637 1.896 1.551 515 HD22 LEU 60 HD22 LEU 60 -1.843 0.340 1.322 516 HD23 LEU 60 HD23 LEU 60 -1.186 1.488 2.495 517 H SER 61 H SER 61 -1.308 5.425 2.917 518 HA SER 61 HA SER 61 -3.734 4.395 4.020 519 HB2 SER 61 HB2 SER 61 -3.155 5.629 5.982 520 HB3 SER 61 HB3 SER 61 -1.687 4.899 5.324 521 HG SER 61 HG SER 61 -1.443 7.118 5.959 522 H LYS 62 H LYS 62 -2.988 7.471 2.470 523 HA LYS 62 HA LYS 62 -5.442 8.850 3.122 524 HB2 LYS 62 HB2 LYS 62 -3.396 9.105 0.891 525 HB3 LYS 62 HB3 LYS 62 -4.850 10.106 0.913 526 HG2 LYS 62 HG2 LYS 62 -4.271 11.180 2.945 527 HG3 LYS 62 HG3 LYS 62 -3.041 9.989 3.344 528 HD2 LYS 62 HD2 LYS 62 -1.974 12.042 2.622 529 HD3 LYS 62 HD3 LYS 62 -1.635 10.755 1.456 530 HE2 LYS 62 HE2 LYS 62 -3.447 11.651 -0.020 531 HE3 LYS 62 HE3 LYS 62 -3.724 12.959 1.140 532 HZ1 LYS 62 HZ1 LYS 62 -1.167 12.454 -0.311 533 HZ2 LYS 62 HZ2 LYS 62 -2.234 13.643 -0.667 534 HZ3 LYS 62 HZ3 LYS 62 -1.421 13.681 0.749 535 H ARG 63 H ARG 63 -4.652 6.658 0.436 536 HA ARG 63 HA ARG 63 -7.340 6.967 -0.774 537 HB2 ARG 63 HB2 ARG 63 -4.877 5.349 -1.512 538 HB3 ARG 63 HB3 ARG 63 -6.416 5.250 -2.386 539 HG2 ARG 63 HG2 ARG 63 -6.302 7.677 -2.877 540 HG3 ARG 63 HG3 ARG 63 -4.727 7.768 -2.062 541 HD2 ARG 63 HD2 ARG 63 -3.785 6.136 -3.672 542 HD3 ARG 63 HD3 ARG 63 -5.364 5.959 -4.433 543 HE ARG 63 HE ARG 63 -5.166 8.034 -5.477 544 HH11 ARG 63 HH11 ARG 63 -3.987 9.635 -6.439 545 HH12 ARG 63 HH12 ARG 63 -2.384 10.002 -5.867 546 HH21 ARG 63 HH21 ARG 63 -2.383 7.643 -3.381 547 HH22 ARG 63 HH22 ARG 63 -1.514 8.946 -4.157 548 H LEU 64 H LEU 64 -5.576 4.375 0.928 549 HA LEU 64 HA LEU 64 -7.820 2.518 0.751 550 HB2 LEU 64 HB2 LEU 64 -5.228 2.184 0.768 551 HB3 LEU 64 HB3 LEU 64 -5.384 2.177 2.513 552 HG LEU 64 HG LEU 64 -6.861 0.294 0.629 553 HD11 LEU 64 HD11 LEU 64 -4.221 -0.140 2.072 554 HD12 LEU 64 HD12 LEU 64 -5.091 -1.351 1.108 555 HD13 LEU 64 HD13 LEU 64 -4.434 0.086 0.321 556 HD21 LEU 64 HD21 LEU 64 -7.866 0.181 2.841 557 HD22 LEU 64 HD22 LEU 64 -6.843 -1.234 2.662 558 HD23 LEU 64 HD23 LEU 64 -6.267 0.143 3.618 559 H ASN 65 H ASN 65 -6.876 5.003 2.976 560 HA ASN 65 HA ASN 65 -7.770 5.882 4.809 561 HB2 ASN 65 HB2 ASN 65 -9.866 5.734 3.454 562 HB3 ASN 65 HB3 ASN 65 -10.282 4.255 4.319 563 HD21 ASN 65 HD21 ASN 65 -10.995 6.001 7.404 564 HD22 ASN 65 HD22 ASN 65 -10.304 4.491 6.796 565 H ILE 66 H ILE 66 -6.003 4.720 5.674 566 HA ILE 66 HA ILE 66 -6.721 3.009 7.994 567 HB ILE 66 HB ILE 66 -4.468 1.769 7.563 568 HG12 ILE 66 HG12 ILE 66 -5.006 2.703 4.730 569 HG13 ILE 66 HG13 ILE 66 -3.679 3.217 5.792 570 HG21 ILE 66 HG21 ILE 66 -6.843 1.098 5.833 571 HG22 ILE 66 HG22 ILE 66 -5.548 0.001 6.397 572 HG23 ILE 66 HG23 ILE 66 -6.643 0.728 7.568 573 HD11 ILE 66 HD11 ILE 66 -4.078 0.435 4.654 574 HD12 ILE 66 HD12 ILE 66 -2.908 1.663 4.146 575 HD13 ILE 66 HD13 ILE 66 -2.774 0.933 5.766 576 H THR 67 H THR 67 -4.644 2.743 9.314 577 HA THR 67 HA THR 67 -3.523 5.340 10.114 578 HB THR 67 HB THR 67 -3.263 2.469 11.073 579 HG1 THR 67 HG1 THR 67 -4.336 3.327 12.844 580 HG21 THR 67 HG21 THR 67 -1.833 4.917 12.160 581 HG22 THR 67 HG22 THR 67 -2.062 3.392 13.054 582 HG23 THR 67 HG23 THR 67 -1.122 3.388 11.567 583 H VAL 68 H VAL 68 -1.374 5.977 9.766 584 HA VAL 68 HA VAL 68 -0.084 5.180 7.377 585 HB VAL 68 HB VAL 68 1.312 6.460 9.755 586 HG11 VAL 68 HG11 VAL 68 1.783 6.713 6.751 587 HG12 VAL 68 HG12 VAL 68 2.673 7.578 8.021 588 HG13 VAL 68 HG13 VAL 68 2.816 5.825 7.895 589 HG21 VAL 68 HG21 VAL 68 -0.726 7.782 9.325 590 HG22 VAL 68 HG22 VAL 68 0.700 8.656 8.778 591 HG23 VAL 68 HG23 VAL 68 -0.335 7.843 7.591 592 H ASP 69 H ASP 69 0.536 4.122 10.707 593 HA ASP 69 HA ASP 69 2.808 2.486 10.055 594 HB2 ASP 69 HB2 ASP 69 2.308 3.418 12.315 595 HB3 ASP 69 HB3 ASP 69 0.932 2.320 12.444 596 H LYS 70 H LYS 70 -0.653 1.814 9.958 597 HA LYS 70 HA LYS 70 -0.371 -1.060 9.595 598 HB2 LYS 70 HB2 LYS 70 -2.564 0.960 9.444 599 HB3 LYS 70 HB3 LYS 70 -2.721 -0.308 8.250 600 HG2 LYS 70 HG2 LYS 70 -2.310 -0.903 11.203 601 HG3 LYS 70 HG3 LYS 70 -3.900 -0.641 10.475 602 HD2 LYS 70 HD2 LYS 70 -3.486 -2.521 8.881 603 HD3 LYS 70 HD3 LYS 70 -1.939 -2.846 9.696 604 HE2 LYS 70 HE2 LYS 70 -3.142 -3.216 11.830 605 HE3 LYS 70 HE3 LYS 70 -4.684 -2.858 11.045 606 HZ1 LYS 70 HZ1 LYS 70 -2.932 -5.127 10.251 607 HZ2 LYS 70 HZ2 LYS 70 -4.213 -5.265 11.248 608 HZ3 LYS 70 HZ3 LYS 70 -4.457 -4.856 9.703 609 H ALA 71 H ALA 71 -0.236 1.729 7.427 610 HA ALA 71 HA ALA 71 -0.152 0.077 4.989 611 HB1 ALA 71 HB1 ALA 71 0.702 2.970 5.509 612 HB2 ALA 71 HB2 ALA 71 0.577 2.198 3.921 613 HB3 ALA 71 HB3 ALA 71 -0.873 2.449 4.914 614 H LYS 72 H LYS 72 2.266 1.755 7.006 615 HA LYS 72 HA LYS 72 4.609 0.977 5.624 616 HB2 LYS 72 HB2 LYS 72 3.908 2.269 8.102 617 HB3 LYS 72 HB3 LYS 72 5.131 1.077 8.490 618 HG2 LYS 72 HG2 LYS 72 6.764 2.098 7.138 619 HG3 LYS 72 HG3 LYS 72 5.574 2.873 6.101 620 HD2 LYS 72 HD2 LYS 72 6.458 4.627 7.373 621 HD3 LYS 72 HD3 LYS 72 4.857 4.292 8.064 622 HE2 LYS 72 HE2 LYS 72 5.904 3.009 9.902 623 HE3 LYS 72 HE3 LYS 72 7.499 3.223 9.170 624 HZ1 LYS 72 HZ1 LYS 72 5.801 5.435 10.203 625 HZ2 LYS 72 HZ2 LYS 72 7.130 4.838 10.939 626 HZ3 LYS 72 HZ3 LYS 72 7.274 5.624 9.519 627 H THR 73 H THR 73 2.966 -0.793 8.260 628 HA THR 73 HA THR 73 4.944 -2.955 8.024 629 HB THR 73 HB THR 73 3.771 -2.182 10.155 630 HG1 THR 73 HG1 THR 73 4.024 -4.269 10.963 631 HG21 THR 73 HG21 THR 73 1.710 -4.270 9.330 632 HG22 THR 73 HG22 THR 73 1.803 -3.372 10.860 633 HG23 THR 73 HG23 THR 73 1.406 -2.519 9.362 634 H TYR 74 H TYR 74 1.556 -2.553 6.896 635 HA TYR 74 HA TYR 74 1.217 -5.192 5.930 636 HB2 TYR 74 HB2 TYR 74 -0.643 -3.687 6.170 637 HB3 TYR 74 HB3 TYR 74 0.074 -2.538 5.029 638 HD1 TYR 74 HD1 TYR 74 -1.135 -6.102 5.198 639 HD2 TYR 74 HD2 TYR 74 -0.527 -2.558 2.804 640 HE1 TYR 74 HE1 TYR 74 -2.160 -7.248 3.239 641 HE2 TYR 74 HE2 TYR 74 -1.613 -3.675 0.889 642 HH TYR 74 HH TYR 74 -2.639 -7.117 1.005 643 H ILE 75 H ILE 75 2.748 -2.376 4.299 644 HA ILE 75 HA ILE 75 3.195 -3.429 1.743 645 HB ILE 75 HB ILE 75 4.835 -1.622 3.536 646 HG12 ILE 75 HG12 ILE 75 3.486 -0.969 0.881 647 HG13 ILE 75 HG13 ILE 75 2.588 -0.941 2.383 648 HG21 ILE 75 HG21 ILE 75 5.526 -2.410 0.673 649 HG22 ILE 75 HG22 ILE 75 6.244 -1.040 1.542 650 HG23 ILE 75 HG23 ILE 75 6.524 -2.666 2.131 651 HD11 ILE 75 HD11 ILE 75 5.017 0.803 1.752 652 HD12 ILE 75 HD12 ILE 75 3.334 1.320 1.863 653 HD13 ILE 75 HD13 ILE 75 4.176 0.760 3.314 654 H LYS 76 H LYS 76 5.157 -4.101 4.683 655 HA LYS 76 HA LYS 76 6.747 -6.090 3.154 656 HB2 LYS 76 HB2 LYS 76 8.249 -6.108 5.071 657 HB3 LYS 76 HB3 LYS 76 7.968 -4.457 4.517 658 HG2 LYS 76 HG2 LYS 76 6.438 -4.023 6.365 659 HG3 LYS 76 HG3 LYS 76 6.498 -5.722 6.878 660 HD2 LYS 76 HD2 LYS 76 8.906 -5.488 7.389 661 HD3 LYS 76 HD3 LYS 76 8.846 -3.780 6.894 662 HE2 LYS 76 HE2 LYS 76 7.172 -3.310 8.646 663 HE3 LYS 76 HE3 LYS 76 7.135 -5.015 9.106 664 HZ1 LYS 76 HZ1 LYS 76 9.515 -3.246 9.339 665 HZ2 LYS 76 HZ2 LYS 76 8.576 -3.736 10.582 666 HZ3 LYS 76 HZ3 LYS 76 9.475 -4.823 9.764 667 H ASN 77 H ASN 77 4.017 -6.253 5.275 668 HA ASN 77 HA ASN 77 4.493 -9.127 5.803 669 HB2 ASN 77 HB2 ASN 77 2.006 -7.423 6.224 670 HB3 ASN 77 HB3 ASN 77 2.208 -9.096 6.738 671 HD21 ASN 77 HD21 ASN 77 4.756 -7.951 9.245 672 HD22 ASN 77 HD22 ASN 77 4.896 -8.961 7.814 673 H SER 78 H SER 78 2.733 -7.200 3.423 674 HA SER 78 HA SER 78 1.450 -9.522 2.206 675 HB2 SER 78 HB2 SER 78 0.421 -7.282 2.320 676 HB3 SER 78 HB3 SER 78 1.657 -6.660 1.214 677 HG SER 78 HG SER 78 -0.335 -7.326 0.182 678 H ASN 79 H ASN 79 4.068 -7.314 1.211 679 HA ASN 79 HA ASN 79 4.617 -9.034 -1.146 680 HB2 ASN 79 HB2 ASN 79 5.787 -6.308 -0.575 681 HB3 ASN 79 HB3 ASN 79 5.706 -7.171 -2.114 682 HD21 ASN 79 HD21 ASN 79 2.583 -4.922 -0.823 683 HD22 ASN 79 HD22 ASN 79 4.012 -5.231 0.187 684 H ARG 80 H ARG 80 6.139 -8.038 1.799 685 HA ARG 80 HA ARG 80 8.069 -8.451 2.812 686 HB2 ARG 80 HB2 ARG 80 6.678 -10.756 2.388 687 HB3 ARG 80 HB3 ARG 80 8.196 -11.237 1.676 688 HG2 ARG 80 HG2 ARG 80 7.568 -10.465 4.538 689 HG3 ARG 80 HG3 ARG 80 8.167 -11.995 3.918 690 HD2 ARG 80 HD2 ARG 80 10.341 -10.852 3.360 691 HD3 ARG 80 HD3 ARG 80 9.742 -9.401 4.178 692 HE ARG 80 HE ARG 80 10.764 -11.847 5.369 693 HH11 ARG 80 HH11 ARG 80 11.005 -12.016 7.552 694 HH12 ARG 80 HH12 ARG 80 10.161 -10.930 8.615 695 HH21 ARG 80 HH21 ARG 80 8.595 -9.186 6.103 696 HH22 ARG 80 HH22 ARG 80 8.846 -9.356 7.821 697 H MET 81 H MET 81 8.627 -7.096 0.542 698 HA MET 81 HA MET 81 10.253 -6.328 -0.840 699 HB2 MET 81 HB2 MET 81 12.050 -8.089 0.847 700 HB3 MET 81 HB3 MET 81 12.644 -7.041 -0.427 701 HG2 MET 81 HG2 MET 81 10.897 -5.948 1.792 702 HG3 MET 81 HG3 MET 81 12.627 -6.176 1.996 703 HE1 MET 81 HE1 MET 81 12.646 -3.552 2.692 704 HE2 MET 81 HE2 MET 81 12.095 -2.261 1.600 705 HE3 MET 81 HE3 MET 81 10.920 -3.406 2.286 706 H GLY 82 H GLY 82 10.695 -9.869 -0.630 707 HA2 GLY 82 HA2 GLY 82 9.692 -11.206 -2.411 708 HA3 GLY 82 HA3 GLY 82 10.313 -10.054 -3.599 709 H ARG 83 H ARG 83 12.808 -9.654 -3.167 710 HA ARG 83 HA ARG 83 14.304 -12.140 -2.474 711 HB2 ARG 83 HB2 ARG 83 14.663 -10.603 -5.070 712 HB3 ARG 83 HB3 ARG 83 15.794 -11.786 -4.397 713 HG2 ARG 83 HG2 ARG 83 14.687 -13.166 -5.848 714 HG3 ARG 83 HG3 ARG 83 13.726 -13.412 -4.402 715 HD2 ARG 83 HD2 ARG 83 12.084 -13.135 -6.021 716 HD3 ARG 83 HD3 ARG 83 12.191 -11.506 -5.389 717 HE ARG 83 HE ARG 83 13.299 -10.765 -7.346 718 HH11 ARG 83 HH11 ARG 83 13.527 -10.818 -9.556 719 HH12 ARG 83 HH12 ARG 83 13.278 -12.306 -10.419 720 HH21 ARG 83 HH21 ARG 83 12.542 -14.178 -7.648 721 HH22 ARG 83 HH22 ARG 83 12.729 -14.155 -9.380 722 H THR 84 H THR 84 14.293 -10.589 -0.590 723 HA THR 84 HA THR 84 15.573 -9.516 0.916 724 HB THR 84 HB THR 84 17.960 -10.074 0.906 725 HG1 THR 84 HG1 THR 84 18.735 -11.481 -0.663 726 HG21 THR 84 HG21 THR 84 16.088 -12.377 0.229 727 HG22 THR 84 HG22 THR 84 17.591 -12.481 1.180 728 HG23 THR 84 HG23 THR 84 16.203 -11.571 1.808 729 H ASN 85 H ASN 85 14.692 -7.841 -1.022 730 HA ASN 85 HA ASN 85 16.769 -6.131 -2.028 731 HB2 ASN 85 HB2 ASN 85 14.628 -6.714 -3.177 732 HB3 ASN 85 HB3 ASN 85 13.749 -5.744 -1.995 733 HD21 ASN 85 HD21 ASN 85 16.020 -3.839 -4.857 734 HD22 ASN 85 HD22 ASN 85 16.399 -5.503 -4.432 735 H ASN 86 H ASN 86 15.475 -6.397 0.937 736 HA ASN 86 HA ASN 86 15.333 -3.736 2.040 737 HB2 ASN 86 HB2 ASN 86 14.174 -5.329 3.254 738 HB3 ASN 86 HB3 ASN 86 15.320 -6.622 2.901 739 HD21 ASN 86 HD21 ASN 86 17.235 -6.199 5.765 740 HD22 ASN 86 HD22 ASN 86 17.092 -6.946 4.173 741 H PHE 87 H PHE 87 18.030 -5.749 1.187 742 HA PHE 87 HA PHE 87 19.913 -5.042 3.137 743 HB2 PHE 87 HB2 PHE 87 21.370 -6.350 1.905 744 HB3 PHE 87 HB3 PHE 87 19.799 -7.004 1.480 745 HD1 PHE 87 HD1 PHE 87 22.884 -6.279 0.112 746 HD2 PHE 87 HD2 PHE 87 18.716 -5.538 -0.701 747 HE1 PHE 87 HE1 PHE 87 23.389 -5.990 -2.301 748 HE2 PHE 87 HE2 PHE 87 19.201 -5.295 -3.086 749 HZ PHE 87 HZ PHE 87 21.558 -5.500 -3.914 750 H LYS 88 H LYS 88 18.744 -2.577 1.624 751 HA LYS 88 HA LYS 88 21.084 -1.520 0.154 752 HB2 LYS 88 HB2 LYS 88 19.651 0.235 -0.581 753 HB3 LYS 88 HB3 LYS 88 18.877 -1.320 -0.850 754 HG2 LYS 88 HG2 LYS 88 18.138 0.054 1.709 755 HG3 LYS 88 HG3 LYS 88 17.692 0.913 0.231 756 HD2 LYS 88 HD2 LYS 88 16.452 -1.066 -0.578 757 HD3 LYS 88 HD3 LYS 88 16.971 -1.965 0.851 758 HE2 LYS 88 HE2 LYS 88 14.725 -1.290 1.240 759 HE3 LYS 88 HE3 LYS 88 15.769 -0.361 2.315 760 HZ1 LYS 88 HZ1 LYS 88 14.564 0.639 -0.233 761 HZ2 LYS 88 HZ2 LYS 88 14.125 1.079 1.274 762 HZ3 LYS 88 HZ3 LYS 88 15.590 1.507 0.707 763 H THR 89 H THR 89 20.271 -1.448 3.304 764 HA THR 89 HA THR 89 21.548 1.199 3.900 765 HB THR 89 HB THR 89 18.914 0.062 4.927 766 HG1 THR 89 HG1 THR 89 18.116 1.988 4.024 767 HG21 THR 89 HG21 THR 89 20.427 2.552 5.773 768 HG22 THR 89 HG22 THR 89 18.718 2.206 6.165 769 HG23 THR 89 HG23 THR 89 19.991 1.148 6.785 770 H ILE 90 H ILE 90 20.404 -1.931 5.237 771 HA ILE 90 HA ILE 90 22.032 -1.760 7.631 772 HB ILE 90 HB ILE 90 21.329 -4.053 7.996 773 HG12 ILE 90 HG12 ILE 90 19.662 -3.908 5.453 774 HG13 ILE 90 HG13 ILE 90 21.229 -4.721 5.529 775 HG21 ILE 90 HG21 ILE 90 18.996 -2.254 7.228 776 HG22 ILE 90 HG22 ILE 90 18.999 -3.548 8.441 777 HG23 ILE 90 HG23 ILE 90 19.965 -2.098 8.707 778 HD11 ILE 90 HD11 ILE 90 18.769 -5.439 7.159 779 HD12 ILE 90 HD12 ILE 90 19.516 -6.374 5.845 780 HD13 ILE 90 HD13 ILE 90 20.380 -6.162 7.380 781 H LYS 91 H LYS 91 23.612 -3.431 8.206 782 HA LYS 91 HA LYS 91 25.586 -4.515 8.025 783 HB2 LYS 91 HB2 LYS 91 24.841 -5.170 5.163 784 HB3 LYS 91 HB3 LYS 91 25.970 -6.047 6.165 785 HG2 LYS 91 HG2 LYS 91 23.021 -5.900 6.931 786 HG3 LYS 91 HG3 LYS 91 23.592 -6.976 5.677 787 HD2 LYS 91 HD2 LYS 91 23.400 -8.195 7.707 788 HD3 LYS 91 HD3 LYS 91 25.101 -8.106 7.240 789 HE2 LYS 91 HE2 LYS 91 25.500 -6.345 8.920 790 HE3 LYS 91 HE3 LYS 91 23.776 -6.314 9.329 791 HZ1 LYS 91 HZ1 LYS 91 25.581 -8.646 9.718 792 HZ2 LYS 91 HZ2 LYS 91 25.046 -7.663 10.905 793 HZ3 LYS 91 HZ3 LYS 91 23.993 -8.616 10.104 794 H MET 92 H MET 92 25.153 -1.879 5.856 795 HA MET 92 HA MET 92 27.880 -1.934 4.808 796 HB2 MET 92 HB2 MET 92 25.770 0.251 4.672 797 HB3 MET 92 HB3 MET 92 27.287 0.194 3.765 798 HG2 MET 92 HG2 MET 92 26.473 -2.039 2.805 799 HG3 MET 92 HG3 MET 92 24.892 -1.638 3.480 800 HE1 MET 92 HE1 MET 92 25.079 1.733 2.920 801 HE2 MET 92 HE2 MET 92 24.019 1.690 1.499 802 HE3 MET 92 HE3 MET 92 23.645 0.681 2.914 803 H PHE 93 H PHE 93 26.159 0.066 7.236 804 HA PHE 93 HA PHE 93 28.708 1.425 7.905 805 HB2 PHE 93 HB2 PHE 93 27.414 3.189 8.795 806 HB3 PHE 93 HB3 PHE 93 26.749 2.783 7.227 807 HD1 PHE 93 HD1 PHE 93 26.178 2.723 10.887 808 HD2 PHE 93 HD2 PHE 93 24.470 1.867 7.019 809 HE1 PHE 93 HE1 PHE 93 23.930 2.534 11.921 810 HE2 PHE 93 HE2 PHE 93 22.224 1.685 8.057 811 HZ PHE 93 HZ PHE 93 21.949 2.014 10.508 812 H GLU 94 H GLU 94 26.976 -1.166 9.102 813 HA GLU 94 HA GLU 94 27.184 -0.545 11.944 814 HB2 GLU 94 HB2 GLU 94 25.487 -2.092 10.395 815 HB3 GLU 94 HB3 GLU 94 26.473 -3.325 11.156 816 HG2 GLU 94 HG2 GLU 94 24.960 -1.091 12.574 817 HG3 GLU 94 HG3 GLU 94 24.405 -2.752 12.402 818 H ASP 95 H ASP 95 29.225 -0.457 12.712 819 HA ASP 95 HA ASP 95 30.919 -2.855 12.719 820 HB2 ASP 95 HB2 ASP 95 31.405 -1.466 10.593 821 HB3 ASP 95 HB3 ASP 95 32.024 -0.220 11.671 822 H ASP 96 H ASP 96 32.891 -2.489 14.104 823 HA ASP 96 HA ASP 96 32.128 -1.247 16.648 824 HB2 ASP 96 HB2 ASP 96 34.684 -2.639 15.763 825 HB3 ASP 96 HB3 ASP 96 34.354 -2.083 17.402 826 H VAL 97 H VAL 97 32.982 0.483 17.673 827 HA VAL 97 HA VAL 97 34.934 2.242 16.231 828 HB VAL 97 HB VAL 97 32.426 3.165 17.688 829 HG11 VAL 97 HG11 VAL 97 34.564 4.762 16.207 830 HG12 VAL 97 HG12 VAL 97 33.036 5.416 16.836 831 HG13 VAL 97 HG13 VAL 97 34.249 4.800 17.957 832 HG21 VAL 97 HG21 VAL 97 31.847 2.253 15.480 833 HG22 VAL 97 HG22 VAL 97 31.711 4.012 15.465 834 HG23 VAL 97 HG23 VAL 97 33.124 3.230 14.719 835 H SER 98 H SER 98 33.364 1.707 19.421 836 HA SER 98 HA SER 98 35.850 2.601 20.775 837 HB2 SER 98 HB2 SER 98 34.376 2.787 22.765 838 HB3 SER 98 HB3 SER 98 33.875 3.796 21.400 839 HG SER 98 HG SER 98 32.104 2.667 22.347 840 H SER 99 H SER 99 34.524 -0.320 19.851 841 HA SER 99 HA SER 99 35.227 -1.797 22.275 842 HB2 SER 99 HB2 SER 99 33.816 -2.729 19.767 843 HB3 SER 99 HB3 SER 99 33.979 -3.640 21.279 844 HG SER 99 HG SER 99 31.959 -2.543 21.118 845 H ALA 100 H ALA 100 37.003 -0.998 19.592 846 HA ALA 100 HA ALA 100 38.250 -3.589 19.060 847 HB1 ALA 100 HB1 ALA 100 38.961 -0.789 18.100 848 HB2 ALA 100 HB2 ALA 100 39.610 -2.316 17.467 849 HB3 ALA 100 HB3 ALA 100 37.888 -1.942 17.268 850 H SER 101 H SER 101 40.417 -4.152 19.420 851 HA SER 101 HA SER 101 42.115 -2.655 21.311 852 HB2 SER 101 HB2 SER 101 41.018 -5.431 21.944 853 HB3 SER 101 HB3 SER 101 42.363 -4.647 22.789 854 HG SER 101 HG SER 101 40.359 -4.395 23.891 855 H ALA 102 H ALA 102 44.253 -3.099 20.904 856 HA ALA 102 HA ALA 102 46.028 -3.679 19.632 857 HB1 ALA 102 HB1 ALA 102 44.960 -6.489 20.004 858 HB2 ALA 102 HB2 ALA 102 46.637 -6.022 19.650 859 HB3 ALA 102 HB3 ALA 102 45.904 -5.568 21.203 860 H GLN 103 H GLN 103 43.848 -2.825 18.143 861 HA GLN 103 HA GLN 103 44.395 -4.063 15.488 862 HB2 GLN 103 HB2 GLN 103 41.763 -2.986 16.530 863 HB3 GLN 103 HB3 GLN 103 42.062 -3.320 14.830 864 HG2 GLN 103 HG2 GLN 103 42.206 -5.415 17.039 865 HG3 GLN 103 HG3 GLN 103 40.828 -5.136 15.990 866 HE21 GLN 103 HE21 GLN 103 44.064 -7.195 14.523 867 HE22 GLN 103 HE22 GLN 103 44.233 -6.301 16.033 868 HA PRO 104 HA PRO 104 45.677 0.007 14.270 869 HB2 PRO 104 HB2 PRO 104 45.339 -0.037 11.554 870 HB3 PRO 104 HB3 PRO 104 46.606 -0.968 12.407 871 HG2 PRO 104 HG2 PRO 104 43.894 -1.955 11.465 872 HG3 PRO 104 HG3 PRO 104 45.496 -2.723 11.234 873 HD2 PRO 104 HD2 PRO 104 43.815 -3.472 13.237 874 HD3 PRO 104 HD3 PRO 104 45.588 -3.430 13.479 875 H ASN 105 H ASN 105 44.518 1.675 14.881 876 HA ASN 105 HA ASN 105 41.963 2.399 13.544 877 HB2 ASN 105 HB2 ASN 105 41.594 0.927 15.601 878 HB3 ASN 105 HB3 ASN 105 42.261 2.235 16.576 879 HD21 ASN 105 HD21 ASN 105 38.566 2.689 14.787 880 HD22 ASN 105 HD22 ASN 105 39.732 1.580 14.081 881 H LEU 106 H LEU 106 44.105 3.674 12.809 882 HA LEU 106 HA LEU 106 44.108 6.329 14.211 883 HB2 LEU 106 HB2 LEU 106 46.380 4.881 12.819 884 HB3 LEU 106 HB3 LEU 106 46.444 6.555 13.363 885 HG LEU 106 HG LEU 106 46.037 4.157 15.206 886 HD11 LEU 106 HD11 LEU 106 48.500 5.875 14.694 887 HD12 LEU 106 HD12 LEU 106 48.356 4.578 15.903 888 HD13 LEU 106 HD13 LEU 106 48.275 4.188 14.177 889 HD21 LEU 106 HD21 LEU 106 45.083 6.206 16.187 890 HD22 LEU 106 HD22 LEU 106 46.587 5.787 17.008 891 HD23 LEU 106 HD23 LEU 106 46.574 7.102 15.813 892 HA PRO 107 HA PRO 107 42.464 6.946 9.904 893 HB2 PRO 107 HB2 PRO 107 40.372 8.592 10.524 894 HB3 PRO 107 HB3 PRO 107 40.283 6.807 10.630 895 HG2 PRO 107 HG2 PRO 107 40.838 8.780 12.871 896 HG3 PRO 107 HG3 PRO 107 39.668 7.421 12.858 897 HD2 PRO 107 HD2 PRO 107 42.136 7.178 13.969 898 HD3 PRO 107 HD3 PRO 107 41.379 5.819 13.084 Start of MODEL 17 1 H1 GLY -5 H1 GLY -5 -29.470 -21.919 -3.684 2 H2 GLY -5 H2 GLY -5 -29.186 -22.400 -5.225 3 H3 GLY -5 H3 GLY -5 -30.529 -21.533 -4.872 4 HA2 GLY -5 HA2 GLY -5 -28.937 -20.115 -5.958 5 HA3 GLY -5 HA3 GLY -5 -29.210 -19.605 -4.284 6 H SER -4 H SER -4 -27.327 -18.918 -3.468 7 HA SER -4 HA SER -4 -24.826 -20.528 -3.827 8 HB2 SER -4 HB2 SER -4 -25.089 -17.499 -3.899 9 HB3 SER -4 HB3 SER -4 -23.569 -18.413 -3.938 10 HG SER -4 HG SER -4 -24.309 -17.798 -6.043 11 H HIS -3 H HIS -3 -23.292 -20.385 -2.136 12 HA HIS -3 HA HIS -3 -24.412 -19.588 0.524 13 HB2 HIS -3 HB2 HIS -3 -24.396 -22.086 -0.243 14 HB3 HIS -3 HB3 HIS -3 -22.690 -22.035 0.159 15 HD2 HIS -3 HD2 HIS -3 -22.428 -20.829 2.944 16 HE1 HIS -3 HE1 HIS -3 -25.866 -22.999 4.221 17 HE2 HIS -3 HE2 HIS -3 -23.805 -21.719 4.995 18 H MET -2 H MET -2 -22.990 -17.709 -0.652 19 HA MET -2 HA MET -2 -20.153 -17.844 0.208 20 HB2 MET -2 HB2 MET -2 -21.724 -15.741 -1.318 21 HB3 MET -2 HB3 MET -2 -20.020 -15.597 -0.882 22 HG2 MET -2 HG2 MET -2 -21.225 -17.796 -2.604 23 HG3 MET -2 HG3 MET -2 -20.379 -16.382 -3.212 24 HE1 MET -2 HE1 MET -2 -17.798 -16.019 -1.454 25 HE2 MET -2 HE2 MET -2 -16.654 -17.033 -2.356 26 HE3 MET -2 HE3 MET -2 -17.824 -16.024 -3.234 27 H ALA -1 H ALA -1 -20.513 -18.034 2.437 28 HA ALA -1 HA ALA -1 -21.259 -15.506 3.836 29 HB1 ALA -1 HB1 ALA -1 -21.991 -18.348 4.647 30 HB2 ALA -1 HB2 ALA -1 -22.467 -16.855 5.487 31 HB3 ALA -1 HB3 ALA -1 -23.096 -17.191 3.864 32 H SER 0 H SER 0 -18.634 -16.945 3.206 33 HA SER 0 HA SER 0 -17.558 -17.602 5.835 34 HB2 SER 0 HB2 SER 0 -16.377 -17.605 3.049 35 HB3 SER 0 HB3 SER 0 -15.573 -18.292 4.487 36 HG SER 0 HG SER 0 -16.705 -19.898 3.301 37 H MET 1 H MET 1 -17.891 -14.659 4.523 38 HA MET 1 HA MET 1 -15.631 -13.494 6.013 39 HB2 MET 1 HB2 MET 1 -14.664 -12.291 4.129 40 HB3 MET 1 HB3 MET 1 -14.625 -14.024 3.831 41 HG2 MET 1 HG2 MET 1 -16.680 -13.785 2.397 42 HG3 MET 1 HG3 MET 1 -16.627 -12.044 2.679 43 HE1 MET 1 HE1 MET 1 -15.189 -15.101 0.780 44 HE2 MET 1 HE2 MET 1 -13.702 -14.478 0.035 45 HE3 MET 1 HE3 MET 1 -13.765 -14.749 1.787 46 H ASP 2 H ASP 2 -18.764 -13.264 5.060 47 HA ASP 2 HA ASP 2 -18.976 -10.333 5.687 48 HB2 ASP 2 HB2 ASP 2 -20.804 -12.143 4.069 49 HB3 ASP 2 HB3 ASP 2 -21.154 -10.466 4.476 50 H GLN 3 H GLN 3 -19.478 -13.363 6.996 51 HA GLN 3 HA GLN 3 -21.646 -12.536 8.860 52 HB2 GLN 3 HB2 GLN 3 -22.559 -13.563 6.826 53 HB3 GLN 3 HB3 GLN 3 -21.543 -14.959 7.021 54 HG2 GLN 3 HG2 GLN 3 -23.209 -14.573 9.419 55 HG3 GLN 3 HG3 GLN 3 -24.190 -14.519 7.965 56 HE21 GLN 3 HE21 GLN 3 -22.053 -18.023 8.536 57 HE22 GLN 3 HE22 GLN 3 -21.358 -16.487 9.066 58 H LEU 4 H LEU 4 -18.650 -12.982 9.128 59 HA LEU 4 HA LEU 4 -18.716 -14.964 11.381 60 HB2 LEU 4 HB2 LEU 4 -16.557 -14.325 9.366 61 HB3 LEU 4 HB3 LEU 4 -16.116 -14.743 11.014 62 HG LEU 4 HG LEU 4 -17.323 -16.890 10.850 63 HD11 LEU 4 HD11 LEU 4 -17.711 -16.104 7.933 64 HD12 LEU 4 HD12 LEU 4 -17.878 -17.761 8.559 65 HD13 LEU 4 HD13 LEU 4 -18.973 -16.504 9.117 66 HD21 LEU 4 HD21 LEU 4 -14.905 -16.717 10.379 67 HD22 LEU 4 HD22 LEU 4 -15.666 -17.982 9.403 68 HD23 LEU 4 HD23 LEU 4 -15.256 -16.418 8.661 69 H ASP 5 H ASP 5 -19.073 -13.852 13.154 70 HA ASP 5 HA ASP 5 -17.253 -11.660 13.930 71 HB2 ASP 5 HB2 ASP 5 -19.298 -10.676 12.790 72 HB3 ASP 5 HB3 ASP 5 -20.274 -11.339 14.096 73 H GLU 6 H GLU 6 -17.684 -14.477 14.735 74 HA GLU 6 HA GLU 6 -17.937 -15.852 16.500 75 HB2 GLU 6 HB2 GLU 6 -15.848 -14.502 16.905 76 HB3 GLU 6 HB3 GLU 6 -16.747 -13.596 18.133 77 HG2 GLU 6 HG2 GLU 6 -17.258 -15.757 19.294 78 HG3 GLU 6 HG3 GLU 6 -16.398 -16.626 18.030 79 H ILE 7 H ILE 7 -20.306 -15.527 16.139 80 HA ILE 7 HA ILE 7 -21.723 -14.094 18.274 81 HB ILE 7 HB ILE 7 -23.094 -15.425 15.932 82 HG12 ILE 7 HG12 ILE 7 -22.951 -12.949 14.979 83 HG13 ILE 7 HG13 ILE 7 -21.438 -12.891 15.880 84 HG21 ILE 7 HG21 ILE 7 -23.672 -12.918 17.586 85 HG22 ILE 7 HG22 ILE 7 -24.717 -13.624 16.334 86 HG23 ILE 7 HG23 ILE 7 -24.433 -14.504 17.836 87 HD11 ILE 7 HD11 ILE 7 -22.169 -14.986 13.768 88 HD12 ILE 7 HD12 ILE 7 -21.201 -13.538 13.467 89 HD13 ILE 7 HD13 ILE 7 -20.578 -14.803 14.537 90 H ILE 8 H ILE 8 -20.617 -15.901 19.620 91 HA ILE 8 HA ILE 8 -22.515 -18.200 19.989 92 HB ILE 8 HB ILE 8 -19.535 -18.179 20.575 93 HG12 ILE 8 HG12 ILE 8 -21.078 -19.524 18.306 94 HG13 ILE 8 HG13 ILE 8 -19.960 -18.171 18.135 95 HG21 ILE 8 HG21 ILE 8 -21.587 -20.448 20.657 96 HG22 ILE 8 HG22 ILE 8 -19.859 -20.576 21.052 97 HG23 ILE 8 HG23 ILE 8 -20.915 -19.635 22.087 98 HD11 ILE 8 HD11 ILE 8 -19.224 -21.007 18.917 99 HD12 ILE 8 HD12 ILE 8 -18.805 -20.129 17.442 100 HD13 ILE 8 HD13 ILE 8 -18.103 -19.622 18.992 101 H GLU 9 H GLU 9 -23.797 -17.718 21.622 102 HA GLU 9 HA GLU 9 -22.679 -17.168 24.286 103 HB2 GLU 9 HB2 GLU 9 -22.927 -14.899 23.305 104 HB3 GLU 9 HB3 GLU 9 -24.639 -15.207 23.010 105 HG2 GLU 9 HG2 GLU 9 -25.030 -15.437 25.444 106 HG3 GLU 9 HG3 GLU 9 -23.301 -15.246 25.753 107 H GLN 10 H GLN 10 -25.840 -17.123 22.536 108 HA GLN 10 HA GLN 10 -26.810 -19.438 24.061 109 HB2 GLN 10 HB2 GLN 10 -27.340 -17.568 25.563 110 HB3 GLN 10 HB3 GLN 10 -28.128 -16.689 24.246 111 HG2 GLN 10 HG2 GLN 10 -29.864 -18.410 24.074 112 HG3 GLN 10 HG3 GLN 10 -29.042 -19.411 25.275 113 HE21 GLN 10 HE21 GLN 10 -30.191 -17.407 28.059 114 HE22 GLN 10 HE22 GLN 10 -28.905 -18.495 27.556 115 H ILE 11 H ILE 11 -28.564 -20.484 23.080 116 HA ILE 11 HA ILE 11 -29.865 -19.385 20.723 117 HB ILE 11 HB ILE 11 -29.615 -21.512 19.508 118 HG12 ILE 11 HG12 ILE 11 -27.459 -22.222 21.553 119 HG13 ILE 11 HG13 ILE 11 -29.011 -23.040 21.359 120 HG21 ILE 11 HG21 ILE 11 -26.938 -20.193 20.091 121 HG22 ILE 11 HG22 ILE 11 -27.454 -20.948 18.563 122 HG23 ILE 11 HG23 ILE 11 -28.219 -19.452 19.117 123 HD11 ILE 11 HD11 ILE 11 -26.732 -23.005 19.348 124 HD12 ILE 11 HD12 ILE 11 -27.320 -24.371 20.305 125 HD13 ILE 11 HD13 ILE 11 -28.349 -23.687 19.030 126 H GLN 12 H GLN 12 -31.901 -19.989 20.597 127 HA GLN 12 HA GLN 12 -33.022 -22.197 22.181 128 HB2 GLN 12 HB2 GLN 12 -34.902 -20.343 22.904 129 HB3 GLN 12 HB3 GLN 12 -33.650 -21.019 23.907 130 HG2 GLN 12 HG2 GLN 12 -33.749 -18.646 24.266 131 HG3 GLN 12 HG3 GLN 12 -32.202 -19.072 23.565 132 HE21 GLN 12 HE21 GLN 12 -32.758 -16.426 21.229 133 HE22 GLN 12 HE22 GLN 12 -31.729 -17.021 22.540 134 H LYS 13 H LYS 13 -34.554 -19.402 20.583 135 HA LYS 13 HA LYS 13 -35.537 -21.090 18.334 136 HB2 LYS 13 HB2 LYS 13 -37.192 -21.175 20.213 137 HB3 LYS 13 HB3 LYS 13 -37.338 -19.414 20.146 138 HG2 LYS 13 HG2 LYS 13 -38.168 -19.585 17.799 139 HG3 LYS 13 HG3 LYS 13 -38.017 -21.344 17.874 140 HD2 LYS 13 HD2 LYS 13 -39.828 -19.637 19.642 141 HD3 LYS 13 HD3 LYS 13 -40.339 -20.507 18.190 142 HE2 LYS 13 HE2 LYS 13 -39.649 -22.661 19.245 143 HE3 LYS 13 HE3 LYS 13 -39.209 -21.788 20.718 144 HZ1 LYS 13 HZ1 LYS 13 -41.941 -21.891 19.550 145 HZ2 LYS 13 HZ2 LYS 13 -41.450 -22.703 20.875 146 HZ3 LYS 13 HZ3 LYS 13 -41.536 -21.075 20.908 147 H GLU 14 H GLU 14 -35.044 -17.843 19.721 148 HA GLU 14 HA GLU 14 -35.030 -16.673 16.968 149 HB2 GLU 14 HB2 GLU 14 -36.268 -15.605 19.527 150 HB3 GLU 14 HB3 GLU 14 -35.833 -14.562 18.163 151 HG2 GLU 14 HG2 GLU 14 -37.256 -15.857 16.657 152 HG3 GLU 14 HG3 GLU 14 -37.719 -16.941 17.977 153 H ALA 15 H ALA 15 -33.191 -15.860 16.429 154 HA ALA 15 HA ALA 15 -31.767 -14.106 18.287 155 HB1 ALA 15 HB1 ALA 15 -30.333 -16.441 16.935 156 HB2 ALA 15 HB2 ALA 15 -29.540 -15.110 17.806 157 HB3 ALA 15 HB3 ALA 15 -30.605 -16.229 18.675 158 H ILE 16 H ILE 16 -31.141 -15.523 15.038 159 HA ILE 16 HA ILE 16 -30.261 -12.898 14.168 160 HB ILE 16 HB ILE 16 -29.020 -15.020 13.909 161 HG12 ILE 16 HG12 ILE 16 -29.389 -13.495 11.297 162 HG13 ILE 16 HG13 ILE 16 -28.452 -12.921 12.682 163 HG21 ILE 16 HG21 ILE 16 -30.862 -15.565 11.539 164 HG22 ILE 16 HG22 ILE 16 -29.502 -16.562 12.083 165 HG23 ILE 16 HG23 ILE 16 -30.937 -16.425 13.091 166 HD11 ILE 16 HD11 ILE 16 -27.841 -15.379 10.991 167 HD12 ILE 16 HD12 ILE 16 -26.945 -13.854 11.043 168 HD13 ILE 16 HD13 ILE 16 -26.956 -14.915 12.466 169 H ASN 17 H ASN 17 -33.035 -14.576 13.714 170 HA ASN 17 HA ASN 17 -33.626 -13.675 11.089 171 HB2 ASN 17 HB2 ASN 17 -35.519 -14.717 13.246 172 HB3 ASN 17 HB3 ASN 17 -35.963 -14.509 11.553 173 HD21 ASN 17 HD21 ASN 17 -34.084 -17.885 12.592 174 HD22 ASN 17 HD22 ASN 17 -34.781 -16.779 13.764 175 H SER 18 H SER 18 -33.756 -11.977 14.001 176 HA SER 18 HA SER 18 -35.783 -9.987 13.450 177 HB2 SER 18 HB2 SER 18 -34.752 -10.474 15.680 178 HB3 SER 18 HB3 SER 18 -33.241 -9.739 15.110 179 HG SER 18 HG SER 18 -34.605 -8.277 16.289 180 H ASN 19 H ASN 19 -32.413 -10.361 12.413 181 HA ASN 19 HA ASN 19 -32.305 -7.702 11.153 182 HB2 ASN 19 HB2 ASN 19 -30.357 -9.980 10.681 183 HB3 ASN 19 HB3 ASN 19 -30.071 -8.255 10.526 184 HD21 ASN 19 HD21 ASN 19 -29.594 -10.146 14.093 185 HD22 ASN 19 HD22 ASN 19 -30.260 -10.967 12.670 186 H VAL 20 H VAL 20 -33.033 -10.951 10.281 187 HA VAL 20 HA VAL 20 -32.649 -10.680 7.429 188 HB VAL 20 HB VAL 20 -34.070 -12.863 8.998 189 HG11 VAL 20 HG11 VAL 20 -33.083 -12.848 6.114 190 HG12 VAL 20 HG12 VAL 20 -33.657 -14.278 7.000 191 HG13 VAL 20 HG13 VAL 20 -34.776 -12.962 6.649 192 HG21 VAL 20 HG21 VAL 20 -31.653 -12.643 9.578 193 HG22 VAL 20 HG22 VAL 20 -31.974 -14.129 8.687 194 HG23 VAL 20 HG23 VAL 20 -31.240 -12.740 7.858 195 H VAL 21 H VAL 21 -35.540 -10.779 9.530 196 HA VAL 21 HA VAL 21 -37.295 -10.002 7.248 197 HB VAL 21 HB VAL 21 -38.140 -10.928 10.015 198 HG11 VAL 21 HG11 VAL 21 -39.627 -10.744 7.345 199 HG12 VAL 21 HG12 VAL 21 -40.292 -11.371 8.870 200 HG13 VAL 21 HG13 VAL 21 -39.871 -9.663 8.733 201 HG21 VAL 21 HG21 VAL 21 -36.924 -12.773 8.957 202 HG22 VAL 21 HG22 VAL 21 -38.654 -13.100 8.901 203 HG23 VAL 21 HG23 VAL 21 -37.818 -12.531 7.439 204 H LEU 22 H LEU 22 -36.180 -7.923 7.252 205 HA LEU 22 HA LEU 22 -37.397 -5.969 9.117 206 HB2 LEU 22 HB2 LEU 22 -35.089 -6.880 9.880 207 HB3 LEU 22 HB3 LEU 22 -34.419 -6.023 8.501 208 HG LEU 22 HG LEU 22 -35.313 -3.884 9.465 209 HD11 LEU 22 HD11 LEU 22 -36.010 -5.629 11.861 210 HD12 LEU 22 HD12 LEU 22 -35.980 -3.853 11.864 211 HD13 LEU 22 HD13 LEU 22 -37.161 -4.709 10.871 212 HD21 LEU 22 HD21 LEU 22 -32.993 -4.605 9.881 213 HD22 LEU 22 HD22 LEU 22 -33.652 -3.716 11.265 214 HD23 LEU 22 HD23 LEU 22 -33.528 -5.488 11.330 215 H LYS 23 H LYS 23 -37.275 -3.760 8.424 216 HA LYS 23 HA LYS 23 -37.597 -3.519 5.485 217 HB2 LYS 23 HB2 LYS 23 -38.698 -1.819 7.754 218 HB3 LYS 23 HB3 LYS 23 -39.077 -1.637 6.036 219 HG2 LYS 23 HG2 LYS 23 -40.092 -3.897 5.993 220 HG3 LYS 23 HG3 LYS 23 -39.693 -4.123 7.694 221 HD2 LYS 23 HD2 LYS 23 -42.005 -3.529 7.589 222 HD3 LYS 23 HD3 LYS 23 -41.113 -2.201 8.318 223 HE2 LYS 23 HE2 LYS 23 -42.727 -1.239 6.857 224 HE3 LYS 23 HE3 LYS 23 -41.151 -0.999 6.105 225 HZ1 LYS 23 HZ1 LYS 23 -43.094 -3.135 5.374 226 HZ2 LYS 23 HZ2 LYS 23 -42.822 -1.781 4.510 227 HZ3 LYS 23 HZ3 LYS 23 -41.648 -2.903 4.644 228 H ASN 24 H ASN 24 -34.965 -3.308 6.722 229 HA ASN 24 HA ASN 24 -33.087 -2.060 6.865 230 HB2 ASN 24 HB2 ASN 24 -33.647 -2.421 4.398 231 HB3 ASN 24 HB3 ASN 24 -34.068 -0.713 4.337 232 HD21 ASN 24 HD21 ASN 24 -30.599 0.323 4.686 233 HD22 ASN 24 HD22 ASN 24 -32.236 0.795 5.189 234 HA PRO 25 HA PRO 25 -34.981 1.893 8.590 235 HB2 PRO 25 HB2 PRO 25 -34.956 1.409 11.260 236 HB3 PRO 25 HB3 PRO 25 -36.257 0.809 10.193 237 HG2 PRO 25 HG2 PRO 25 -33.816 -0.726 11.163 238 HG3 PRO 25 HG3 PRO 25 -35.535 -1.229 11.213 239 HD2 PRO 25 HD2 PRO 25 -33.849 -1.987 9.196 240 HD3 PRO 25 HD3 PRO 25 -35.588 -1.646 8.921 241 H ARG 26 H ARG 26 -33.063 2.726 7.700 242 HA ARG 26 HA ARG 26 -30.972 3.682 7.609 243 HB2 ARG 26 HB2 ARG 26 -31.529 4.050 10.573 244 HB3 ARG 26 HB3 ARG 26 -30.132 4.722 9.741 245 HG2 ARG 26 HG2 ARG 26 -31.712 6.440 9.921 246 HG3 ARG 26 HG3 ARG 26 -31.597 5.990 8.218 247 HD2 ARG 26 HD2 ARG 26 -33.769 4.959 8.251 248 HD3 ARG 26 HD3 ARG 26 -33.777 4.876 10.015 249 HE ARG 26 HE ARG 26 -34.611 6.997 10.136 250 HH11 ARG 26 HH11 ARG 26 -35.357 8.963 9.477 251 HH12 ARG 26 HH12 ARG 26 -35.065 9.513 7.853 252 HH21 ARG 26 HH21 ARG 26 -33.337 6.716 6.875 253 HH22 ARG 26 HH22 ARG 26 -33.945 8.283 6.417 254 H VAL 27 H VAL 27 -30.408 1.456 7.014 255 HA VAL 27 HA VAL 27 -28.277 0.308 8.786 256 HB VAL 27 HB VAL 27 -29.929 -1.249 6.789 257 HG11 VAL 27 HG11 VAL 27 -27.867 -2.105 8.877 258 HG12 VAL 27 HG12 VAL 27 -28.832 -3.195 7.857 259 HG13 VAL 27 HG13 VAL 27 -27.628 -2.137 7.119 260 HG21 VAL 27 HG21 VAL 27 -31.333 -0.663 8.711 261 HG22 VAL 27 HG22 VAL 27 -30.882 -2.367 8.785 262 HG23 VAL 27 HG23 VAL 27 -30.059 -1.188 9.831 263 HA PRO 28 HA PRO 28 -25.916 1.518 5.037 264 HB2 PRO 28 HB2 PRO 28 -23.682 2.436 6.241 265 HB3 PRO 28 HB3 PRO 28 -25.175 3.419 6.125 266 HG2 PRO 28 HG2 PRO 28 -24.231 1.751 8.485 267 HG3 PRO 28 HG3 PRO 28 -24.840 3.439 8.496 268 HD2 PRO 28 HD2 PRO 28 -26.397 1.266 9.085 269 HD3 PRO 28 HD3 PRO 28 -27.053 2.735 8.299 270 H THR 29 H THR 29 -23.687 0.860 4.392 271 HA THR 29 HA THR 29 -23.230 -1.989 5.105 272 HB THR 29 HB THR 29 -22.934 -2.119 2.567 273 HG1 THR 29 HG1 THR 29 -24.024 -0.560 1.386 274 HG21 THR 29 HG21 THR 29 -25.693 -1.432 3.665 275 HG22 THR 29 HG22 THR 29 -25.351 -2.386 2.201 276 HG23 THR 29 HG23 THR 29 -24.901 -3.015 3.796 277 H GLN 30 H GLN 30 -21.505 -1.147 6.453 278 HA GLN 30 HA GLN 30 -19.091 -0.315 4.938 279 HB2 GLN 30 HB2 GLN 30 -19.947 0.150 7.807 280 HB3 GLN 30 HB3 GLN 30 -18.352 0.612 7.204 281 HG2 GLN 30 HG2 GLN 30 -19.182 2.231 5.725 282 HG3 GLN 30 HG3 GLN 30 -20.827 1.599 5.761 283 HE21 GLN 30 HE21 GLN 30 -21.678 3.078 8.926 284 HE22 GLN 30 HE22 GLN 30 -21.949 1.634 7.955 285 H LYS 31 H LYS 31 -19.971 -3.083 5.412 286 HA LYS 31 HA LYS 31 -17.917 -4.322 7.074 287 HB2 LYS 31 HB2 LYS 31 -20.466 -4.885 6.518 288 HB3 LYS 31 HB3 LYS 31 -19.774 -5.872 5.258 289 HG2 LYS 31 HG2 LYS 31 -19.094 -6.082 8.245 290 HG3 LYS 31 HG3 LYS 31 -20.388 -6.957 7.454 291 HD2 LYS 31 HD2 LYS 31 -18.817 -8.570 7.534 292 HD3 LYS 31 HD3 LYS 31 -18.547 -7.953 5.901 293 HE2 LYS 31 HE2 LYS 31 -16.578 -6.708 6.665 294 HE3 LYS 31 HE3 LYS 31 -16.954 -7.068 8.356 295 HZ1 LYS 31 HZ1 LYS 31 -16.251 -9.145 6.337 296 HZ2 LYS 31 HZ2 LYS 31 -15.219 -8.531 7.465 297 HZ3 LYS 31 HZ3 LYS 31 -16.517 -9.396 7.924 298 H THR 32 H THR 32 -16.657 -2.848 5.178 299 HA THR 32 HA THR 32 -15.588 -4.775 3.142 300 HB THR 32 HB THR 32 -17.346 -3.194 2.358 301 HG1 THR 32 HG1 THR 32 -16.261 -2.680 0.480 302 HG21 THR 32 HG21 THR 32 -15.207 -1.048 2.686 303 HG22 THR 32 HG22 THR 32 -16.797 -0.866 1.917 304 HG23 THR 32 HG23 THR 32 -16.693 -1.184 3.655 305 H GLY 33 H GLY 33 -14.473 -3.476 5.778 306 HA2 GLY 33 HA2 GLY 33 -12.119 -1.988 4.900 307 HA3 GLY 33 HA3 GLY 33 -12.556 -2.421 6.550 308 H GLU 34 H GLU 34 -12.447 -5.104 4.389 309 HA GLU 34 HA GLU 34 -9.859 -6.015 5.590 310 HB2 GLU 34 HB2 GLU 34 -12.454 -7.571 5.353 311 HB3 GLU 34 HB3 GLU 34 -10.893 -8.242 5.860 312 HG2 GLU 34 HG2 GLU 34 -10.812 -6.586 7.736 313 HG3 GLU 34 HG3 GLU 34 -12.443 -6.058 7.306 314 H LEU 35 H LEU 35 -9.769 -4.867 3.165 315 HA LEU 35 HA LEU 35 -8.737 -5.055 1.248 316 HB2 LEU 35 HB2 LEU 35 -7.390 -6.730 2.946 317 HB3 LEU 35 HB3 LEU 35 -7.708 -7.810 1.605 318 HG LEU 35 HG LEU 35 -6.836 -5.780 0.132 319 HD11 LEU 35 HD11 LEU 35 -5.486 -5.165 2.812 320 HD12 LEU 35 HD12 LEU 35 -5.194 -4.348 1.270 321 HD13 LEU 35 HD13 LEU 35 -6.752 -4.167 2.097 322 HD21 LEU 35 HD21 LEU 35 -5.723 -8.002 0.435 323 HD22 LEU 35 HD22 LEU 35 -4.601 -6.657 0.230 324 HD23 LEU 35 HD23 LEU 35 -4.875 -7.340 1.850 325 H SER 36 H SER 36 -10.741 -4.892 0.288 326 HA SER 36 HA SER 36 -11.916 -7.341 -0.983 327 HB2 SER 36 HB2 SER 36 -13.022 -6.505 1.118 328 HB3 SER 36 HB3 SER 36 -13.444 -5.026 0.238 329 HG SER 36 HG SER 36 -15.119 -6.584 0.113 330 H GLU 37 H GLU 37 -10.685 -6.763 -2.780 331 HA GLU 37 HA GLU 37 -10.534 -6.179 -4.987 332 HB2 GLU 37 HB2 GLU 37 -13.532 -5.964 -4.563 333 HB3 GLU 37 HB3 GLU 37 -12.749 -6.080 -6.147 334 HG2 GLU 37 HG2 GLU 37 -11.735 -8.267 -5.451 335 HG3 GLU 37 HG3 GLU 37 -12.682 -8.197 -3.964 336 H GLU 38 H GLU 38 -10.447 -3.864 -3.118 337 HA GLU 38 HA GLU 38 -10.237 -1.770 -5.223 338 HB2 GLU 38 HB2 GLU 38 -11.878 -1.526 -2.678 339 HB3 GLU 38 HB3 GLU 38 -11.163 -0.118 -3.473 340 HG2 GLU 38 HG2 GLU 38 -12.363 -0.713 -5.578 341 HG3 GLU 38 HG3 GLU 38 -13.155 -2.048 -4.731 342 H GLN 39 H GLN 39 -9.518 -2.766 -1.841 343 HA GLN 39 HA GLN 39 -7.510 -0.784 -1.412 344 HB2 GLN 39 HB2 GLN 39 -7.979 -3.488 -0.103 345 HB3 GLN 39 HB3 GLN 39 -6.760 -2.351 0.427 346 HG2 GLN 39 HG2 GLN 39 -8.496 -1.860 1.879 347 HG3 GLN 39 HG3 GLN 39 -8.716 -0.618 0.652 348 HE21 GLN 39 HE21 GLN 39 -11.958 -1.888 -0.220 349 HE22 GLN 39 HE22 GLN 39 -10.783 -0.600 -0.459 350 H LYS 40 H LYS 40 -7.151 -4.208 -2.399 351 HA LYS 40 HA LYS 40 -4.332 -3.988 -2.994 352 HB2 LYS 40 HB2 LYS 40 -4.567 -6.148 -4.049 353 HB3 LYS 40 HB3 LYS 40 -5.446 -6.096 -2.528 354 HG2 LYS 40 HG2 LYS 40 -7.511 -5.435 -4.141 355 HG3 LYS 40 HG3 LYS 40 -6.472 -6.144 -5.370 356 HD2 LYS 40 HD2 LYS 40 -8.046 -7.804 -4.537 357 HD3 LYS 40 HD3 LYS 40 -6.413 -8.271 -4.029 358 HE2 LYS 40 HE2 LYS 40 -6.877 -7.352 -1.742 359 HE3 LYS 40 HE3 LYS 40 -8.474 -6.840 -2.262 360 HZ1 LYS 40 HZ1 LYS 40 -7.507 -9.643 -2.049 361 HZ2 LYS 40 HZ2 LYS 40 -8.676 -8.921 -1.149 362 HZ3 LYS 40 HZ3 LYS 40 -8.940 -9.252 -2.726 363 H LYS 41 H LYS 41 -7.170 -3.084 -4.858 364 HA LYS 41 HA LYS 41 -5.752 -2.569 -7.338 365 HB2 LYS 41 HB2 LYS 41 -8.317 -1.224 -6.439 366 HB3 LYS 41 HB3 LYS 41 -7.714 -1.378 -8.066 367 HG2 LYS 41 HG2 LYS 41 -8.700 -3.697 -6.345 368 HG3 LYS 41 HG3 LYS 41 -9.601 -2.865 -7.618 369 HD2 LYS 41 HD2 LYS 41 -7.823 -3.544 -9.254 370 HD3 LYS 41 HD3 LYS 41 -7.080 -4.528 -7.962 371 HE2 LYS 41 HE2 LYS 41 -9.076 -5.891 -7.760 372 HE3 LYS 41 HE3 LYS 41 -9.986 -4.820 -8.835 373 HZ1 LYS 41 HZ1 LYS 41 -7.646 -6.454 -9.680 374 HZ2 LYS 41 HZ2 LYS 41 -9.207 -6.804 -10.008 375 HZ3 LYS 41 HZ3 LYS 41 -8.520 -5.476 -10.657 376 H ILE 42 H ILE 42 -5.655 -0.903 -4.379 377 HA ILE 42 HA ILE 42 -4.341 1.464 -5.654 378 HB ILE 42 HB ILE 42 -5.108 0.804 -2.801 379 HG12 ILE 42 HG12 ILE 42 -6.066 3.306 -4.133 380 HG13 ILE 42 HG13 ILE 42 -6.692 1.826 -4.836 381 HG21 ILE 42 HG21 ILE 42 -3.665 3.307 -3.746 382 HG22 ILE 42 HG22 ILE 42 -4.351 3.032 -2.128 383 HG23 ILE 42 HG23 ILE 42 -3.004 2.049 -2.677 384 HD11 ILE 42 HD11 ILE 42 -6.862 2.489 -1.877 385 HD12 ILE 42 HD12 ILE 42 -8.183 2.613 -3.073 386 HD13 ILE 42 HD13 ILE 42 -7.477 1.035 -2.680 387 H VAL 43 H VAL 43 -3.640 -1.173 -3.299 388 HA VAL 43 HA VAL 43 -0.907 -0.401 -2.986 389 HB VAL 43 HB VAL 43 -2.290 -3.015 -2.303 390 HG11 VAL 43 HG11 VAL 43 0.379 -1.911 -1.304 391 HG12 VAL 43 HG12 VAL 43 -0.426 -3.382 -0.721 392 HG13 VAL 43 HG13 VAL 43 0.179 -3.326 -2.355 393 HG21 VAL 43 HG21 VAL 43 -3.141 -0.821 -1.228 394 HG22 VAL 43 HG22 VAL 43 -2.673 -2.109 -0.148 395 HG23 VAL 43 HG23 VAL 43 -1.566 -0.741 -0.425 396 H ALA 44 H ALA 44 -2.207 -3.335 -4.678 397 HA ALA 44 HA ALA 44 0.455 -4.059 -5.581 398 HB1 ALA 44 HB1 ALA 44 -2.255 -5.108 -6.469 399 HB2 ALA 44 HB2 ALA 44 -0.660 -5.854 -6.757 400 HB3 ALA 44 HB3 ALA 44 -1.284 -5.724 -5.103 401 H ASP 45 H ASP 45 -2.237 -2.229 -6.990 402 HA ASP 45 HA ASP 45 -1.100 -1.776 -9.579 403 HB2 ASP 45 HB2 ASP 45 -3.375 -1.111 -8.885 404 HB3 ASP 45 HB3 ASP 45 -2.689 0.140 -7.839 405 H TYR 46 H TYR 46 -0.434 -0.013 -6.469 406 HA TYR 46 HA TYR 46 1.503 1.769 -7.591 407 HB2 TYR 46 HB2 TYR 46 0.217 1.679 -5.262 408 HB3 TYR 46 HB3 TYR 46 1.662 0.857 -4.720 409 HD1 TYR 46 HD1 TYR 46 3.680 2.566 -6.378 410 HD2 TYR 46 HD2 TYR 46 0.314 3.575 -3.917 411 HE1 TYR 46 HE1 TYR 46 4.650 4.789 -6.035 412 HE2 TYR 46 HE2 TYR 46 1.370 5.772 -3.386 413 HH TYR 46 HH TYR 46 4.449 6.814 -4.915 414 H ILE 47 H ILE 47 1.860 -1.504 -6.136 415 HA ILE 47 HA ILE 47 4.703 -1.646 -6.216 416 HB ILE 47 HB ILE 47 2.654 -3.860 -6.600 417 HG12 ILE 47 HG12 ILE 47 2.168 -3.142 -4.460 418 HG13 ILE 47 HG13 ILE 47 3.379 -4.336 -4.122 419 HG21 ILE 47 HG21 ILE 47 5.542 -4.183 -5.755 420 HG22 ILE 47 HG22 ILE 47 4.314 -5.455 -5.911 421 HG23 ILE 47 HG23 ILE 47 4.880 -4.617 -7.351 422 HD11 ILE 47 HD11 ILE 47 3.738 -1.306 -4.151 423 HD12 ILE 47 HD12 ILE 47 3.768 -2.383 -2.746 424 HD13 ILE 47 HD13 ILE 47 5.083 -2.453 -3.939 425 H SER 48 H SER 48 2.385 -2.117 -8.859 426 HA SER 48 HA SER 48 4.419 -2.765 -10.824 427 HB2 SER 48 HB2 SER 48 1.543 -1.863 -11.156 428 HB3 SER 48 HB3 SER 48 2.597 -2.424 -12.465 429 HG SER 48 HG SER 48 1.279 -4.109 -11.606 430 H GLU 49 H GLU 49 3.788 0.300 -9.371 431 HA GLU 49 HA GLU 49 4.472 1.841 -11.826 432 HB2 GLU 49 HB2 GLU 49 3.761 2.720 -9.002 433 HB3 GLU 49 HB3 GLU 49 4.158 3.810 -10.323 434 HG2 GLU 49 HG2 GLU 49 1.864 1.845 -10.441 435 HG3 GLU 49 HG3 GLU 49 1.709 3.466 -9.782 436 H VAL 50 H VAL 50 5.624 1.478 -8.478 437 HA VAL 50 HA VAL 50 8.233 2.681 -9.314 438 HB VAL 50 HB VAL 50 8.346 3.812 -7.228 439 HG11 VAL 50 HG11 VAL 50 5.513 4.173 -8.203 440 HG12 VAL 50 HG12 VAL 50 6.563 5.346 -7.385 441 HG13 VAL 50 HG13 VAL 50 6.952 4.815 -9.027 442 HG21 VAL 50 HG21 VAL 50 7.463 2.162 -5.689 443 HG22 VAL 50 HG22 VAL 50 6.568 3.677 -5.549 444 HG23 VAL 50 HG23 VAL 50 5.852 2.296 -6.413 445 H GLY 51 H GLY 51 7.033 -0.199 -7.842 446 HA2 GLY 51 HA2 GLY 51 8.754 -1.946 -8.369 447 HA3 GLY 51 HA3 GLY 51 9.877 -1.039 -7.355 448 H LEU 52 H LEU 52 9.163 -0.679 -5.088 449 HA LEU 52 HA LEU 52 7.219 -2.375 -3.836 450 HB2 LEU 52 HB2 LEU 52 8.912 -4.131 -4.364 451 HB3 LEU 52 HB3 LEU 52 10.155 -3.195 -3.550 452 HG LEU 52 HG LEU 52 9.048 -3.569 -1.379 453 HD11 LEU 52 HD11 LEU 52 7.011 -5.165 -2.995 454 HD12 LEU 52 HD12 LEU 52 7.150 -5.163 -1.218 455 HD13 LEU 52 HD13 LEU 52 6.691 -3.682 -2.059 456 HD21 LEU 52 HD21 LEU 52 10.665 -5.242 -2.293 457 HD22 LEU 52 HD22 LEU 52 9.466 -5.965 -1.215 458 HD23 LEU 52 HD23 LEU 52 9.304 -6.157 -2.976 459 H ASN 53 H ASN 53 10.270 -0.695 -3.383 460 HA ASN 53 HA ASN 53 9.482 0.197 -0.651 461 HB2 ASN 53 HB2 ASN 53 12.200 -0.176 -1.972 462 HB3 ASN 53 HB3 ASN 53 11.956 0.392 -0.323 463 HD21 ASN 53 HD21 ASN 53 12.043 -3.538 -0.901 464 HD22 ASN 53 HD22 ASN 53 12.581 -2.381 -2.108 465 H ASN 54 H ASN 54 9.622 1.571 -3.691 466 HA ASN 54 HA ASN 54 10.720 4.176 -2.823 467 HB2 ASN 54 HB2 ASN 54 9.744 3.280 -5.551 468 HB3 ASN 54 HB3 ASN 54 10.681 4.729 -5.192 469 HD21 ASN 54 HD21 ASN 54 12.617 1.294 -5.873 470 HD22 ASN 54 HD22 ASN 54 10.945 1.607 -6.338 471 H LEU 55 H LEU 55 7.605 2.747 -3.104 472 HA LEU 55 HA LEU 55 6.040 5.196 -3.230 473 HB2 LEU 55 HB2 LEU 55 4.187 3.746 -2.609 474 HB3 LEU 55 HB3 LEU 55 5.159 3.042 -3.883 475 HG LEU 55 HG LEU 55 6.309 1.651 -1.992 476 HD11 LEU 55 HD11 LEU 55 3.659 2.392 -0.668 477 HD12 LEU 55 HD12 LEU 55 4.726 1.054 -0.193 478 HD13 LEU 55 HD13 LEU 55 5.282 2.714 -0.016 479 HD21 LEU 55 HD21 LEU 55 4.901 0.745 -3.785 480 HD22 LEU 55 HD22 LEU 55 4.565 -0.051 -2.239 481 HD23 LEU 55 HD23 LEU 55 3.435 1.171 -2.872 482 H ASN 56 H ASN 56 4.604 5.848 -1.324 483 HA ASN 56 HA ASN 56 6.041 5.539 1.262 484 HB2 ASN 56 HB2 ASN 56 5.655 7.753 1.888 485 HB3 ASN 56 HB3 ASN 56 6.317 7.821 0.267 486 HD21 ASN 56 HD21 ASN 56 3.724 10.243 -0.084 487 HD22 ASN 56 HD22 ASN 56 5.435 10.033 0.279 488 H ALA 57 H ALA 57 4.631 5.981 3.117 489 HA ALA 57 HA ALA 57 2.370 4.124 3.010 490 HB1 ALA 57 HB1 ALA 57 3.777 5.685 5.214 491 HB2 ALA 57 HB2 ALA 57 2.524 4.458 5.487 492 HB3 ALA 57 HB3 ALA 57 4.067 3.992 4.746 493 H THR 58 H THR 58 2.817 7.596 3.033 494 HA THR 58 HA THR 58 0.361 8.458 4.182 495 HB THR 58 HB THR 58 2.061 9.875 2.098 496 HG1 THR 58 HG1 THR 58 3.155 10.704 3.894 497 HG21 THR 58 HG21 THR 58 0.207 10.931 4.277 498 HG22 THR 58 HG22 THR 58 1.345 11.929 3.340 499 HG23 THR 58 HG23 THR 58 0.023 11.105 2.514 500 H GLU 59 H GLU 59 1.291 8.041 0.727 501 HA GLU 59 HA GLU 59 -1.287 8.759 -0.346 502 HB2 GLU 59 HB2 GLU 59 0.958 7.019 -1.448 503 HB3 GLU 59 HB3 GLU 59 -0.435 7.533 -2.397 504 HG2 GLU 59 HG2 GLU 59 1.591 9.434 -1.136 505 HG3 GLU 59 HG3 GLU 59 1.644 8.856 -2.788 506 H LEU 60 H LEU 60 0.112 5.538 0.375 507 HA LEU 60 HA LEU 60 -2.174 3.968 -0.216 508 HB2 LEU 60 HB2 LEU 60 0.254 3.657 1.531 509 HB3 LEU 60 HB3 LEU 60 -1.116 2.625 1.899 510 HG LEU 60 HG LEU 60 -1.175 1.767 -0.402 511 HD11 LEU 60 HD11 LEU 60 1.349 3.423 -0.817 512 HD12 LEU 60 HD12 LEU 60 0.740 2.171 -1.921 513 HD13 LEU 60 HD13 LEU 60 -0.207 3.641 -1.646 514 HD21 LEU 60 HD21 LEU 60 0.148 0.606 1.339 515 HD22 LEU 60 HD22 LEU 60 0.876 0.421 -0.266 516 HD23 LEU 60 HD23 LEU 60 1.569 1.575 0.889 517 H SER 61 H SER 61 -1.336 5.299 3.046 518 HA SER 61 HA SER 61 -3.768 4.506 4.272 519 HB2 SER 61 HB2 SER 61 -3.167 6.136 6.049 520 HB3 SER 61 HB3 SER 61 -1.888 4.983 5.640 521 HG SER 61 HG SER 61 -0.832 6.557 4.517 522 H LYS 62 H LYS 62 -3.226 7.212 2.198 523 HA LYS 62 HA LYS 62 -5.641 8.708 3.023 524 HB2 LYS 62 HB2 LYS 62 -3.649 8.986 0.747 525 HB3 LYS 62 HB3 LYS 62 -5.120 9.960 0.821 526 HG2 LYS 62 HG2 LYS 62 -4.482 11.020 2.863 527 HG3 LYS 62 HG3 LYS 62 -3.199 9.866 3.172 528 HD2 LYS 62 HD2 LYS 62 -2.193 11.929 2.410 529 HD3 LYS 62 HD3 LYS 62 -1.936 10.675 1.200 530 HE2 LYS 62 HE2 LYS 62 -2.472 12.675 0.027 531 HE3 LYS 62 HE3 LYS 62 -3.866 11.607 -0.123 532 HZ1 LYS 62 HZ1 LYS 62 -3.642 13.868 1.804 533 HZ2 LYS 62 HZ2 LYS 62 -4.515 13.894 0.429 534 HZ3 LYS 62 HZ3 LYS 62 -4.954 12.904 1.648 535 H ARG 63 H ARG 63 -4.780 6.571 0.305 536 HA ARG 63 HA ARG 63 -7.498 6.617 -0.837 537 HB2 ARG 63 HB2 ARG 63 -4.901 5.154 -1.411 538 HB3 ARG 63 HB3 ARG 63 -6.389 4.703 -2.234 539 HG2 ARG 63 HG2 ARG 63 -5.308 7.544 -2.305 540 HG3 ARG 63 HG3 ARG 63 -4.861 6.293 -3.473 541 HD2 ARG 63 HD2 ARG 63 -7.262 5.958 -4.040 542 HD3 ARG 63 HD3 ARG 63 -7.704 7.269 -2.955 543 HE ARG 63 HE ARG 63 -6.173 7.481 -5.517 544 HH11 ARG 63 HH11 ARG 63 -6.286 9.376 -6.646 545 HH12 ARG 63 HH12 ARG 63 -7.054 10.767 -5.941 546 HH21 ARG 63 HH21 ARG 63 -7.886 9.226 -2.997 547 HH22 ARG 63 HH22 ARG 63 -7.940 10.691 -3.940 548 H LEU 64 H LEU 64 -5.688 4.412 1.226 549 HA LEU 64 HA LEU 64 -7.782 2.355 1.254 550 HB2 LEU 64 HB2 LEU 64 -5.207 2.749 2.810 551 HB3 LEU 64 HB3 LEU 64 -6.190 1.298 2.906 552 HG LEU 64 HG LEU 64 -4.886 2.283 0.320 553 HD11 LEU 64 HD11 LEU 64 -3.969 0.080 2.213 554 HD12 LEU 64 HD12 LEU 64 -3.193 0.609 0.703 555 HD13 LEU 64 HD13 LEU 64 -3.227 1.691 2.092 556 HD21 LEU 64 HD21 LEU 64 -6.810 0.809 -0.032 557 HD22 LEU 64 HD22 LEU 64 -5.300 -0.048 -0.387 558 HD23 LEU 64 HD23 LEU 64 -6.149 -0.351 1.145 559 H ASN 65 H ASN 65 -6.944 5.103 3.265 560 HA ASN 65 HA ASN 65 -7.736 5.950 5.171 561 HB2 ASN 65 HB2 ASN 65 -9.908 5.718 3.848 562 HB3 ASN 65 HB3 ASN 65 -10.280 4.329 4.866 563 HD21 ASN 65 HD21 ASN 65 -10.808 6.389 7.806 564 HD22 ASN 65 HD22 ASN 65 -10.127 4.830 7.323 565 H ILE 66 H ILE 66 -5.905 4.242 5.545 566 HA ILE 66 HA ILE 66 -6.531 2.759 8.067 567 HB ILE 66 HB ILE 66 -4.236 1.666 7.706 568 HG12 ILE 66 HG12 ILE 66 -4.682 2.632 4.879 569 HG13 ILE 66 HG13 ILE 66 -3.374 3.092 5.975 570 HG21 ILE 66 HG21 ILE 66 -6.445 0.808 5.834 571 HG22 ILE 66 HG22 ILE 66 -5.133 -0.184 6.528 572 HG23 ILE 66 HG23 ILE 66 -6.355 0.496 7.594 573 HD11 ILE 66 HD11 ILE 66 -3.818 0.372 4.685 574 HD12 ILE 66 HD12 ILE 66 -2.565 1.568 4.317 575 HD13 ILE 66 HD13 ILE 66 -2.555 0.734 5.894 576 H THR 67 H THR 67 -4.582 2.746 9.510 577 HA THR 67 HA THR 67 -3.551 5.419 10.132 578 HB THR 67 HB THR 67 -3.262 2.624 11.270 579 HG1 THR 67 HG1 THR 67 -4.293 3.637 13.013 580 HG21 THR 67 HG21 THR 67 -1.786 5.108 12.185 581 HG22 THR 67 HG22 THR 67 -2.050 3.660 13.193 582 HG23 THR 67 HG23 THR 67 -1.116 3.519 11.709 583 H VAL 68 H VAL 68 -1.523 6.177 9.583 584 HA VAL 68 HA VAL 68 -0.143 5.187 7.348 585 HB VAL 68 HB VAL 68 1.155 6.833 9.555 586 HG11 VAL 68 HG11 VAL 68 1.598 6.749 6.536 587 HG12 VAL 68 HG12 VAL 68 2.428 7.828 7.676 588 HG13 VAL 68 HG13 VAL 68 2.702 6.088 7.766 589 HG21 VAL 68 HG21 VAL 68 -0.961 7.950 9.014 590 HG22 VAL 68 HG22 VAL 68 0.387 8.847 8.327 591 HG23 VAL 68 HG23 VAL 68 -0.608 7.821 7.277 592 H ASP 69 H ASP 69 0.534 4.566 10.771 593 HA ASP 69 HA ASP 69 2.905 3.037 10.293 594 HB2 ASP 69 HB2 ASP 69 2.083 4.332 12.414 595 HB3 ASP 69 HB3 ASP 69 1.210 2.848 12.794 596 H LYS 70 H LYS 70 -0.450 2.087 10.117 597 HA LYS 70 HA LYS 70 0.221 -0.797 10.117 598 HB2 LYS 70 HB2 LYS 70 -2.315 0.703 9.298 599 HB3 LYS 70 HB3 LYS 70 -2.114 -1.050 9.256 600 HG2 LYS 70 HG2 LYS 70 -1.726 -1.092 11.696 601 HG3 LYS 70 HG3 LYS 70 -1.943 0.667 11.772 602 HD2 LYS 70 HD2 LYS 70 -4.247 0.412 10.852 603 HD3 LYS 70 HD3 LYS 70 -4.056 -1.342 10.840 604 HE2 LYS 70 HE2 LYS 70 -3.859 0.417 13.334 605 HE3 LYS 70 HE3 LYS 70 -5.336 -0.390 12.804 606 HZ1 LYS 70 HZ1 LYS 70 -2.828 -1.789 13.573 607 HZ2 LYS 70 HZ2 LYS 70 -4.193 -1.718 14.461 608 HZ3 LYS 70 HZ3 LYS 70 -4.191 -2.529 13.047 609 H ALA 71 H ALA 71 -0.156 1.863 7.815 610 HA ALA 71 HA ALA 71 -0.030 0.204 5.452 611 HB1 ALA 71 HB1 ALA 71 0.784 3.126 5.741 612 HB2 ALA 71 HB2 ALA 71 0.361 2.275 4.248 613 HB3 ALA 71 HB3 ALA 71 -0.866 2.577 5.496 614 H LYS 72 H LYS 72 2.441 2.007 7.252 615 HA LYS 72 HA LYS 72 4.780 1.467 5.803 616 HB2 LYS 72 HB2 LYS 72 4.228 1.822 8.762 617 HB3 LYS 72 HB3 LYS 72 5.871 1.605 8.139 618 HG2 LYS 72 HG2 LYS 72 5.805 3.621 6.887 619 HG3 LYS 72 HG3 LYS 72 4.062 3.789 7.109 620 HD2 LYS 72 HD2 LYS 72 5.415 5.366 8.492 621 HD3 LYS 72 HD3 LYS 72 4.248 4.390 9.380 622 HE2 LYS 72 HE2 LYS 72 6.107 2.790 9.955 623 HE3 LYS 72 HE3 LYS 72 7.250 3.933 9.205 624 HZ1 LYS 72 HZ1 LYS 72 5.601 4.255 11.642 625 HZ2 LYS 72 HZ2 LYS 72 7.220 4.401 11.509 626 HZ3 LYS 72 HZ3 LYS 72 6.260 5.584 10.898 627 H THR 73 H THR 73 3.217 -0.716 8.152 628 HA THR 73 HA THR 73 5.366 -2.749 7.648 629 HB THR 73 HB THR 73 4.703 -2.184 9.977 630 HG1 THR 73 HG1 THR 73 4.789 -4.336 10.582 631 HG21 THR 73 HG21 THR 73 2.195 -3.826 9.386 632 HG22 THR 73 HG22 THR 73 2.728 -3.208 10.962 633 HG23 THR 73 HG23 THR 73 2.223 -2.077 9.704 634 H TYR 74 H TYR 74 1.907 -2.301 6.961 635 HA TYR 74 HA TYR 74 1.407 -4.930 5.969 636 HB2 TYR 74 HB2 TYR 74 -0.408 -3.476 6.513 637 HB3 TYR 74 HB3 TYR 74 0.191 -2.212 5.434 638 HD1 TYR 74 HD1 TYR 74 -0.301 -2.136 3.153 639 HD2 TYR 74 HD2 TYR 74 -1.305 -5.648 5.460 640 HE1 TYR 74 HE1 TYR 74 -1.378 -3.134 1.177 641 HE2 TYR 74 HE2 TYR 74 -2.428 -6.633 3.454 642 HH TYR 74 HH TYR 74 -2.379 -4.972 0.274 643 H ILE 75 H ILE 75 2.870 -2.084 4.396 644 HA ILE 75 HA ILE 75 3.027 -2.886 1.724 645 HB ILE 75 HB ILE 75 4.889 -1.336 3.539 646 HG12 ILE 75 HG12 ILE 75 3.360 -0.347 1.096 647 HG13 ILE 75 HG13 ILE 75 2.564 -0.492 2.643 648 HG21 ILE 75 HG21 ILE 75 5.313 -1.759 0.549 649 HG22 ILE 75 HG22 ILE 75 6.148 -0.539 1.530 650 HG23 ILE 75 HG23 ILE 75 6.418 -2.238 1.858 651 HD11 ILE 75 HD11 ILE 75 5.004 1.269 2.095 652 HD12 ILE 75 HD12 ILE 75 3.339 1.804 2.352 653 HD13 ILE 75 HD13 ILE 75 4.239 1.048 3.675 654 H LYS 76 H LYS 76 4.803 -4.338 4.412 655 HA LYS 76 HA LYS 76 6.102 -6.202 2.444 656 HB2 LYS 76 HB2 LYS 76 7.927 -6.491 4.062 657 HB3 LYS 76 HB3 LYS 76 7.732 -4.782 3.651 658 HG2 LYS 76 HG2 LYS 76 6.559 -4.363 5.769 659 HG3 LYS 76 HG3 LYS 76 6.683 -6.083 6.199 660 HD2 LYS 76 HD2 LYS 76 9.143 -5.912 6.207 661 HD3 LYS 76 HD3 LYS 76 9.036 -4.202 5.734 662 HE2 LYS 76 HE2 LYS 76 7.775 -3.701 7.811 663 HE3 LYS 76 HE3 LYS 76 7.855 -5.402 8.284 664 HZ1 LYS 76 HZ1 LYS 76 10.212 -3.622 7.927 665 HZ2 LYS 76 HZ2 LYS 76 9.601 -4.099 9.362 666 HZ3 LYS 76 HZ3 LYS 76 10.286 -5.195 8.366 667 H ASN 77 H ASN 77 4.100 -6.104 5.320 668 HA ASN 77 HA ASN 77 4.024 -9.037 5.526 669 HB2 ASN 77 HB2 ASN 77 2.569 -6.805 6.980 670 HB3 ASN 77 HB3 ASN 77 2.227 -8.512 7.245 671 HD21 ASN 77 HD21 ASN 77 5.544 -6.942 8.930 672 HD22 ASN 77 HD22 ASN 77 4.551 -5.955 7.874 673 H SER 78 H SER 78 3.450 -8.130 2.937 674 HA SER 78 HA SER 78 0.972 -9.557 2.426 675 HB2 SER 78 HB2 SER 78 0.122 -7.262 2.899 676 HB3 SER 78 HB3 SER 78 1.120 -6.630 1.580 677 HG SER 78 HG SER 78 -1.088 -7.125 0.985 678 H ASN 79 H ASN 79 3.336 -7.334 0.953 679 HA ASN 79 HA ASN 79 3.371 -9.007 -1.513 680 HB2 ASN 79 HB2 ASN 79 3.091 -6.932 -2.785 681 HB3 ASN 79 HB3 ASN 79 1.766 -7.184 -1.645 682 HD21 ASN 79 HD21 ASN 79 4.442 -4.205 -0.832 683 HD22 ASN 79 HD22 ASN 79 4.877 -5.462 -1.982 684 H ARG 80 H ARG 80 5.509 -8.968 0.488 685 HA ARG 80 HA ARG 80 7.747 -7.447 -0.610 686 HB2 ARG 80 HB2 ARG 80 9.066 -8.399 1.098 687 HB3 ARG 80 HB3 ARG 80 7.529 -7.851 1.756 688 HG2 ARG 80 HG2 ARG 80 6.692 -10.212 1.745 689 HG3 ARG 80 HG3 ARG 80 8.264 -10.749 1.106 690 HD2 ARG 80 HD2 ARG 80 9.409 -9.778 3.037 691 HD3 ARG 80 HD3 ARG 80 7.884 -9.195 3.694 692 HE ARG 80 HE ARG 80 8.934 -11.927 3.787 693 HH11 ARG 80 HH11 ARG 80 7.819 -13.530 4.827 694 HH12 ARG 80 HH12 ARG 80 6.158 -13.290 5.279 695 HH21 ARG 80 HH21 ARG 80 5.932 -10.099 4.026 696 HH22 ARG 80 HH22 ARG 80 5.113 -11.431 4.815 697 H MET 81 H MET 81 6.430 -10.336 -1.719 698 HA MET 81 HA MET 81 8.962 -11.020 -3.105 699 HB2 MET 81 HB2 MET 81 8.444 -12.235 -0.775 700 HB3 MET 81 HB3 MET 81 7.458 -13.280 -1.791 701 HG2 MET 81 HG2 MET 81 9.487 -13.584 -3.274 702 HG3 MET 81 HG3 MET 81 10.373 -12.514 -2.179 703 HE1 MET 81 HE1 MET 81 8.821 -16.062 -2.751 704 HE2 MET 81 HE2 MET 81 9.024 -16.848 -1.171 705 HE3 MET 81 HE3 MET 81 7.836 -15.546 -1.362 706 H GLY 82 H GLY 82 7.418 -9.826 -4.647 707 HA2 GLY 82 HA2 GLY 82 5.463 -11.529 -6.062 708 HA3 GLY 82 HA3 GLY 82 5.955 -9.891 -6.479 709 H ARG 83 H ARG 83 7.389 -9.623 -8.078 710 HA ARG 83 HA ARG 83 8.803 -11.991 -9.284 711 HB2 ARG 83 HB2 ARG 83 7.866 -9.390 -10.468 712 HB3 ARG 83 HB3 ARG 83 9.087 -10.430 -11.240 713 HG2 ARG 83 HG2 ARG 83 7.559 -12.312 -11.313 714 HG3 ARG 83 HG3 ARG 83 6.278 -11.369 -10.521 715 HD2 ARG 83 HD2 ARG 83 5.932 -10.009 -12.404 716 HD3 ARG 83 HD3 ARG 83 7.583 -10.230 -12.980 717 HE ARG 83 HE ARG 83 6.971 -12.031 -14.218 718 HH11 ARG 83 HH11 ARG 83 5.689 -13.567 -15.128 719 HH12 ARG 83 HH12 ARG 83 4.121 -13.911 -14.456 720 HH21 ARG 83 HH21 ARG 83 4.343 -11.594 -11.932 721 HH22 ARG 83 HH22 ARG 83 3.375 -12.830 -12.690 722 H THR 84 H THR 84 10.014 -11.332 -7.093 723 HA THR 84 HA THR 84 12.011 -10.686 -6.151 724 HB THR 84 HB THR 84 13.952 -11.231 -7.736 725 HG1 THR 84 HG1 THR 84 13.375 -12.376 -9.568 726 HG21 THR 84 HG21 THR 84 11.738 -13.291 -7.381 727 HG22 THR 84 HG22 THR 84 13.460 -13.633 -7.659 728 HG23 THR 84 HG23 THR 84 12.947 -12.859 -6.152 729 H ASN 85 H ASN 85 10.623 -8.359 -7.373 730 HA ASN 85 HA ASN 85 10.849 -6.297 -8.185 731 HB2 ASN 85 HB2 ASN 85 11.792 -6.061 -5.886 732 HB3 ASN 85 HB3 ASN 85 13.416 -6.264 -6.540 733 HD21 ASN 85 HD21 ASN 85 11.454 -2.736 -7.301 734 HD22 ASN 85 HD22 ASN 85 10.485 -4.190 -7.070 735 H ASN 86 H ASN 86 12.289 -8.526 -9.770 736 HA ASN 86 HA ASN 86 14.344 -7.053 -11.221 737 HB2 ASN 86 HB2 ASN 86 14.986 -9.030 -12.075 738 HB3 ASN 86 HB3 ASN 86 14.114 -9.651 -10.677 739 HD21 ASN 86 HD21 ASN 86 11.391 -10.893 -12.715 740 HD22 ASN 86 HD22 ASN 86 11.712 -10.156 -11.144 741 H PHE 87 H PHE 87 10.969 -7.193 -11.506 742 HA PHE 87 HA PHE 87 10.670 -6.647 -14.327 743 HB2 PHE 87 HB2 PHE 87 8.344 -6.443 -13.813 744 HB3 PHE 87 HB3 PHE 87 8.997 -7.763 -12.851 745 HD1 PHE 87 HD1 PHE 87 9.304 -7.551 -10.388 746 HD2 PHE 87 HD2 PHE 87 7.485 -4.416 -12.729 747 HE1 PHE 87 HE1 PHE 87 8.416 -6.510 -8.314 748 HE2 PHE 87 HE2 PHE 87 6.649 -3.358 -10.650 749 HZ PHE 87 HZ PHE 87 7.085 -4.416 -8.450 750 H LYS 88 H LYS 88 12.417 -4.796 -12.635 751 HA LYS 88 HA LYS 88 11.091 -2.187 -12.556 752 HB2 LYS 88 HB2 LYS 88 13.193 -1.489 -11.462 753 HB3 LYS 88 HB3 LYS 88 12.476 -2.922 -10.716 754 HG2 LYS 88 HG2 LYS 88 14.098 -4.349 -12.025 755 HG3 LYS 88 HG3 LYS 88 14.875 -2.873 -12.606 756 HD2 LYS 88 HD2 LYS 88 15.714 -2.337 -10.442 757 HD3 LYS 88 HD3 LYS 88 14.521 -3.355 -9.634 758 HE2 LYS 88 HE2 LYS 88 16.539 -4.567 -9.469 759 HE3 LYS 88 HE3 LYS 88 15.563 -5.390 -10.687 760 HZ1 LYS 88 HZ1 LYS 88 17.788 -3.484 -11.258 761 HZ2 LYS 88 HZ2 LYS 88 17.881 -5.102 -11.417 762 HZ3 LYS 88 HZ3 LYS 88 16.904 -4.242 -12.404 763 H THR 89 H THR 89 12.213 -3.757 -15.042 764 HA THR 89 HA THR 89 13.300 -1.450 -16.581 765 HB THR 89 HB THR 89 14.502 -4.259 -16.411 766 HG1 THR 89 HG1 THR 89 16.244 -3.193 -15.411 767 HG21 THR 89 HG21 THR 89 15.502 -1.723 -17.735 768 HG22 THR 89 HG22 THR 89 16.364 -3.286 -17.654 769 HG23 THR 89 HG23 THR 89 14.854 -3.161 -18.573 770 H ILE 90 H ILE 90 12.195 -4.850 -16.622 771 HA ILE 90 HA ILE 90 11.392 -4.846 -19.413 772 HB ILE 90 HB ILE 90 10.456 -6.802 -17.285 773 HG12 ILE 90 HG12 ILE 90 13.120 -6.887 -18.779 774 HG13 ILE 90 HG13 ILE 90 12.930 -6.580 -17.053 775 HG21 ILE 90 HG21 ILE 90 11.077 -7.165 -20.265 776 HG22 ILE 90 HG22 ILE 90 10.434 -8.408 -19.175 777 HG23 ILE 90 HG23 ILE 90 9.445 -7.041 -19.579 778 HD11 ILE 90 HD11 ILE 90 12.362 -9.202 -18.446 779 HD12 ILE 90 HD12 ILE 90 13.613 -8.824 -17.256 780 HD13 ILE 90 HD13 ILE 90 11.909 -8.835 -16.757 781 H LYS 91 H LYS 91 9.133 -5.130 -20.107 782 HA LYS 91 HA LYS 91 6.977 -4.510 -20.349 783 HB2 LYS 91 HB2 LYS 91 6.850 -4.438 -17.308 784 HB3 LYS 91 HB3 LYS 91 5.471 -4.490 -18.378 785 HG2 LYS 91 HG2 LYS 91 7.554 -6.709 -18.393 786 HG3 LYS 91 HG3 LYS 91 6.221 -6.677 -17.250 787 HD2 LYS 91 HD2 LYS 91 4.584 -6.961 -18.856 788 HD3 LYS 91 HD3 LYS 91 5.583 -6.331 -20.170 789 HE2 LYS 91 HE2 LYS 91 5.298 -8.680 -20.524 790 HE3 LYS 91 HE3 LYS 91 6.987 -8.359 -20.133 791 HZ1 LYS 91 HZ1 LYS 91 4.957 -9.408 -18.224 792 HZ2 LYS 91 HZ2 LYS 91 6.130 -10.294 -18.932 793 HZ3 LYS 91 HZ3 LYS 91 6.529 -9.134 -17.856 794 H MET 92 H MET 92 9.116 -2.219 -19.338 795 HA MET 92 HA MET 92 7.058 -0.049 -19.238 796 HB2 MET 92 HB2 MET 92 9.990 0.035 -18.478 797 HB3 MET 92 HB3 MET 92 8.816 1.353 -18.328 798 HG2 MET 92 HG2 MET 92 7.414 -0.301 -16.905 799 HG3 MET 92 HG3 MET 92 8.892 -1.260 -16.804 800 HE1 MET 92 HE1 MET 92 11.095 1.278 -16.676 801 HE2 MET 92 HE2 MET 92 11.340 1.149 -14.920 802 HE3 MET 92 HE3 MET 92 11.156 -0.323 -15.905 803 H PHE 93 H PHE 93 10.081 -0.779 -21.062 804 HA PHE 93 HA PHE 93 9.722 1.572 -22.781 805 HB2 PHE 93 HB2 PHE 93 11.618 -0.766 -23.152 806 HB3 PHE 93 HB3 PHE 93 11.745 0.835 -23.861 807 HD1 PHE 93 HD1 PHE 93 12.255 2.833 -22.365 808 HD2 PHE 93 HD2 PHE 93 12.437 -1.241 -20.975 809 HE1 PHE 93 HE1 PHE 93 13.628 3.568 -20.422 810 HE2 PHE 93 HE2 PHE 93 13.831 -0.505 -19.033 811 HZ PHE 93 HZ PHE 93 14.417 1.894 -18.756 812 H GLU 94 H GLU 94 8.698 -1.700 -22.853 813 HA GLU 94 HA GLU 94 8.197 -1.869 -25.754 814 HB2 GLU 94 HB2 GLU 94 7.995 -3.690 -23.346 815 HB3 GLU 94 HB3 GLU 94 7.200 -4.137 -24.868 816 HG2 GLU 94 HG2 GLU 94 10.177 -3.523 -24.575 817 HG3 GLU 94 HG3 GLU 94 9.479 -5.134 -24.499 818 H ASP 95 H ASP 95 6.224 -1.703 -26.718 819 HA ASP 95 HA ASP 95 3.785 -1.106 -25.100 820 HB2 ASP 95 HB2 ASP 95 5.046 0.579 -27.296 821 HB3 ASP 95 HB3 ASP 95 3.346 0.709 -26.869 822 H ASP 96 H ASP 96 1.791 -1.375 -26.226 823 HA ASP 96 HA ASP 96 1.851 -3.153 -28.639 824 HB2 ASP 96 HB2 ASP 96 -0.016 -3.013 -26.264 825 HB3 ASP 96 HB3 ASP 96 -0.629 -3.517 -27.834 826 H VAL 97 H VAL 97 0.794 -2.570 -30.418 827 HA VAL 97 HA VAL 97 -0.938 -0.112 -30.434 828 HB VAL 97 HB VAL 97 1.099 -0.892 -32.555 829 HG11 VAL 97 HG11 VAL 97 -0.703 1.561 -32.334 830 HG12 VAL 97 HG12 VAL 97 0.583 1.325 -33.539 831 HG13 VAL 97 HG13 VAL 97 -0.829 0.270 -33.553 832 HG21 VAL 97 HG21 VAL 97 2.270 0.018 -30.602 833 HG22 VAL 97 HG22 VAL 97 2.274 1.203 -31.907 834 HG23 VAL 97 HG23 VAL 97 1.150 1.398 -30.542 835 H SER 98 H SER 98 -0.086 -3.172 -32.041 836 HA SER 98 HA SER 98 -2.847 -3.413 -33.138 837 HB2 SER 98 HB2 SER 98 -1.808 -4.708 -34.963 838 HB3 SER 98 HB3 SER 98 -1.196 -3.052 -34.863 839 HG SER 98 HG SER 98 0.500 -4.566 -35.142 840 H SER 99 H SER 99 -1.553 -4.425 -30.501 841 HA SER 99 HA SER 99 -1.514 -6.222 -29.145 842 HB2 SER 99 HB2 SER 99 -3.949 -6.243 -29.758 843 HB3 SER 99 HB3 SER 99 -3.586 -7.529 -30.923 844 HG SER 99 HG SER 99 -4.221 -8.321 -28.833 845 H ALA 100 H ALA 100 0.612 -6.710 -29.536 846 HA ALA 100 HA ALA 100 1.442 -8.591 -31.628 847 HB1 ALA 100 HB1 ALA 100 3.014 -7.293 -29.362 848 HB2 ALA 100 HB2 ALA 100 3.690 -8.158 -30.758 849 HB3 ALA 100 HB3 ALA 100 2.818 -6.640 -31.005 850 H SER 101 H SER 101 3.067 -10.321 -30.941 851 HA SER 101 HA SER 101 1.912 -12.088 -28.811 852 HB2 SER 101 HB2 SER 101 3.285 -12.867 -31.414 853 HB3 SER 101 HB3 SER 101 2.786 -13.986 -30.134 854 HG SER 101 HG SER 101 1.223 -13.815 -31.812 855 H ALA 102 H ALA 102 3.642 -13.706 -28.002 856 HA ALA 102 HA ALA 102 5.707 -12.266 -26.740 857 HB1 ALA 102 HB1 ALA 102 5.452 -15.269 -27.196 858 HB2 ALA 102 HB2 ALA 102 6.468 -14.488 -25.965 859 HB3 ALA 102 HB3 ALA 102 4.703 -14.354 -25.864 860 H GLN 103 H GLN 103 5.732 -13.782 -29.762 861 HA GLN 103 HA GLN 103 8.207 -12.422 -30.483 862 HB2 GLN 103 HB2 GLN 103 7.837 -15.431 -30.827 863 HB3 GLN 103 HB3 GLN 103 8.997 -14.498 -31.779 864 HG2 GLN 103 HG2 GLN 103 10.128 -13.800 -29.643 865 HG3 GLN 103 HG3 GLN 103 9.053 -14.899 -28.763 866 HE21 GLN 103 HE21 GLN 103 10.703 -17.876 -29.953 867 HE22 GLN 103 HE22 GLN 103 9.162 -17.274 -29.361 868 HA PRO 104 HA PRO 104 5.777 -11.994 -34.273 869 HB2 PRO 104 HB2 PRO 104 7.683 -11.296 -36.094 870 HB3 PRO 104 HB3 PRO 104 7.123 -10.189 -34.802 871 HG2 PRO 104 HG2 PRO 104 9.598 -11.943 -34.802 872 HG3 PRO 104 HG3 PRO 104 9.465 -10.213 -34.358 873 HD2 PRO 104 HD2 PRO 104 9.437 -12.220 -32.498 874 HD3 PRO 104 HD3 PRO 104 8.472 -10.723 -32.289 875 H ASN 105 H ASN 105 5.024 -13.545 -35.472 876 HA ASN 105 HA ASN 105 6.737 -15.742 -36.542 877 HB2 ASN 105 HB2 ASN 105 5.533 -16.195 -34.281 878 HB3 ASN 105 HB3 ASN 105 4.053 -16.289 -35.231 879 HD21 ASN 105 HD21 ASN 105 5.114 -19.385 -36.843 880 HD22 ASN 105 HD22 ASN 105 4.271 -17.872 -37.204 881 H LEU 106 H LEU 106 6.024 -13.624 -38.094 882 HA LEU 106 HA LEU 106 4.136 -14.836 -40.051 883 HB2 LEU 106 HB2 LEU 106 3.058 -13.035 -38.621 884 HB3 LEU 106 HB3 LEU 106 4.194 -11.889 -39.318 885 HG LEU 106 HG LEU 106 3.237 -12.497 -41.621 886 HD11 LEU 106 HD11 LEU 106 1.132 -13.892 -39.907 887 HD12 LEU 106 HD12 LEU 106 0.982 -13.535 -41.641 888 HD13 LEU 106 HD13 LEU 106 2.207 -14.677 -41.084 889 HD21 LEU 106 HD21 LEU 106 2.558 -10.466 -40.404 890 HD22 LEU 106 HD22 LEU 106 1.198 -11.156 -41.302 891 HD23 LEU 106 HD23 LEU 106 1.304 -11.387 -39.541 892 HA PRO 107 HA PRO 107 8.242 -13.645 -41.975 893 HB2 PRO 107 HB2 PRO 107 8.917 -16.056 -43.064 894 HB3 PRO 107 HB3 PRO 107 9.256 -15.622 -41.360 895 HG2 PRO 107 HG2 PRO 107 6.913 -17.224 -42.442 896 HG3 PRO 107 HG3 PRO 107 7.994 -17.633 -41.072 897 HD2 PRO 107 HD2 PRO 107 5.572 -16.454 -40.684 898 HD3 PRO 107 HD3 PRO 107 6.987 -16.034 -39.672 Start of MODEL 18 1 H1 GLY -5 H1 GLY -5 -18.217 -5.444 -28.658 2 H2 GLY -5 H2 GLY -5 -17.868 -5.369 -30.256 3 H3 GLY -5 H3 GLY -5 -17.171 -6.518 -29.319 4 HA2 GLY -5 HA2 GLY -5 -20.050 -6.338 -29.945 5 HA3 GLY -5 HA3 GLY -5 -18.913 -7.489 -30.667 6 H SER -4 H SER -4 -21.108 -6.969 -28.149 7 HA SER -4 HA SER -4 -20.266 -9.432 -26.685 8 HB2 SER -4 HB2 SER -4 -21.076 -6.804 -25.375 9 HB3 SER -4 HB3 SER -4 -20.755 -8.336 -24.542 10 HG SER -4 HG SER -4 -18.935 -6.930 -24.514 11 H HIS -3 H HIS -3 -21.974 -10.513 -25.585 12 HA HIS -3 HA HIS -3 -24.704 -9.918 -26.621 13 HB2 HIS -3 HB2 HIS -3 -23.631 -12.135 -27.144 14 HB3 HIS -3 HB3 HIS -3 -23.687 -12.507 -25.419 15 HD2 HIS -3 HD2 HIS -3 -25.989 -13.434 -24.499 16 HE1 HIS -3 HE1 HIS -3 -28.415 -12.737 -27.942 17 HE2 HIS -3 HE2 HIS -3 -28.341 -13.813 -25.637 18 H MET -2 H MET -2 -26.333 -9.499 -25.332 19 HA MET -2 HA MET -2 -26.018 -9.576 -22.356 20 HB2 MET -2 HB2 MET -2 -27.011 -7.216 -24.005 21 HB3 MET -2 HB3 MET -2 -27.111 -7.359 -22.244 22 HG2 MET -2 HG2 MET -2 -24.623 -7.525 -22.136 23 HG3 MET -2 HG3 MET -2 -24.553 -7.336 -23.887 24 HE1 MET -2 HE1 MET -2 -25.002 -5.615 -20.435 25 HE2 MET -2 HE2 MET -2 -25.593 -3.993 -20.854 26 HE3 MET -2 HE3 MET -2 -26.661 -5.398 -21.043 27 H ALA -1 H ALA -1 -27.372 -11.180 -21.928 28 HA ALA -1 HA ALA -1 -30.272 -10.713 -22.362 29 HB1 ALA -1 HB1 ALA -1 -28.878 -13.331 -23.068 30 HB2 ALA -1 HB2 ALA -1 -30.638 -13.069 -23.002 31 HB3 ALA -1 HB3 ALA -1 -29.659 -12.196 -24.192 32 H SER 0 H SER 0 -28.139 -13.226 -20.914 33 HA SER 0 HA SER 0 -28.207 -14.312 -18.930 34 HB2 SER 0 HB2 SER 0 -28.699 -11.530 -17.866 35 HB3 SER 0 HB3 SER 0 -28.025 -12.903 -16.962 36 HG SER 0 HG SER 0 -26.380 -11.511 -17.782 37 H MET 1 H MET 1 -30.625 -14.575 -20.161 38 HA MET 1 HA MET 1 -32.414 -15.240 -17.959 39 HB2 MET 1 HB2 MET 1 -34.319 -13.883 -18.576 40 HB3 MET 1 HB3 MET 1 -32.943 -12.832 -18.264 41 HG2 MET 1 HG2 MET 1 -32.546 -12.724 -20.758 42 HG3 MET 1 HG3 MET 1 -34.045 -13.617 -20.993 43 HE1 MET 1 HE1 MET 1 -36.148 -12.414 -18.974 44 HE2 MET 1 HE2 MET 1 -36.820 -11.114 -19.981 45 HE3 MET 1 HE3 MET 1 -36.427 -12.685 -20.712 46 H ASP 2 H ASP 2 -31.944 -15.138 -21.360 47 HA ASP 2 HA ASP 2 -34.062 -17.117 -21.935 48 HB2 ASP 2 HB2 ASP 2 -33.664 -15.058 -23.297 49 HB3 ASP 2 HB3 ASP 2 -32.107 -15.718 -23.795 50 H GLN 3 H GLN 3 -30.823 -17.300 -21.114 51 HA GLN 3 HA GLN 3 -30.360 -19.972 -22.361 52 HB2 GLN 3 HB2 GLN 3 -29.435 -18.053 -23.657 53 HB3 GLN 3 HB3 GLN 3 -28.495 -17.567 -22.265 54 HG2 GLN 3 HG2 GLN 3 -27.879 -20.352 -22.900 55 HG3 GLN 3 HG3 GLN 3 -27.841 -19.406 -24.377 56 HE21 GLN 3 HE21 GLN 3 -25.206 -18.310 -21.367 57 HE22 GLN 3 HE22 GLN 3 -26.756 -19.058 -20.952 58 H LEU 4 H LEU 4 -31.094 -19.031 -19.539 59 HA LEU 4 HA LEU 4 -28.834 -20.300 -18.026 60 HB2 LEU 4 HB2 LEU 4 -30.630 -17.964 -17.307 61 HB3 LEU 4 HB3 LEU 4 -29.954 -19.006 -16.065 62 HG LEU 4 HG LEU 4 -27.658 -18.482 -16.790 63 HD11 LEU 4 HD11 LEU 4 -29.033 -16.574 -18.722 64 HD12 LEU 4 HD12 LEU 4 -27.328 -16.419 -18.216 65 HD13 LEU 4 HD13 LEU 4 -27.847 -17.844 -19.098 66 HD21 LEU 4 HD21 LEU 4 -28.772 -17.217 -14.991 67 HD22 LEU 4 HD22 LEU 4 -27.654 -16.186 -15.893 68 HD23 LEU 4 HD23 LEU 4 -29.405 -16.060 -16.180 69 H ASP 5 H ASP 5 -29.319 -22.154 -17.087 70 HA ASP 5 HA ASP 5 -32.061 -22.717 -16.099 71 HB2 ASP 5 HB2 ASP 5 -31.777 -23.530 -18.496 72 HB3 ASP 5 HB3 ASP 5 -30.521 -24.619 -17.915 73 H GLU 6 H GLU 6 -28.960 -22.499 -15.181 74 HA GLU 6 HA GLU 6 -28.954 -24.888 -13.399 75 HB2 GLU 6 HB2 GLU 6 -27.154 -24.751 -15.081 76 HB3 GLU 6 HB3 GLU 6 -26.658 -23.180 -14.439 77 HG2 GLU 6 HG2 GLU 6 -26.191 -24.233 -12.246 78 HG3 GLU 6 HG3 GLU 6 -26.751 -25.787 -12.870 79 H ILE 7 H ILE 7 -30.258 -24.019 -11.783 80 HA ILE 7 HA ILE 7 -28.982 -21.926 -10.082 81 HB ILE 7 HB ILE 7 -31.999 -22.101 -10.433 82 HG12 ILE 7 HG12 ILE 7 -31.534 -19.685 -11.484 83 HG13 ILE 7 HG13 ILE 7 -30.031 -20.430 -12.003 84 HG21 ILE 7 HG21 ILE 7 -30.166 -20.013 -9.170 85 HG22 ILE 7 HG22 ILE 7 -31.940 -19.958 -9.228 86 HG23 ILE 7 HG23 ILE 7 -31.139 -21.208 -8.281 87 HD11 ILE 7 HD11 ILE 7 -32.876 -21.348 -12.631 88 HD12 ILE 7 HD12 ILE 7 -31.734 -20.582 -13.751 89 HD13 ILE 7 HD13 ILE 7 -31.426 -22.220 -13.154 90 H ILE 8 H ILE 8 -28.228 -23.134 -8.453 91 HA ILE 8 HA ILE 8 -30.083 -24.878 -6.919 92 HB ILE 8 HB ILE 8 -27.232 -25.745 -7.553 93 HG12 ILE 8 HG12 ILE 8 -28.597 -27.719 -8.728 94 HG13 ILE 8 HG13 ILE 8 -29.790 -26.466 -9.002 95 HG21 ILE 8 HG21 ILE 8 -29.587 -27.184 -6.249 96 HG22 ILE 8 HG22 ILE 8 -27.979 -27.877 -6.550 97 HG23 ILE 8 HG23 ILE 8 -28.152 -26.554 -5.406 98 HD11 ILE 8 HD11 ILE 8 -26.864 -26.484 -9.897 99 HD12 ILE 8 HD12 ILE 8 -28.289 -26.716 -10.927 100 HD13 ILE 8 HD13 ILE 8 -27.969 -25.134 -10.199 101 H GLU 9 H GLU 9 -30.005 -24.436 -4.808 102 HA GLU 9 HA GLU 9 -29.532 -23.367 -2.866 103 HB2 GLU 9 HB2 GLU 9 -28.047 -25.440 -3.033 104 HB3 GLU 9 HB3 GLU 9 -26.692 -24.336 -3.266 105 HG2 GLU 9 HG2 GLU 9 -27.234 -23.270 -1.057 106 HG3 GLU 9 HG3 GLU 9 -28.622 -24.342 -0.894 107 H GLN 10 H GLN 10 -29.734 -21.477 -4.694 108 HA GLN 10 HA GLN 10 -27.792 -19.371 -3.934 109 HB2 GLN 10 HB2 GLN 10 -27.851 -20.739 -6.497 110 HB3 GLN 10 HB3 GLN 10 -28.394 -19.086 -6.747 111 HG2 GLN 10 HG2 GLN 10 -26.385 -18.210 -5.652 112 HG3 GLN 10 HG3 GLN 10 -25.856 -19.849 -5.243 113 HE21 GLN 10 HE21 GLN 10 -23.821 -19.158 -8.165 114 HE22 GLN 10 HE22 GLN 10 -23.860 -18.870 -6.430 115 H ILE 11 H ILE 11 -28.501 -17.217 -4.838 116 HA ILE 11 HA ILE 11 -29.940 -15.506 -4.741 117 HB ILE 11 HB ILE 11 -29.810 -16.314 -7.017 118 HG12 ILE 11 HG12 ILE 11 -32.470 -14.954 -6.499 119 HG13 ILE 11 HG13 ILE 11 -30.887 -14.182 -6.357 120 HG21 ILE 11 HG21 ILE 11 -32.483 -17.670 -6.526 121 HG22 ILE 11 HG22 ILE 11 -31.744 -17.419 -8.123 122 HG23 ILE 11 HG23 ILE 11 -30.938 -18.435 -6.944 123 HD11 ILE 11 HD11 ILE 11 -32.109 -15.343 -8.895 124 HD12 ILE 11 HD12 ILE 11 -31.830 -13.641 -8.510 125 HD13 ILE 11 HD13 ILE 11 -30.445 -14.721 -8.767 126 H GLN 12 H GLN 12 -30.382 -16.805 -2.491 127 HA GLN 12 HA GLN 12 -33.299 -16.999 -1.997 128 HB2 GLN 12 HB2 GLN 12 -30.982 -17.384 -0.053 129 HB3 GLN 12 HB3 GLN 12 -32.677 -17.706 0.236 130 HG2 GLN 12 HG2 GLN 12 -32.251 -19.804 -0.320 131 HG3 GLN 12 HG3 GLN 12 -32.349 -19.251 -1.982 132 HE21 GLN 12 HE21 GLN 12 -28.420 -19.347 -1.499 133 HE22 GLN 12 HE22 GLN 12 -29.332 -17.928 -1.047 134 H LYS 13 H LYS 13 -34.146 -15.907 -0.002 135 HA LYS 13 HA LYS 13 -33.489 -13.038 0.121 136 HB2 LYS 13 HB2 LYS 13 -35.549 -14.737 1.580 137 HB3 LYS 13 HB3 LYS 13 -35.305 -13.005 1.856 138 HG2 LYS 13 HG2 LYS 13 -35.730 -12.552 -0.554 139 HG3 LYS 13 HG3 LYS 13 -36.080 -14.273 -0.806 140 HD2 LYS 13 HD2 LYS 13 -37.961 -14.144 0.787 141 HD3 LYS 13 HD3 LYS 13 -37.586 -12.435 1.112 142 HE2 LYS 13 HE2 LYS 13 -37.973 -11.897 -1.284 143 HE3 LYS 13 HE3 LYS 13 -38.363 -13.592 -1.606 144 HZ1 LYS 13 HZ1 LYS 13 -39.887 -11.811 0.226 145 HZ2 LYS 13 HZ2 LYS 13 -40.369 -12.263 -1.265 146 HZ3 LYS 13 HZ3 LYS 13 -40.252 -13.376 -0.078 147 H GLU 14 H GLU 14 -31.248 -13.751 0.588 148 HA GLU 14 HA GLU 14 -30.537 -14.396 3.347 149 HB2 GLU 14 HB2 GLU 14 -29.002 -13.613 0.871 150 HB3 GLU 14 HB3 GLU 14 -28.224 -13.662 2.474 151 HG2 GLU 14 HG2 GLU 14 -28.647 -15.922 2.803 152 HG3 GLU 14 HG3 GLU 14 -29.894 -15.998 1.558 153 H ALA 15 H ALA 15 -31.412 -12.935 4.711 154 HA ALA 15 HA ALA 15 -30.047 -10.319 4.816 155 HB1 ALA 15 HB1 ALA 15 -33.066 -10.701 5.052 156 HB2 ALA 15 HB2 ALA 15 -32.197 -9.195 5.421 157 HB3 ALA 15 HB3 ALA 15 -32.206 -9.836 3.765 158 H ILE 16 H ILE 16 -32.594 -11.875 6.702 159 HA ILE 16 HA ILE 16 -30.935 -11.669 9.169 160 HB ILE 16 HB ILE 16 -33.816 -11.108 8.503 161 HG12 ILE 16 HG12 ILE 16 -32.094 -9.217 10.104 162 HG13 ILE 16 HG13 ILE 16 -31.755 -9.373 8.391 163 HG21 ILE 16 HG21 ILE 16 -32.685 -11.302 11.331 164 HG22 ILE 16 HG22 ILE 16 -34.219 -10.504 10.931 165 HG23 ILE 16 HG23 ILE 16 -34.038 -12.232 10.645 166 HD11 ILE 16 HD11 ILE 16 -34.486 -8.651 9.516 167 HD12 ILE 16 HD12 ILE 16 -33.306 -7.531 8.804 168 HD13 ILE 16 HD13 ILE 16 -34.049 -8.789 7.797 169 H ASN 17 H ASN 17 -31.741 -13.911 7.147 170 HA ASN 17 HA ASN 17 -32.743 -15.921 9.023 171 HB2 ASN 17 HB2 ASN 17 -31.952 -16.073 6.075 172 HB3 ASN 17 HB3 ASN 17 -32.607 -17.428 6.991 173 HD21 ASN 17 HD21 ASN 17 -35.230 -14.838 5.463 174 HD22 ASN 17 HD22 ASN 17 -33.570 -14.911 4.917 175 H SER 18 H SER 18 -29.694 -14.697 8.448 176 HA SER 18 HA SER 18 -28.270 -17.231 9.145 177 HB2 SER 18 HB2 SER 18 -27.475 -15.986 7.193 178 HB3 SER 18 HB3 SER 18 -27.165 -14.567 8.211 179 HG SER 18 HG SER 18 -25.289 -15.883 7.880 180 H ASN 19 H ASN 19 -28.267 -13.782 10.239 181 HA ASN 19 HA ASN 19 -26.501 -14.370 12.376 182 HB2 ASN 19 HB2 ASN 19 -26.676 -12.040 12.950 183 HB3 ASN 19 HB3 ASN 19 -26.640 -12.186 11.202 184 HD21 ASN 19 HD21 ASN 19 -29.741 -10.509 10.864 185 HD22 ASN 19 HD22 ASN 19 -28.326 -11.160 10.056 186 H VAL 20 H VAL 20 -29.865 -14.744 12.342 187 HA VAL 20 HA VAL 20 -30.383 -14.406 15.192 188 HB VAL 20 HB VAL 20 -31.955 -15.659 12.917 189 HG11 VAL 20 HG11 VAL 20 -32.874 -15.204 15.789 190 HG12 VAL 20 HG12 VAL 20 -33.945 -15.567 14.418 191 HG13 VAL 20 HG13 VAL 20 -32.764 -16.765 14.943 192 HG21 VAL 20 HG21 VAL 20 -31.668 -13.183 12.859 193 HG22 VAL 20 HG22 VAL 20 -33.346 -13.639 13.152 194 HG23 VAL 20 HG23 VAL 20 -32.333 -13.073 14.500 195 H VAL 21 H VAL 21 -29.165 -17.063 13.251 196 HA VAL 21 HA VAL 21 -29.704 -19.024 15.409 197 HB VAL 21 HB VAL 21 -28.612 -19.727 12.679 198 HG11 VAL 21 HG11 VAL 21 -30.320 -21.248 14.719 199 HG12 VAL 21 HG12 VAL 21 -29.728 -21.883 13.170 200 HG13 VAL 21 HG13 VAL 21 -28.585 -21.503 14.456 201 HG21 VAL 21 HG21 VAL 21 -30.679 -18.511 12.204 202 HG22 VAL 21 HG22 VAL 21 -30.972 -20.237 12.027 203 HG23 VAL 21 HG23 VAL 21 -31.536 -19.397 13.489 204 H LEU 22 H LEU 22 -27.982 -17.269 16.297 205 HA LEU 22 HA LEU 22 -25.449 -18.781 16.613 206 HB2 LEU 22 HB2 LEU 22 -25.720 -15.865 15.798 207 HB3 LEU 22 HB3 LEU 22 -24.289 -16.444 16.636 208 HG LEU 22 HG LEU 22 -25.234 -17.588 13.973 209 HD11 LEU 22 HD11 LEU 22 -23.065 -15.535 14.568 210 HD12 LEU 22 HD12 LEU 22 -23.410 -16.271 12.985 211 HD13 LEU 22 HD13 LEU 22 -24.611 -15.219 13.750 212 HD21 LEU 22 HD21 LEU 22 -23.781 -19.140 15.246 213 HD22 LEU 22 HD22 LEU 22 -22.903 -18.462 13.875 214 HD23 LEU 22 HD23 LEU 22 -22.599 -17.836 15.509 215 H LYS 23 H LYS 23 -24.529 -18.660 18.580 216 HA LYS 23 HA LYS 23 -25.771 -17.000 20.735 217 HB2 LYS 23 HB2 LYS 23 -25.230 -19.990 20.917 218 HB3 LYS 23 HB3 LYS 23 -25.767 -18.946 22.241 219 HG2 LYS 23 HG2 LYS 23 -27.814 -18.369 20.857 220 HG3 LYS 23 HG3 LYS 23 -27.342 -19.657 19.738 221 HD2 LYS 23 HD2 LYS 23 -27.966 -19.986 22.706 222 HD3 LYS 23 HD3 LYS 23 -29.042 -20.395 21.364 223 HE2 LYS 23 HE2 LYS 23 -27.392 -22.072 20.548 224 HE3 LYS 23 HE3 LYS 23 -26.329 -21.683 21.908 225 HZ1 LYS 23 HZ1 LYS 23 -29.073 -22.797 22.161 226 HZ2 LYS 23 HZ2 LYS 23 -27.690 -23.633 22.388 227 HZ3 LYS 23 HZ3 LYS 23 -28.092 -22.431 23.417 228 H ASN 24 H ASN 24 -23.419 -16.388 19.403 229 HA ASN 24 HA ASN 24 -21.222 -15.871 19.605 230 HB2 ASN 24 HB2 ASN 24 -22.355 -14.493 21.321 231 HB3 ASN 24 HB3 ASN 24 -21.919 -15.679 22.549 232 HD21 ASN 24 HD21 ASN 24 -18.487 -14.681 22.650 233 HD22 ASN 24 HD22 ASN 24 -19.557 -16.080 22.845 234 HA PRO 25 HA PRO 25 -19.967 -20.178 20.715 235 HB2 PRO 25 HB2 PRO 25 -18.917 -21.018 18.353 236 HB3 PRO 25 HB3 PRO 25 -20.674 -20.868 18.633 237 HG2 PRO 25 HG2 PRO 25 -18.843 -18.839 17.304 238 HG3 PRO 25 HG3 PRO 25 -20.391 -19.501 16.686 239 HD2 PRO 25 HD2 PRO 25 -20.261 -17.127 18.017 240 HD3 PRO 25 HD3 PRO 25 -21.653 -18.234 18.213 241 H ARG 26 H ARG 26 -18.592 -18.909 22.155 242 HA ARG 26 HA ARG 26 -16.614 -18.369 23.144 243 HB2 ARG 26 HB2 ARG 26 -16.765 -20.965 22.700 244 HB3 ARG 26 HB3 ARG 26 -15.332 -20.711 21.726 245 HG2 ARG 26 HG2 ARG 26 -15.632 -19.848 24.646 246 HG3 ARG 26 HG3 ARG 26 -15.036 -21.433 24.143 247 HD2 ARG 26 HD2 ARG 26 -13.198 -20.262 22.871 248 HD3 ARG 26 HD3 ARG 26 -13.699 -18.752 23.664 249 HE ARG 26 HE ARG 26 -13.385 -20.437 25.790 250 HH11 ARG 26 HH11 ARG 26 -11.542 -20.864 26.954 251 HH12 ARG 26 HH12 ARG 26 -9.979 -20.645 26.223 252 HH21 ARG 26 HH21 ARG 26 -11.194 -19.616 23.184 253 HH22 ARG 26 HH22 ARG 26 -9.777 -19.968 24.140 254 H VAL 27 H VAL 27 -16.969 -16.691 21.224 255 HA VAL 27 HA VAL 27 -16.202 -15.245 19.634 256 HB VAL 27 HB VAL 27 -13.881 -15.264 21.548 257 HG11 VAL 27 HG11 VAL 27 -14.905 -13.101 19.626 258 HG12 VAL 27 HG12 VAL 27 -13.633 -12.870 20.845 259 HG13 VAL 27 HG13 VAL 27 -13.355 -13.946 19.477 260 HG21 VAL 27 HG21 VAL 27 -15.995 -14.918 22.729 261 HG22 VAL 27 HG22 VAL 27 -15.112 -13.397 22.631 262 HG23 VAL 27 HG23 VAL 27 -16.485 -13.681 21.540 263 HA PRO 28 HA PRO 28 -13.646 -17.995 17.009 264 HB2 PRO 28 HB2 PRO 28 -14.801 -17.478 14.611 265 HB3 PRO 28 HB3 PRO 28 -15.476 -18.630 15.804 266 HG2 PRO 28 HG2 PRO 28 -16.280 -15.730 15.371 267 HG3 PRO 28 HG3 PRO 28 -17.354 -17.157 15.532 268 HD2 PRO 28 HD2 PRO 28 -16.811 -15.501 17.621 269 HD3 PRO 28 HD3 PRO 28 -17.002 -17.263 17.868 270 H THR 29 H THR 29 -12.316 -17.601 15.143 271 HA THR 29 HA THR 29 -10.948 -14.980 15.446 272 HB THR 29 HB THR 29 -8.938 -16.578 15.392 273 HG1 THR 29 HG1 THR 29 -9.363 -18.664 16.101 274 HG21 THR 29 HG21 THR 29 -10.857 -16.739 17.751 275 HG22 THR 29 HG22 THR 29 -9.102 -17.022 17.803 276 HG23 THR 29 HG23 THR 29 -9.729 -15.406 17.433 277 H GLN 30 H GLN 30 -12.047 -14.421 13.433 278 HA GLN 30 HA GLN 30 -10.580 -15.425 11.044 279 HB2 GLN 30 HB2 GLN 30 -12.644 -15.578 9.813 280 HB3 GLN 30 HB3 GLN 30 -12.859 -16.409 11.350 281 HG2 GLN 30 HG2 GLN 30 -13.851 -14.096 12.178 282 HG3 GLN 30 HG3 GLN 30 -13.997 -13.737 10.458 283 HE21 GLN 30 HE21 GLN 30 -16.543 -16.402 12.247 284 HE22 GLN 30 HE22 GLN 30 -15.182 -15.722 13.131 285 H LYS 31 H LYS 31 -10.238 -12.939 12.604 286 HA LYS 31 HA LYS 31 -11.069 -10.790 10.765 287 HB2 LYS 31 HB2 LYS 31 -11.277 -10.965 13.342 288 HB3 LYS 31 HB3 LYS 31 -9.602 -10.472 13.402 289 HG2 LYS 31 HG2 LYS 31 -11.955 -8.916 12.206 290 HG3 LYS 31 HG3 LYS 31 -11.193 -8.639 13.760 291 HD2 LYS 31 HD2 LYS 31 -10.196 -6.956 12.602 292 HD3 LYS 31 HD3 LYS 31 -9.006 -8.216 12.356 293 HE2 LYS 31 HE2 LYS 31 -9.261 -7.265 10.228 294 HE3 LYS 31 HE3 LYS 31 -10.262 -8.716 10.121 295 HZ1 LYS 31 HZ1 LYS 31 -11.244 -5.963 10.649 296 HZ2 LYS 31 HZ2 LYS 31 -11.395 -6.746 9.246 297 HZ3 LYS 31 HZ3 LYS 31 -12.216 -7.282 10.562 298 H THR 32 H THR 32 -9.653 -11.700 9.079 299 HA THR 32 HA THR 32 -6.881 -10.591 9.186 300 HB THR 32 HB THR 32 -7.012 -12.969 9.954 301 HG1 THR 32 HG1 THR 32 -5.197 -13.575 8.823 302 HG21 THR 32 HG21 THR 32 -7.525 -13.621 7.024 303 HG22 THR 32 HG22 THR 32 -7.187 -14.769 8.335 304 HG23 THR 32 HG23 THR 32 -8.689 -13.836 8.352 305 H GLY 33 H GLY 33 -9.510 -10.062 7.563 306 HA2 GLY 33 HA2 GLY 33 -8.665 -10.447 4.773 307 HA3 GLY 33 HA3 GLY 33 -10.129 -9.655 5.344 308 H GLU 34 H GLU 34 -9.956 -7.503 6.170 309 HA GLU 34 HA GLU 34 -9.478 -5.309 6.133 310 HB2 GLU 34 HB2 GLU 34 -6.576 -6.175 5.979 311 HB3 GLU 34 HB3 GLU 34 -7.122 -4.544 6.316 312 HG2 GLU 34 HG2 GLU 34 -7.888 -6.903 8.086 313 HG3 GLU 34 HG3 GLU 34 -6.413 -5.976 8.294 314 H LEU 35 H LEU 35 -9.133 -7.062 3.380 315 HA LEU 35 HA LEU 35 -9.042 -4.718 1.645 316 HB2 LEU 35 HB2 LEU 35 -7.137 -7.101 1.393 317 HB3 LEU 35 HB3 LEU 35 -7.567 -6.047 0.061 318 HG LEU 35 HG LEU 35 -6.745 -4.118 1.722 319 HD11 LEU 35 HD11 LEU 35 -4.982 -6.485 2.510 320 HD12 LEU 35 HD12 LEU 35 -4.735 -4.779 2.954 321 HD13 LEU 35 HD13 LEU 35 -6.113 -5.669 3.595 322 HD21 LEU 35 HD21 LEU 35 -5.855 -4.596 -0.543 323 HD22 LEU 35 HD22 LEU 35 -4.552 -4.248 0.597 324 HD23 LEU 35 HD23 LEU 35 -4.894 -5.926 0.114 325 H SER 36 H SER 36 -10.278 -4.921 -0.041 326 HA SER 36 HA SER 36 -11.770 -7.453 -0.625 327 HB2 SER 36 HB2 SER 36 -13.178 -5.708 0.363 328 HB3 SER 36 HB3 SER 36 -12.753 -4.621 -0.969 329 HG SER 36 HG SER 36 -14.736 -5.777 -1.312 330 H GLU 37 H GLU 37 -11.193 -4.496 -2.457 331 HA GLU 37 HA GLU 37 -9.891 -5.967 -4.635 332 HB2 GLU 37 HB2 GLU 37 -12.675 -6.111 -4.477 333 HB3 GLU 37 HB3 GLU 37 -12.451 -4.704 -5.527 334 HG2 GLU 37 HG2 GLU 37 -10.865 -6.098 -6.908 335 HG3 GLU 37 HG3 GLU 37 -11.227 -7.465 -5.844 336 H GLU 38 H GLU 38 -11.691 -3.047 -3.736 337 HA GLU 38 HA GLU 38 -10.286 -1.212 -5.458 338 HB2 GLU 38 HB2 GLU 38 -12.478 -0.788 -4.378 339 HB3 GLU 38 HB3 GLU 38 -11.690 -0.723 -2.795 340 HG2 GLU 38 HG2 GLU 38 -10.417 1.261 -3.469 341 HG3 GLU 38 HG3 GLU 38 -11.018 1.128 -5.125 342 H GLN 39 H GLN 39 -9.551 -2.562 -2.262 343 HA GLN 39 HA GLN 39 -7.450 -0.725 -1.556 344 HB2 GLN 39 HB2 GLN 39 -8.012 -3.564 -0.624 345 HB3 GLN 39 HB3 GLN 39 -6.862 -2.435 0.100 346 HG2 GLN 39 HG2 GLN 39 -8.801 -2.318 1.457 347 HG3 GLN 39 HG3 GLN 39 -8.752 -0.830 0.521 348 HE21 GLN 39 HE21 GLN 39 -12.207 -1.488 0.030 349 HE22 GLN 39 HE22 GLN 39 -11.027 -0.520 0.913 350 H LYS 40 H LYS 40 -7.438 -3.780 -3.372 351 HA LYS 40 HA LYS 40 -4.545 -3.827 -3.756 352 HB2 LYS 40 HB2 LYS 40 -6.892 -5.140 -5.179 353 HB3 LYS 40 HB3 LYS 40 -5.232 -5.391 -5.728 354 HG2 LYS 40 HG2 LYS 40 -4.586 -6.592 -3.893 355 HG3 LYS 40 HG3 LYS 40 -5.717 -5.806 -2.804 356 HD2 LYS 40 HD2 LYS 40 -7.313 -7.224 -4.747 357 HD3 LYS 40 HD3 LYS 40 -6.023 -8.321 -4.207 358 HE2 LYS 40 HE2 LYS 40 -6.590 -7.739 -1.837 359 HE3 LYS 40 HE3 LYS 40 -7.906 -6.708 -2.431 360 HZ1 LYS 40 HZ1 LYS 40 -7.766 -9.624 -3.033 361 HZ2 LYS 40 HZ2 LYS 40 -8.561 -9.038 -1.734 362 HZ3 LYS 40 HZ3 LYS 40 -9.062 -8.621 -3.215 363 H LYS 41 H LYS 41 -7.225 -2.466 -5.591 364 HA LYS 41 HA LYS 41 -5.581 -1.367 -7.700 365 HB2 LYS 41 HB2 LYS 41 -8.251 -0.338 -6.659 366 HB3 LYS 41 HB3 LYS 41 -7.438 0.246 -8.105 367 HG2 LYS 41 HG2 LYS 41 -7.524 -2.030 -9.093 368 HG3 LYS 41 HG3 LYS 41 -8.421 -2.602 -7.673 369 HD2 LYS 41 HD2 LYS 41 -10.224 -0.962 -8.143 370 HD3 LYS 41 HD3 LYS 41 -9.318 -0.368 -9.551 371 HE2 LYS 41 HE2 LYS 41 -9.417 -2.655 -10.551 372 HE3 LYS 41 HE3 LYS 41 -10.373 -3.207 -9.169 373 HZ1 LYS 41 HZ1 LYS 41 -11.200 -1.080 -11.078 374 HZ2 LYS 41 HZ2 LYS 41 -11.794 -2.597 -11.045 375 HZ3 LYS 41 HZ3 LYS 41 -12.088 -1.584 -9.801 376 H ILE 42 H ILE 42 -5.449 -0.537 -4.465 377 HA ILE 42 HA ILE 42 -4.114 2.070 -5.056 378 HB ILE 42 HB ILE 42 -5.285 0.890 -2.533 379 HG12 ILE 42 HG12 ILE 42 -6.155 3.524 -3.742 380 HG13 ILE 42 HG13 ILE 42 -6.709 2.057 -4.525 381 HG21 ILE 42 HG21 ILE 42 -3.853 3.554 -2.848 382 HG22 ILE 42 HG22 ILE 42 -4.841 3.082 -1.443 383 HG23 ILE 42 HG23 ILE 42 -3.380 2.187 -1.819 384 HD11 ILE 42 HD11 ILE 42 -7.145 2.693 -1.596 385 HD12 ILE 42 HD12 ILE 42 -8.356 2.712 -2.907 386 HD13 ILE 42 HD13 ILE 42 -7.589 1.190 -2.421 387 H VAL 43 H VAL 43 -3.453 -1.205 -3.933 388 HA VAL 43 HA VAL 43 -0.639 -0.426 -3.241 389 HB VAL 43 HB VAL 43 -2.191 -2.871 -2.345 390 HG11 VAL 43 HG11 VAL 43 0.591 -1.826 -1.612 391 HG12 VAL 43 HG12 VAL 43 -0.238 -3.163 -0.795 392 HG13 VAL 43 HG13 VAL 43 0.234 -3.337 -2.477 393 HG21 VAL 43 HG21 VAL 43 -2.931 -0.672 -1.307 394 HG22 VAL 43 HG22 VAL 43 -2.293 -1.846 -0.171 395 HG23 VAL 43 HG23 VAL 43 -1.272 -0.497 -0.689 396 H ALA 44 H ALA 44 -2.357 -3.257 -4.733 397 HA ALA 44 HA ALA 44 0.049 -4.379 -5.823 398 HB1 ALA 44 HB1 ALA 44 -2.857 -4.730 -6.698 399 HB2 ALA 44 HB2 ALA 44 -1.498 -5.817 -7.064 400 HB3 ALA 44 HB3 ALA 44 -2.057 -5.640 -5.390 401 H ASP 45 H ASP 45 -2.328 -2.077 -7.081 402 HA ASP 45 HA ASP 45 -1.200 -1.769 -9.724 403 HB2 ASP 45 HB2 ASP 45 -3.491 -1.086 -9.004 404 HB3 ASP 45 HB3 ASP 45 -2.774 0.199 -8.028 405 H TYR 46 H TYR 46 -0.319 -0.343 -6.597 406 HA TYR 46 HA TYR 46 1.404 1.741 -7.693 407 HB2 TYR 46 HB2 TYR 46 0.098 1.609 -5.455 408 HB3 TYR 46 HB3 TYR 46 1.438 0.646 -4.856 409 HD1 TYR 46 HD1 TYR 46 3.216 2.798 -6.870 410 HD2 TYR 46 HD2 TYR 46 0.720 2.870 -3.374 411 HE1 TYR 46 HE1 TYR 46 4.162 4.950 -6.297 412 HE2 TYR 46 HE2 TYR 46 1.699 5.084 -2.721 413 HH TYR 46 HH TYR 46 4.170 6.718 -4.763 414 H ILE 47 H ILE 47 1.853 -1.502 -6.271 415 HA ILE 47 HA ILE 47 4.695 -1.747 -6.578 416 HB ILE 47 HB ILE 47 2.312 -3.568 -6.375 417 HG12 ILE 47 HG12 ILE 47 3.330 -4.389 -4.411 418 HG13 ILE 47 HG13 ILE 47 4.925 -3.812 -4.869 419 HG21 ILE 47 HG21 ILE 47 5.063 -4.570 -7.136 420 HG22 ILE 47 HG22 ILE 47 3.728 -5.572 -6.546 421 HG23 ILE 47 HG23 ILE 47 3.567 -4.739 -8.095 422 HD11 ILE 47 HD11 ILE 47 2.627 -2.008 -3.989 423 HD12 ILE 47 HD12 ILE 47 4.027 -2.505 -3.018 424 HD13 ILE 47 HD13 ILE 47 4.254 -1.491 -4.451 425 H SER 48 H SER 48 2.053 -2.220 -8.956 426 HA SER 48 HA SER 48 3.863 -2.744 -11.157 427 HB2 SER 48 HB2 SER 48 0.962 -1.859 -11.155 428 HB3 SER 48 HB3 SER 48 1.879 -2.370 -12.578 429 HG SER 48 HG SER 48 0.737 -4.106 -11.793 430 H GLU 49 H GLU 49 3.401 0.247 -9.508 431 HA GLU 49 HA GLU 49 3.838 1.844 -11.990 432 HB2 GLU 49 HB2 GLU 49 1.803 2.310 -10.777 433 HB3 GLU 49 HB3 GLU 49 2.696 2.536 -9.266 434 HG2 GLU 49 HG2 GLU 49 3.702 4.529 -10.012 435 HG3 GLU 49 HG3 GLU 49 3.235 4.241 -11.701 436 H VAL 50 H VAL 50 5.260 1.136 -8.793 437 HA VAL 50 HA VAL 50 7.628 2.803 -9.561 438 HB VAL 50 HB VAL 50 5.829 3.731 -7.886 439 HG11 VAL 50 HG11 VAL 50 7.460 2.112 -5.928 440 HG12 VAL 50 HG12 VAL 50 6.228 3.347 -5.601 441 HG13 VAL 50 HG13 VAL 50 5.764 1.830 -6.382 442 HG21 VAL 50 HG21 VAL 50 7.658 5.035 -8.463 443 HG22 VAL 50 HG22 VAL 50 7.650 4.982 -6.694 444 HG23 VAL 50 HG23 VAL 50 8.813 4.003 -7.629 445 H GLY 51 H GLY 51 6.624 -0.230 -8.226 446 HA2 GLY 51 HA2 GLY 51 8.530 -1.870 -8.795 447 HA3 GLY 51 HA3 GLY 51 9.461 -0.973 -7.588 448 H LEU 52 H LEU 52 8.725 -0.877 -5.485 449 HA LEU 52 HA LEU 52 6.650 -2.505 -4.345 450 HB2 LEU 52 HB2 LEU 52 8.240 -4.301 -4.999 451 HB3 LEU 52 HB3 LEU 52 9.540 -3.545 -4.102 452 HG LEU 52 HG LEU 52 7.042 -4.100 -2.587 453 HD11 LEU 52 HD11 LEU 52 8.900 -6.329 -3.550 454 HD12 LEU 52 HD12 LEU 52 7.654 -6.530 -2.310 455 HD13 LEU 52 HD13 LEU 52 7.176 -6.133 -3.965 456 HD21 LEU 52 HD21 LEU 52 9.002 -3.260 -1.370 457 HD22 LEU 52 HD22 LEU 52 8.583 -4.880 -0.830 458 HD23 LEU 52 HD23 LEU 52 9.961 -4.654 -1.928 459 H ASN 53 H ASN 53 9.818 -1.217 -3.856 460 HA ASN 53 HA ASN 53 9.257 -0.304 -1.126 461 HB2 ASN 53 HB2 ASN 53 11.591 -0.539 -0.770 462 HB3 ASN 53 HB3 ASN 53 11.084 -1.928 -1.729 463 HD21 ASN 53 HD21 ASN 53 13.263 -1.150 -4.401 464 HD22 ASN 53 HD22 ASN 53 12.078 -2.269 -3.759 465 H ASN 54 H ASN 54 9.248 1.307 -4.104 466 HA ASN 54 HA ASN 54 10.631 3.709 -3.071 467 HB2 ASN 54 HB2 ASN 54 9.477 3.084 -5.792 468 HB3 ASN 54 HB3 ASN 54 10.440 4.504 -5.394 469 HD21 ASN 54 HD21 ASN 54 12.280 1.097 -6.417 470 HD22 ASN 54 HD22 ASN 54 10.586 1.450 -6.744 471 H LEU 55 H LEU 55 7.400 2.540 -3.389 472 HA LEU 55 HA LEU 55 5.945 5.018 -3.258 473 HB2 LEU 55 HB2 LEU 55 4.116 3.580 -2.447 474 HB3 LEU 55 HB3 LEU 55 4.876 2.980 -3.900 475 HG LEU 55 HG LEU 55 6.256 1.477 -2.131 476 HD11 LEU 55 HD11 LEU 55 3.566 1.965 -0.778 477 HD12 LEU 55 HD12 LEU 55 4.737 0.693 -0.371 478 HD13 LEU 55 HD13 LEU 55 5.156 2.390 -0.109 479 HD21 LEU 55 HD21 LEU 55 4.907 0.633 -3.998 480 HD22 LEU 55 HD22 LEU 55 4.596 -0.275 -2.515 481 HD23 LEU 55 HD23 LEU 55 3.414 0.927 -3.078 482 H ASN 56 H ASN 56 4.653 5.714 -1.332 483 HA ASN 56 HA ASN 56 6.108 5.302 1.230 484 HB2 ASN 56 HB2 ASN 56 5.741 7.517 1.898 485 HB3 ASN 56 HB3 ASN 56 6.398 7.598 0.277 486 HD21 ASN 56 HD21 ASN 56 3.844 10.067 -0.023 487 HD22 ASN 56 HD22 ASN 56 5.548 9.822 0.340 488 H ALA 57 H ALA 57 4.663 5.790 3.111 489 HA ALA 57 HA ALA 57 2.342 3.995 2.966 490 HB1 ALA 57 HB1 ALA 57 3.785 5.457 5.212 491 HB2 ALA 57 HB2 ALA 57 2.490 4.267 5.447 492 HB3 ALA 57 HB3 ALA 57 4.025 3.766 4.711 493 H THR 58 H THR 58 2.930 7.434 3.031 494 HA THR 58 HA THR 58 0.534 8.403 4.188 495 HB THR 58 HB THR 58 2.265 9.726 2.068 496 HG1 THR 58 HG1 THR 58 3.411 10.527 3.848 497 HG21 THR 58 HG21 THR 58 0.474 10.870 4.252 498 HG22 THR 58 HG22 THR 58 1.615 11.821 3.267 499 HG23 THR 58 HG23 THR 58 0.254 11.007 2.491 500 H GLU 59 H GLU 59 1.342 7.846 0.717 501 HA GLU 59 HA GLU 59 -1.255 8.650 -0.259 502 HB2 GLU 59 HB2 GLU 59 0.844 6.778 -1.432 503 HB3 GLU 59 HB3 GLU 59 -0.579 7.339 -2.312 504 HG2 GLU 59 HG2 GLU 59 1.630 9.137 -1.219 505 HG3 GLU 59 HG3 GLU 59 1.483 8.597 -2.879 506 H LEU 60 H LEU 60 -0.041 5.495 0.835 507 HA LEU 60 HA LEU 60 -2.436 4.014 0.202 508 HB2 LEU 60 HB2 LEU 60 -0.363 3.498 2.365 509 HB3 LEU 60 HB3 LEU 60 -1.579 2.357 1.805 510 HG LEU 60 HG LEU 60 0.813 3.405 0.241 511 HD11 LEU 60 HD11 LEU 60 0.002 0.609 1.157 512 HD12 LEU 60 HD12 LEU 60 1.482 1.042 0.272 513 HD13 LEU 60 HD13 LEU 60 1.235 1.630 1.923 514 HD21 LEU 60 HD21 LEU 60 -0.934 3.201 -1.393 515 HD22 LEU 60 HD22 LEU 60 0.039 1.727 -1.508 516 HD23 LEU 60 HD23 LEU 60 -1.521 1.695 -0.661 517 H SER 61 H SER 61 -1.430 5.658 3.282 518 HA SER 61 HA SER 61 -3.776 4.912 4.713 519 HB2 SER 61 HB2 SER 61 -3.127 6.686 6.294 520 HB3 SER 61 HB3 SER 61 -1.779 5.615 5.861 521 HG SER 61 HG SER 61 -1.114 7.765 5.784 522 H LYS 62 H LYS 62 -3.151 7.585 2.552 523 HA LYS 62 HA LYS 62 -5.573 9.103 3.093 524 HB2 LYS 62 HB2 LYS 62 -3.577 9.059 0.800 525 HB3 LYS 62 HB3 LYS 62 -4.990 10.119 0.794 526 HG2 LYS 62 HG2 LYS 62 -4.261 11.350 2.687 527 HG3 LYS 62 HG3 LYS 62 -3.069 10.139 3.143 528 HD2 LYS 62 HD2 LYS 62 -1.928 12.043 2.194 529 HD3 LYS 62 HD3 LYS 62 -1.730 10.654 1.117 530 HE2 LYS 62 HE2 LYS 62 -3.583 11.546 -0.318 531 HE3 LYS 62 HE3 LYS 62 -3.692 12.963 0.739 532 HZ1 LYS 62 HZ1 LYS 62 -1.278 12.142 -0.798 533 HZ2 LYS 62 HZ2 LYS 62 -2.275 13.373 -1.212 534 HZ3 LYS 62 HZ3 LYS 62 -1.375 13.476 0.149 535 H ARG 63 H ARG 63 -4.799 6.672 0.585 536 HA ARG 63 HA ARG 63 -7.540 6.905 -0.538 537 HB2 ARG 63 HB2 ARG 63 -5.044 5.431 -1.451 538 HB3 ARG 63 HB3 ARG 63 -6.605 5.368 -2.288 539 HG2 ARG 63 HG2 ARG 63 -6.563 7.840 -2.552 540 HG3 ARG 63 HG3 ARG 63 -4.961 7.891 -1.792 541 HD2 ARG 63 HD2 ARG 63 -4.022 6.495 -3.566 542 HD3 ARG 63 HD3 ARG 63 -5.605 6.289 -4.311 543 HE ARG 63 HE ARG 63 -3.839 8.627 -4.469 544 HH11 ARG 63 HH11 ARG 63 -4.345 10.287 -5.847 545 HH12 ARG 63 HH12 ARG 63 -5.941 10.400 -6.531 546 HH21 ARG 63 HH21 ARG 63 -7.154 7.589 -4.993 547 HH22 ARG 63 HH22 ARG 63 -7.489 8.921 -6.064 548 H LEU 64 H LEU 64 -5.664 4.423 1.165 549 HA LEU 64 HA LEU 64 -7.819 2.431 0.912 550 HB2 LEU 64 HB2 LEU 64 -5.166 2.243 0.889 551 HB3 LEU 64 HB3 LEU 64 -5.367 2.081 2.625 552 HG LEU 64 HG LEU 64 -6.713 0.299 0.553 553 HD11 LEU 64 HD11 LEU 64 -4.104 -0.137 2.062 554 HD12 LEU 64 HD12 LEU 64 -4.893 -1.303 0.977 555 HD13 LEU 64 HD13 LEU 64 -4.268 0.218 0.331 556 HD21 LEU 64 HD21 LEU 64 -7.788 0.013 2.716 557 HD22 LEU 64 HD22 LEU 64 -6.719 -1.364 2.472 558 HD23 LEU 64 HD23 LEU 64 -6.216 -0.049 3.544 559 H ASN 65 H ASN 65 -6.953 4.949 3.092 560 HA ASN 65 HA ASN 65 -7.772 5.732 5.008 561 HB2 ASN 65 HB2 ASN 65 -9.880 5.712 3.782 562 HB3 ASN 65 HB3 ASN 65 -10.230 4.075 4.350 563 HD21 ASN 65 HD21 ASN 65 -10.428 7.135 7.109 564 HD22 ASN 65 HD22 ASN 65 -9.278 7.270 5.788 565 H ILE 66 H ILE 66 -5.983 4.605 5.800 566 HA ILE 66 HA ILE 66 -6.538 2.828 8.109 567 HB ILE 66 HB ILE 66 -4.374 1.615 7.562 568 HG12 ILE 66 HG12 ILE 66 -4.770 2.892 4.821 569 HG13 ILE 66 HG13 ILE 66 -3.419 3.144 5.937 570 HG21 ILE 66 HG21 ILE 66 -6.640 1.159 5.594 571 HG22 ILE 66 HG22 ILE 66 -5.450 -0.037 6.167 572 HG23 ILE 66 HG23 ILE 66 -6.632 0.635 7.291 573 HD11 ILE 66 HD11 ILE 66 -4.060 0.577 4.443 574 HD12 ILE 66 HD12 ILE 66 -2.800 1.753 4.064 575 HD13 ILE 66 HD13 ILE 66 -2.707 0.811 5.579 576 H THR 67 H THR 67 -4.725 2.969 9.728 577 HA THR 67 HA THR 67 -3.548 5.645 9.865 578 HB THR 67 HB THR 67 -4.171 4.481 11.915 579 HG1 THR 67 HG1 THR 67 -2.328 5.098 12.988 580 HG21 THR 67 HG21 THR 67 -1.753 2.686 11.449 581 HG22 THR 67 HG22 THR 67 -2.798 2.727 12.877 582 HG23 THR 67 HG23 THR 67 -3.446 2.145 11.340 583 H VAL 68 H VAL 68 -1.270 6.115 9.843 584 HA VAL 68 HA VAL 68 -0.008 5.179 7.469 585 HB VAL 68 HB VAL 68 1.438 6.539 9.773 586 HG11 VAL 68 HG11 VAL 68 1.834 6.639 6.744 587 HG12 VAL 68 HG12 VAL 68 2.785 7.535 7.949 588 HG13 VAL 68 HG13 VAL 68 2.873 5.773 7.895 589 HG21 VAL 68 HG21 VAL 68 -0.565 7.887 9.349 590 HG22 VAL 68 HG22 VAL 68 0.846 8.700 8.677 591 HG23 VAL 68 HG23 VAL 68 -0.262 7.829 7.599 592 H ASP 69 H ASP 69 0.447 4.192 10.847 593 HA ASP 69 HA ASP 69 2.668 2.473 10.324 594 HB2 ASP 69 HB2 ASP 69 2.052 3.439 12.548 595 HB3 ASP 69 HB3 ASP 69 0.652 2.365 12.601 596 H LYS 70 H LYS 70 -0.799 1.863 10.023 597 HA LYS 70 HA LYS 70 -0.502 -1.028 9.658 598 HB2 LYS 70 HB2 LYS 70 -2.708 0.994 9.249 599 HB3 LYS 70 HB3 LYS 70 -2.750 -0.439 8.230 600 HG2 LYS 70 HG2 LYS 70 -2.728 -1.909 10.187 601 HG3 LYS 70 HG3 LYS 70 -2.668 -0.501 11.268 602 HD2 LYS 70 HD2 LYS 70 -4.835 0.282 10.437 603 HD3 LYS 70 HD3 LYS 70 -4.919 -1.019 9.248 604 HE2 LYS 70 HE2 LYS 70 -4.667 -1.594 12.222 605 HE3 LYS 70 HE3 LYS 70 -6.237 -1.224 11.505 606 HZ1 LYS 70 HZ1 LYS 70 -4.534 -3.429 10.490 607 HZ2 LYS 70 HZ2 LYS 70 -5.703 -3.636 11.611 608 HZ3 LYS 70 HZ3 LYS 70 -6.115 -3.144 10.125 609 H ALA 71 H ALA 71 -0.326 1.805 7.550 610 HA ALA 71 HA ALA 71 -0.150 0.224 5.081 611 HB1 ALA 71 HB1 ALA 71 0.614 3.113 5.743 612 HB2 ALA 71 HB2 ALA 71 0.605 2.405 4.121 613 HB3 ALA 71 HB3 ALA 71 -0.905 2.578 5.040 614 H LYS 72 H LYS 72 2.250 1.862 7.155 615 HA LYS 72 HA LYS 72 4.649 1.120 5.834 616 HB2 LYS 72 HB2 LYS 72 3.971 1.634 8.751 617 HB3 LYS 72 HB3 LYS 72 5.620 1.274 8.223 618 HG2 LYS 72 HG2 LYS 72 5.730 3.249 6.872 619 HG3 LYS 72 HG3 LYS 72 4.008 3.568 7.097 620 HD2 LYS 72 HD2 LYS 72 5.454 5.058 8.436 621 HD3 LYS 72 HD3 LYS 72 4.276 4.152 9.394 622 HE2 LYS 72 HE2 LYS 72 5.966 2.592 10.151 623 HE3 LYS 72 HE3 LYS 72 7.176 3.286 9.055 624 HZ1 LYS 72 HZ1 LYS 72 5.927 4.716 11.345 625 HZ2 LYS 72 HZ2 LYS 72 7.446 4.122 11.317 626 HZ3 LYS 72 HZ3 LYS 72 7.042 5.358 10.333 627 H THR 73 H THR 73 2.832 -0.776 8.317 628 HA THR 73 HA THR 73 4.871 -2.897 8.104 629 HB THR 73 HB THR 73 3.716 -2.167 10.239 630 HG1 THR 73 HG1 THR 73 3.920 -4.277 11.007 631 HG21 THR 73 HG21 THR 73 1.605 -4.189 9.379 632 HG22 THR 73 HG22 THR 73 1.729 -3.335 10.931 633 HG23 THR 73 HG23 THR 73 1.342 -2.435 9.459 634 H TYR 74 H TYR 74 1.489 -2.485 6.982 635 HA TYR 74 HA TYR 74 1.130 -5.113 6.016 636 HB2 TYR 74 HB2 TYR 74 -0.736 -3.635 6.266 637 HB3 TYR 74 HB3 TYR 74 -0.022 -2.456 5.153 638 HD1 TYR 74 HD1 TYR 74 -1.229 -6.027 5.221 639 HD2 TYR 74 HD2 TYR 74 -0.545 -2.436 2.921 640 HE1 TYR 74 HE1 TYR 74 -2.155 -7.144 3.196 641 HE2 TYR 74 HE2 TYR 74 -1.507 -3.527 0.940 642 HH TYR 74 HH TYR 74 -2.535 -6.972 0.942 643 H ILE 75 H ILE 75 2.697 -2.324 4.383 644 HA ILE 75 HA ILE 75 3.108 -3.335 1.807 645 HB ILE 75 HB ILE 75 4.832 -1.669 3.659 646 HG12 ILE 75 HG12 ILE 75 3.532 -0.863 1.024 647 HG13 ILE 75 HG13 ILE 75 2.633 -0.832 2.525 648 HG21 ILE 75 HG21 ILE 75 5.493 -2.363 0.762 649 HG22 ILE 75 HG22 ILE 75 6.290 -1.095 1.715 650 HG23 ILE 75 HG23 ILE 75 6.468 -2.765 2.200 651 HD11 ILE 75 HD11 ILE 75 5.176 0.776 1.976 652 HD12 ILE 75 HD12 ILE 75 3.529 1.397 2.066 653 HD13 ILE 75 HD13 ILE 75 4.300 0.741 3.518 654 H LYS 76 H LYS 76 5.303 -3.944 4.606 655 HA LYS 76 HA LYS 76 6.694 -6.041 3.152 656 HB2 LYS 76 HB2 LYS 76 8.062 -6.305 5.107 657 HB3 LYS 76 HB3 LYS 76 7.916 -4.602 4.685 658 HG2 LYS 76 HG2 LYS 76 6.356 -4.225 6.529 659 HG3 LYS 76 HG3 LYS 76 6.311 -5.966 6.896 660 HD2 LYS 76 HD2 LYS 76 8.755 -5.895 7.398 661 HD3 LYS 76 HD3 LYS 76 8.740 -4.138 7.118 662 HE2 LYS 76 HE2 LYS 76 7.066 -3.865 8.933 663 HE3 LYS 76 HE3 LYS 76 7.037 -5.613 9.184 664 HZ1 LYS 76 HZ1 LYS 76 9.419 -3.880 9.589 665 HZ2 LYS 76 HZ2 LYS 76 8.507 -4.526 10.777 666 HZ3 LYS 76 HZ3 LYS 76 9.393 -5.499 9.813 667 H ASN 77 H ASN 77 4.039 -6.160 5.508 668 HA ASN 77 HA ASN 77 4.288 -9.018 5.898 669 HB2 ASN 77 HB2 ASN 77 1.814 -7.244 6.128 670 HB3 ASN 77 HB3 ASN 77 1.900 -8.922 6.642 671 HD21 ASN 77 HD21 ASN 77 4.147 -8.031 9.439 672 HD22 ASN 77 HD22 ASN 77 4.276 -9.117 8.065 673 H SER 78 H SER 78 2.613 -7.106 3.437 674 HA SER 78 HA SER 78 1.314 -9.374 2.180 675 HB2 SER 78 HB2 SER 78 0.552 -6.968 2.121 676 HB3 SER 78 HB3 SER 78 1.880 -6.637 0.994 677 HG SER 78 HG SER 78 -0.175 -7.158 -0.012 678 H ASN 79 H ASN 79 4.190 -7.428 1.390 679 HA ASN 79 HA ASN 79 5.372 -9.685 -0.110 680 HB2 ASN 79 HB2 ASN 79 5.779 -8.148 -2.096 681 HB3 ASN 79 HB3 ASN 79 4.150 -8.766 -1.860 682 HD21 ASN 79 HD21 ASN 79 4.716 -4.747 -1.192 683 HD22 ASN 79 HD22 ASN 79 6.013 -5.882 -0.803 684 H ARG 80 H ARG 80 6.802 -9.660 1.745 685 HA ARG 80 HA ARG 80 8.517 -7.427 2.272 686 HB2 ARG 80 HB2 ARG 80 8.072 -9.476 3.782 687 HB3 ARG 80 HB3 ARG 80 9.273 -10.335 2.823 688 HG2 ARG 80 HG2 ARG 80 10.912 -8.494 3.328 689 HG3 ARG 80 HG3 ARG 80 9.665 -7.708 4.304 690 HD2 ARG 80 HD2 ARG 80 10.851 -8.798 5.958 691 HD3 ARG 80 HD3 ARG 80 9.584 -9.968 5.628 692 HE ARG 80 HE ARG 80 11.160 -11.432 4.688 693 HH11 ARG 80 HH11 ARG 80 13.221 -12.232 4.413 694 HH12 ARG 80 HH12 ARG 80 14.592 -11.175 4.578 695 HH21 ARG 80 HH21 ARG 80 12.768 -8.376 5.319 696 HH22 ARG 80 HH22 ARG 80 14.351 -9.063 5.091 697 H MET 81 H MET 81 9.287 -10.397 0.585 698 HA MET 81 HA MET 81 11.196 -9.236 -1.309 699 HB2 MET 81 HB2 MET 81 12.156 -11.007 0.996 700 HB3 MET 81 HB3 MET 81 13.081 -10.726 -0.483 701 HG2 MET 81 HG2 MET 81 13.085 -8.293 -0.016 702 HG3 MET 81 HG3 MET 81 12.361 -8.631 1.563 703 HE1 MET 81 HE1 MET 81 14.425 -7.145 2.489 704 HE2 MET 81 HE2 MET 81 16.129 -7.597 2.248 705 HE3 MET 81 HE3 MET 81 15.152 -7.054 0.867 706 H GLY 82 H GLY 82 8.766 -10.589 -1.810 707 HA2 GLY 82 HA2 GLY 82 9.320 -13.482 -2.185 708 HA3 GLY 82 HA3 GLY 82 7.787 -12.642 -2.376 709 H ARG 83 H ARG 83 7.154 -12.801 -4.354 710 HA ARG 83 HA ARG 83 8.981 -12.635 -6.713 711 HB2 ARG 83 HB2 ARG 83 6.159 -13.618 -6.263 712 HB3 ARG 83 HB3 ARG 83 6.858 -13.426 -7.893 713 HG2 ARG 83 HG2 ARG 83 8.767 -14.917 -7.181 714 HG3 ARG 83 HG3 ARG 83 7.892 -15.247 -5.677 715 HD2 ARG 83 HD2 ARG 83 5.997 -16.159 -6.965 716 HD3 ARG 83 HD3 ARG 83 6.823 -15.801 -8.482 717 HE ARG 83 HE ARG 83 7.350 -18.013 -6.627 718 HH11 ARG 83 HH11 ARG 83 8.838 -19.574 -7.136 719 HH12 ARG 83 HH12 ARG 83 9.944 -19.327 -8.455 720 HH21 ARG 83 HH21 ARG 83 8.780 -16.214 -9.283 721 HH22 ARG 83 HH22 ARG 83 9.922 -17.481 -9.635 722 H THR 84 H THR 84 8.656 -10.309 -5.261 723 HA THR 84 HA THR 84 7.950 -8.153 -5.204 724 HB THR 84 HB THR 84 8.013 -8.115 -8.215 725 HG1 THR 84 HG1 THR 84 10.255 -8.200 -8.098 726 HG21 THR 84 HG21 THR 84 9.321 -6.375 -6.062 727 HG22 THR 84 HG22 THR 84 9.349 -6.076 -7.815 728 HG23 THR 84 HG23 THR 84 7.827 -5.958 -6.926 729 H ASN 85 H ASN 85 5.732 -9.915 -5.082 730 HA ASN 85 HA ASN 85 3.573 -10.304 -5.574 731 HB2 ASN 85 HB2 ASN 85 3.746 -8.188 -4.048 732 HB3 ASN 85 HB3 ASN 85 3.034 -7.349 -5.412 733 HD21 ASN 85 HD21 ASN 85 -0.114 -9.120 -5.100 734 HD22 ASN 85 HD22 ASN 85 0.999 -8.480 -6.319 735 H ASN 86 H ASN 86 5.061 -10.213 -7.987 736 HA ASN 86 HA ASN 86 3.077 -9.196 -9.931 737 HB2 ASN 86 HB2 ASN 86 4.721 -8.703 -11.318 738 HB3 ASN 86 HB3 ASN 86 5.757 -8.803 -9.902 739 HD21 ASN 86 HD21 ASN 86 7.151 -11.989 -10.965 740 HD22 ASN 86 HD22 ASN 86 6.644 -11.143 -9.501 741 H PHE 87 H PHE 87 3.669 -12.067 -8.392 742 HA PHE 87 HA PHE 87 3.025 -13.975 -10.459 743 HB2 PHE 87 HB2 PHE 87 3.082 -15.573 -8.729 744 HB3 PHE 87 HB3 PHE 87 4.335 -14.404 -8.353 745 HD1 PHE 87 HD1 PHE 87 3.900 -12.652 -6.519 746 HD2 PHE 87 HD2 PHE 87 1.304 -16.028 -7.205 747 HE1 PHE 87 HE1 PHE 87 2.832 -12.281 -4.307 748 HE2 PHE 87 HE2 PHE 87 0.249 -15.659 -4.985 749 HZ PHE 87 HZ PHE 87 1.007 -13.782 -3.539 750 H LYS 88 H LYS 88 1.146 -11.666 -10.017 751 HA LYS 88 HA LYS 88 -1.448 -12.810 -9.187 752 HB2 LYS 88 HB2 LYS 88 -2.223 -10.480 -9.422 753 HB3 LYS 88 HB3 LYS 88 -0.815 -10.613 -8.369 754 HG2 LYS 88 HG2 LYS 88 0.602 -9.950 -10.435 755 HG3 LYS 88 HG3 LYS 88 -0.922 -9.529 -11.218 756 HD2 LYS 88 HD2 LYS 88 -1.361 -7.809 -9.555 757 HD3 LYS 88 HD3 LYS 88 -0.039 -8.397 -8.531 758 HE2 LYS 88 HE2 LYS 88 1.544 -7.908 -10.497 759 HE3 LYS 88 HE3 LYS 88 0.193 -7.063 -11.262 760 HZ1 LYS 88 HZ1 LYS 88 1.481 -6.376 -8.672 761 HZ2 LYS 88 HZ2 LYS 88 1.517 -5.480 -10.051 762 HZ3 LYS 88 HZ3 LYS 88 0.133 -5.618 -9.233 763 H THR 89 H THR 89 0.371 -12.583 -11.965 764 HA THR 89 HA THR 89 -1.937 -13.061 -13.794 765 HB THR 89 HB THR 89 0.478 -11.271 -14.298 766 HG1 THR 89 HG1 THR 89 -1.092 -9.640 -14.355 767 HG21 THR 89 HG21 THR 89 -1.940 -11.991 -15.986 768 HG22 THR 89 HG22 THR 89 -0.792 -10.670 -16.358 769 HG23 THR 89 HG23 THR 89 -0.232 -12.351 -16.338 770 H ILE 90 H ILE 90 1.627 -13.341 -13.318 771 HA ILE 90 HA ILE 90 1.912 -15.571 -15.194 772 HB ILE 90 HB ILE 90 3.783 -14.781 -12.944 773 HG12 ILE 90 HG12 ILE 90 3.642 -13.717 -15.804 774 HG13 ILE 90 HG13 ILE 90 3.362 -12.792 -14.328 775 HG21 ILE 90 HG21 ILE 90 4.278 -16.275 -15.564 776 HG22 ILE 90 HG22 ILE 90 5.524 -15.834 -14.380 777 HG23 ILE 90 HG23 ILE 90 4.305 -16.982 -13.928 778 HD11 ILE 90 HD11 ILE 90 6.022 -13.857 -15.305 779 HD12 ILE 90 HD12 ILE 90 5.510 -12.181 -15.084 780 HD13 ILE 90 HD13 ILE 90 5.758 -13.217 -13.662 781 H LYS 91 H LYS 91 2.310 -17.726 -14.578 782 HA LYS 91 HA LYS 91 1.994 -19.705 -13.559 783 HB2 LYS 91 HB2 LYS 91 3.531 -18.254 -12.036 784 HB3 LYS 91 HB3 LYS 91 2.215 -18.317 -10.882 785 HG2 LYS 91 HG2 LYS 91 2.403 -20.641 -10.590 786 HG3 LYS 91 HG3 LYS 91 3.275 -20.880 -12.116 787 HD2 LYS 91 HD2 LYS 91 4.388 -19.380 -9.710 788 HD3 LYS 91 HD3 LYS 91 4.708 -21.082 -10.026 789 HE2 LYS 91 HE2 LYS 91 5.375 -18.887 -12.050 790 HE3 LYS 91 HE3 LYS 91 6.487 -19.361 -10.766 791 HZ1 LYS 91 HZ1 LYS 91 5.443 -21.241 -12.840 792 HZ2 LYS 91 HZ2 LYS 91 6.926 -20.559 -12.836 793 HZ3 LYS 91 HZ3 LYS 91 6.514 -21.603 -11.655 794 H MET 92 H MET 92 -0.504 -17.503 -13.125 795 HA MET 92 HA MET 92 -2.262 -19.331 -11.646 796 HB2 MET 92 HB2 MET 92 -3.955 -17.710 -11.881 797 HB3 MET 92 HB3 MET 92 -2.460 -16.833 -11.551 798 HG2 MET 92 HG2 MET 92 -2.254 -16.356 -13.998 799 HG3 MET 92 HG3 MET 92 -3.783 -17.188 -14.276 800 HE1 MET 92 HE1 MET 92 -4.812 -15.215 -15.591 801 HE2 MET 92 HE2 MET 92 -4.771 -13.528 -15.030 802 HE3 MET 92 HE3 MET 92 -3.256 -14.370 -15.425 803 H PHE 93 H PHE 93 -1.493 -18.785 -15.019 804 HA PHE 93 HA PHE 93 -3.688 -20.606 -15.888 805 HB2 PHE 93 HB2 PHE 93 -3.779 -19.424 -17.920 806 HB3 PHE 93 HB3 PHE 93 -3.757 -18.219 -16.648 807 HD1 PHE 93 HD1 PHE 93 -1.903 -19.675 -19.489 808 HD2 PHE 93 HD2 PHE 93 -1.814 -16.713 -16.355 809 HE1 PHE 93 HE1 PHE 93 -0.012 -18.534 -20.618 810 HE2 PHE 93 HE2 PHE 93 0.087 -15.584 -17.479 811 HZ PHE 93 HZ PHE 93 0.992 -16.490 -19.613 812 H GLU 94 H GLU 94 -0.338 -20.591 -15.491 813 HA GLU 94 HA GLU 94 0.251 -22.437 -17.743 814 HB2 GLU 94 HB2 GLU 94 2.017 -21.027 -15.712 815 HB3 GLU 94 HB3 GLU 94 2.623 -22.160 -16.915 816 HG2 GLU 94 HG2 GLU 94 1.102 -19.637 -17.690 817 HG3 GLU 94 HG3 GLU 94 2.832 -19.661 -17.408 818 H ASP 95 H ASP 95 1.136 -24.496 -17.448 819 HA ASP 95 HA ASP 95 0.515 -25.848 -14.880 820 HB2 ASP 95 HB2 ASP 95 1.375 -26.897 -17.598 821 HB3 ASP 95 HB3 ASP 95 1.166 -27.899 -16.163 822 H ASP 96 H ASP 96 1.999 -25.809 -13.339 823 HA ASP 96 HA ASP 96 4.853 -26.397 -13.940 824 HB2 ASP 96 HB2 ASP 96 3.794 -24.102 -12.241 825 HB3 ASP 96 HB3 ASP 96 5.411 -24.763 -12.044 826 H VAL 97 H VAL 97 5.880 -27.611 -12.425 827 HA VAL 97 HA VAL 97 4.553 -28.215 -9.825 828 HB VAL 97 HB VAL 97 5.729 -30.395 -11.596 829 HG11 VAL 97 HG11 VAL 97 4.272 -30.525 -8.916 830 HG12 VAL 97 HG12 VAL 97 4.771 -31.925 -9.890 831 HG13 VAL 97 HG13 VAL 97 5.996 -30.869 -9.188 832 HG21 VAL 97 HG21 VAL 97 3.561 -29.737 -12.528 833 HG22 VAL 97 HG22 VAL 97 3.415 -31.295 -11.718 834 HG23 VAL 97 HG23 VAL 97 2.812 -29.827 -10.916 835 H SER 98 H SER 98 7.536 -28.762 -11.736 836 HA SER 98 HA SER 98 9.165 -28.306 -9.272 837 HB2 SER 98 HB2 SER 98 9.824 -30.036 -11.673 838 HB3 SER 98 HB3 SER 98 10.795 -29.845 -10.200 839 HG SER 98 HG SER 98 9.496 -31.732 -10.125 840 H SER 99 H SER 99 8.273 -26.235 -11.210 841 HA SER 99 HA SER 99 9.023 -24.462 -12.401 842 HB2 SER 99 HB2 SER 99 10.046 -24.209 -10.071 843 HB3 SER 99 HB3 SER 99 11.597 -24.608 -10.827 844 HG SER 99 HG SER 99 11.216 -22.348 -10.803 845 H ALA 100 H ALA 100 9.160 -26.486 -14.020 846 HA ALA 100 HA ALA 100 11.732 -26.978 -15.252 847 HB1 ALA 100 HB1 ALA 100 8.895 -27.498 -16.239 848 HB2 ALA 100 HB2 ALA 100 10.381 -28.200 -16.909 849 HB3 ALA 100 HB3 ALA 100 9.881 -28.611 -15.260 850 H SER 101 H SER 101 12.116 -26.594 -17.614 851 HA SER 101 HA SER 101 10.977 -24.105 -18.756 852 HB2 SER 101 HB2 SER 101 13.046 -23.537 -17.423 853 HB3 SER 101 HB3 SER 101 13.975 -24.573 -18.523 854 HG SER 101 HG SER 101 13.930 -22.299 -19.098 855 H ALA 102 H ALA 102 12.396 -23.917 -21.019 856 HA ALA 102 HA ALA 102 11.579 -26.222 -22.618 857 HB1 ALA 102 HB1 ALA 102 12.982 -23.639 -23.372 858 HB2 ALA 102 HB2 ALA 102 12.267 -24.821 -24.495 859 HB3 ALA 102 HB3 ALA 102 11.222 -23.923 -23.373 860 H GLN 103 H GLN 103 13.135 -27.410 -21.083 861 HA GLN 103 HA GLN 103 15.962 -27.388 -21.595 862 HB2 GLN 103 HB2 GLN 103 14.135 -29.296 -20.108 863 HB3 GLN 103 HB3 GLN 103 15.871 -29.564 -20.225 864 HG2 GLN 103 HG2 GLN 103 14.635 -27.030 -19.057 865 HG3 GLN 103 HG3 GLN 103 15.129 -28.428 -18.111 866 HE21 GLN 103 HE21 GLN 103 18.001 -25.827 -19.373 867 HE22 GLN 103 HE22 GLN 103 16.322 -25.567 -19.816 868 HA PRO 104 HA PRO 104 16.089 -30.252 -25.050 869 HB2 PRO 104 HB2 PRO 104 18.700 -30.980 -25.092 870 HB3 PRO 104 HB3 PRO 104 18.170 -29.304 -25.406 871 HG2 PRO 104 HG2 PRO 104 19.193 -30.454 -22.787 872 HG3 PRO 104 HG3 PRO 104 19.719 -28.957 -23.619 873 HD2 PRO 104 HD2 PRO 104 17.861 -28.954 -21.603 874 HD3 PRO 104 HD3 PRO 104 17.789 -27.801 -22.969 875 H ASN 105 H ASN 105 14.571 -31.641 -23.914 876 HA ASN 105 HA ASN 105 15.687 -34.294 -23.144 877 HB2 ASN 105 HB2 ASN 105 15.317 -32.986 -21.080 878 HB3 ASN 105 HB3 ASN 105 13.651 -32.668 -21.554 879 HD21 ASN 105 HD21 ASN 105 12.494 -35.884 -20.541 880 HD22 ASN 105 HD22 ASN 105 12.122 -34.461 -21.512 881 H LEU 106 H LEU 106 15.062 -35.184 -25.051 882 HA LEU 106 HA LEU 106 12.135 -35.533 -25.512 883 HB2 LEU 106 HB2 LEU 106 13.218 -33.861 -27.069 884 HB3 LEU 106 HB3 LEU 106 14.240 -35.159 -27.670 885 HG LEU 106 HG LEU 106 12.099 -36.388 -28.365 886 HD11 LEU 106 HD11 LEU 106 10.836 -33.688 -27.712 887 HD12 LEU 106 HD12 LEU 106 10.058 -35.003 -28.619 888 HD13 LEU 106 HD13 LEU 106 10.466 -35.235 -26.918 889 HD21 LEU 106 HD21 LEU 106 13.467 -35.112 -29.965 890 HD22 LEU 106 HD22 LEU 106 11.744 -34.978 -30.349 891 HD23 LEU 106 HD23 LEU 106 12.582 -33.625 -29.555 892 HA PRO 107 HA PRO 107 14.333 -39.653 -25.120 893 HB2 PRO 107 HB2 PRO 107 12.764 -40.782 -23.190 894 HB3 PRO 107 HB3 PRO 107 14.130 -39.684 -22.824 895 HG2 PRO 107 HG2 PRO 107 11.180 -38.983 -23.021 896 HG3 PRO 107 HG3 PRO 107 12.336 -38.556 -21.717 897 HD2 PRO 107 HD2 PRO 107 11.744 -36.820 -23.724 898 HD3 PRO 107 HD3 PRO 107 13.400 -36.940 -23.057 Start of MODEL 19 1 H1 GLY -5 H1 GLY -5 4.918 -28.814 44.054 2 H2 GLY -5 H2 GLY -5 6.108 -27.739 44.386 3 H3 GLY -5 H3 GLY -5 4.973 -28.080 45.517 4 HA2 GLY -5 HA2 GLY -5 6.965 -29.993 44.481 5 HA3 GLY -5 HA3 GLY -5 7.063 -29.167 46.046 6 H SER -4 H SER -4 6.811 -32.086 45.257 7 HA SER -4 HA SER -4 4.897 -32.791 47.378 8 HB2 SER -4 HB2 SER -4 3.598 -32.891 45.217 9 HB3 SER -4 HB3 SER -4 4.715 -34.157 44.668 10 HG SER -4 HG SER -4 2.818 -35.004 45.685 11 H HIS -3 H HIS -3 5.385 -34.742 48.393 12 HA HIS -3 HA HIS -3 7.821 -36.232 47.617 13 HB2 HIS -3 HB2 HIS -3 8.207 -33.975 49.018 14 HB3 HIS -3 HB3 HIS -3 7.805 -35.000 50.376 15 HD2 HIS -3 HD2 HIS -3 9.483 -37.662 49.484 16 HE1 HIS -3 HE1 HIS -3 12.855 -35.058 49.365 17 HE2 HIS -3 HE2 HIS -3 12.104 -37.489 49.480 18 H MET -2 H MET -2 5.134 -37.113 47.762 19 HA MET -2 HA MET -2 4.872 -38.604 50.333 20 HB2 MET -2 HB2 MET -2 2.833 -37.926 48.189 21 HB3 MET -2 HB3 MET -2 2.508 -38.903 49.629 22 HG2 MET -2 HG2 MET -2 3.454 -36.013 49.636 23 HG3 MET -2 HG3 MET -2 1.804 -36.557 49.915 24 HE1 MET -2 HE1 MET -2 1.963 -34.916 52.087 25 HE2 MET -2 HE2 MET -2 3.143 -35.153 53.396 26 HE3 MET -2 HE3 MET -2 3.693 -34.616 51.795 27 H ALA -1 H ALA -1 6.574 -40.003 49.727 28 HA ALA -1 HA ALA -1 7.533 -41.894 48.970 29 HB1 ALA -1 HB1 ALA -1 4.691 -42.925 48.996 30 HB2 ALA -1 HB2 ALA -1 6.185 -43.890 49.029 31 HB3 ALA -1 HB3 ALA -1 5.798 -42.814 50.391 32 H SER 0 H SER 0 8.179 -40.805 47.125 33 HA SER 0 HA SER 0 7.011 -40.487 44.631 34 HB2 SER 0 HB2 SER 0 9.329 -40.346 43.747 35 HB3 SER 0 HB3 SER 0 9.057 -39.394 45.215 36 HG SER 0 HG SER 0 11.014 -40.600 45.318 37 H MET 1 H MET 1 8.618 -43.393 45.779 38 HA MET 1 HA MET 1 8.753 -44.793 43.278 39 HB2 MET 1 HB2 MET 1 8.771 -45.814 46.148 40 HB3 MET 1 HB3 MET 1 9.135 -46.810 44.732 41 HG2 MET 1 HG2 MET 1 11.055 -45.407 44.169 42 HG3 MET 1 HG3 MET 1 10.679 -44.303 45.489 43 HE1 MET 1 HE1 MET 1 12.035 -47.832 44.475 44 HE2 MET 1 HE2 MET 1 12.372 -48.593 46.044 45 HE3 MET 1 HE3 MET 1 10.694 -48.346 45.527 46 H ASP 2 H ASP 2 6.087 -44.103 45.138 47 HA ASP 2 HA ASP 2 4.351 -46.100 43.742 48 HB2 ASP 2 HB2 ASP 2 4.717 -46.443 46.229 49 HB3 ASP 2 HB3 ASP 2 3.963 -44.877 46.501 50 H GLN 3 H GLN 3 5.266 -43.099 43.408 51 HA GLN 3 HA GLN 3 2.620 -41.797 42.971 52 HB2 GLN 3 HB2 GLN 3 3.319 -41.448 45.258 53 HB3 GLN 3 HB3 GLN 3 4.909 -40.948 44.762 54 HG2 GLN 3 HG2 GLN 3 2.845 -39.146 43.675 55 HG3 GLN 3 HG3 GLN 3 2.726 -39.331 45.416 56 HE21 GLN 3 HE21 GLN 3 6.299 -37.803 43.991 57 HE22 GLN 3 HE22 GLN 3 5.351 -38.889 42.964 58 H LEU 4 H LEU 4 4.875 -42.832 41.175 59 HA LEU 4 HA LEU 4 5.277 -40.329 39.578 60 HB2 LEU 4 HB2 LEU 4 7.210 -42.389 40.446 61 HB3 LEU 4 HB3 LEU 4 7.188 -42.170 38.710 62 HG LEU 4 HG LEU 4 7.673 -39.805 38.893 63 HD11 LEU 4 HD11 LEU 4 7.635 -40.232 41.905 64 HD12 LEU 4 HD12 LEU 4 8.342 -38.812 41.100 65 HD13 LEU 4 HD13 LEU 4 6.614 -39.127 40.961 66 HD21 LEU 4 HD21 LEU 4 9.526 -41.444 38.869 67 HD22 LEU 4 HD22 LEU 4 9.955 -39.991 39.785 68 HD23 LEU 4 HD23 LEU 4 9.514 -41.483 40.647 69 H ASP 5 H ASP 5 4.095 -40.273 37.862 70 HA ASP 5 HA ASP 5 3.780 -42.642 36.104 71 HB2 ASP 5 HB2 ASP 5 1.858 -42.517 37.760 72 HB3 ASP 5 HB3 ASP 5 1.423 -40.964 37.052 73 H GLU 6 H GLU 6 4.760 -39.513 36.272 74 HA GLU 6 HA GLU 6 3.787 -38.705 33.572 75 HB2 GLU 6 HB2 GLU 6 2.823 -37.434 35.456 76 HB3 GLU 6 HB3 GLU 6 4.444 -37.014 36.020 77 HG2 GLU 6 HG2 GLU 6 4.875 -35.839 33.885 78 HG3 GLU 6 HG3 GLU 6 3.279 -36.309 33.298 79 H ILE 7 H ILE 7 5.485 -39.662 32.481 80 HA ILE 7 HA ILE 7 8.250 -38.610 32.947 81 HB ILE 7 HB ILE 7 7.477 -41.361 31.933 82 HG12 ILE 7 HG12 ILE 7 6.891 -41.277 34.294 83 HG13 ILE 7 HG13 ILE 7 8.232 -42.354 33.976 84 HG21 ILE 7 HG21 ILE 7 10.188 -40.152 32.603 85 HG22 ILE 7 HG22 ILE 7 9.903 -41.874 32.277 86 HG23 ILE 7 HG23 ILE 7 9.607 -40.684 31.012 87 HD11 ILE 7 HD11 ILE 7 8.541 -39.542 35.097 88 HD12 ILE 7 HD12 ILE 7 8.528 -41.037 36.049 89 HD13 ILE 7 HD13 ILE 7 9.830 -40.745 34.879 90 H ILE 8 H ILE 8 9.320 -37.828 31.184 91 HA ILE 8 HA ILE 8 7.782 -37.583 28.649 92 HB ILE 8 HB ILE 8 10.249 -36.059 29.531 93 HG12 ILE 8 HG12 ILE 8 8.509 -35.444 31.069 94 HG13 ILE 8 HG13 ILE 8 8.747 -34.139 29.927 95 HG21 ILE 8 HG21 ILE 8 8.319 -35.643 27.204 96 HG22 ILE 8 HG22 ILE 8 9.556 -34.477 27.716 97 HG23 ILE 8 HG23 ILE 8 10.044 -36.059 27.116 98 HD11 ILE 8 HD11 ILE 8 6.435 -36.135 29.911 99 HD12 ILE 8 HD12 ILE 8 6.378 -34.429 30.377 100 HD13 ILE 8 HD13 ILE 8 6.689 -34.869 28.687 101 H GLU 9 H GLU 9 8.290 -38.674 26.901 102 HA GLU 9 HA GLU 9 11.061 -39.669 26.443 103 HB2 GLU 9 HB2 GLU 9 9.383 -41.355 27.532 104 HB3 GLU 9 HB3 GLU 9 8.653 -41.438 25.931 105 HG2 GLU 9 HG2 GLU 9 10.850 -42.209 25.008 106 HG3 GLU 9 HG3 GLU 9 11.585 -42.002 26.595 107 H GLN 10 H GLN 10 9.135 -37.516 25.285 108 HA GLN 10 HA GLN 10 8.640 -38.454 22.559 109 HB2 GLN 10 HB2 GLN 10 7.369 -36.611 24.252 110 HB3 GLN 10 HB3 GLN 10 8.188 -35.611 23.050 111 HG2 GLN 10 HG2 GLN 10 5.995 -36.088 22.219 112 HG3 GLN 10 HG3 GLN 10 7.140 -36.987 21.229 113 HE21 GLN 10 HE21 GLN 10 4.436 -39.390 21.819 114 HE22 GLN 10 HE22 GLN 10 4.794 -37.992 20.813 115 H ILE 11 H ILE 11 9.049 -37.017 20.727 116 HA ILE 11 HA ILE 11 11.846 -36.204 20.585 117 HB ILE 11 HB ILE 11 10.708 -37.903 19.105 118 HG12 ILE 11 HG12 ILE 11 12.095 -35.649 17.650 119 HG13 ILE 11 HG13 ILE 11 12.887 -36.806 18.727 120 HG21 ILE 11 HG21 ILE 11 9.548 -35.487 17.650 121 HG22 ILE 11 HG22 ILE 11 9.384 -37.195 17.209 122 HG23 ILE 11 HG23 ILE 11 8.604 -36.593 18.670 123 HD11 ILE 11 HD11 ILE 11 11.417 -37.482 16.140 124 HD12 ILE 11 HD12 ILE 11 13.168 -37.513 16.409 125 HD13 ILE 11 HD13 ILE 11 12.126 -38.673 17.257 126 H GLN 12 H GLN 12 9.582 -34.478 21.753 127 HA GLN 12 HA GLN 12 10.117 -31.953 20.279 128 HB2 GLN 12 HB2 GLN 12 7.731 -31.449 20.161 129 HB3 GLN 12 HB3 GLN 12 8.110 -32.938 19.287 130 HG2 GLN 12 HG2 GLN 12 7.303 -34.272 21.237 131 HG3 GLN 12 HG3 GLN 12 6.888 -32.784 22.084 132 HE21 GLN 12 HE21 GLN 12 3.694 -33.850 20.774 133 HE22 GLN 12 HE22 GLN 12 4.796 -34.126 22.119 134 H LYS 13 H LYS 13 9.515 -30.028 21.435 135 HA LYS 13 HA LYS 13 10.030 -30.273 24.335 136 HB2 LYS 13 HB2 LYS 13 10.041 -27.796 22.575 137 HB3 LYS 13 HB3 LYS 13 10.574 -27.911 24.256 138 HG2 LYS 13 HG2 LYS 13 12.302 -29.632 23.503 139 HG3 LYS 13 HG3 LYS 13 11.835 -29.270 21.841 140 HD2 LYS 13 HD2 LYS 13 13.777 -27.965 22.265 141 HD3 LYS 13 HD3 LYS 13 12.411 -26.857 22.234 142 HE2 LYS 13 HE2 LYS 13 13.818 -26.183 24.038 143 HE3 LYS 13 HE3 LYS 13 12.375 -26.894 24.759 144 HZ1 LYS 13 HZ1 LYS 13 14.987 -28.283 24.427 145 HZ2 LYS 13 HZ2 LYS 13 14.415 -27.686 25.830 146 HZ3 LYS 13 HZ3 LYS 13 13.664 -28.946 25.121 147 H GLU 14 H GLU 14 7.486 -31.135 23.690 148 HA GLU 14 HA GLU 14 5.850 -29.376 25.348 149 HB2 GLU 14 HB2 GLU 14 3.943 -29.305 23.852 150 HB3 GLU 14 HB3 GLU 14 5.329 -28.481 23.145 151 HG2 GLU 14 HG2 GLU 14 5.777 -30.478 21.715 152 HG3 GLU 14 HG3 GLU 14 4.365 -31.277 22.418 153 H ALA 15 H ALA 15 4.245 -30.297 26.353 154 HA ALA 15 HA ALA 15 4.014 -33.271 26.503 155 HB1 ALA 15 HB1 ALA 15 5.072 -31.411 28.673 156 HB2 ALA 15 HB2 ALA 15 4.719 -33.145 28.866 157 HB3 ALA 15 HB3 ALA 15 6.005 -32.617 27.774 158 H ILE 16 H ILE 16 3.194 -31.164 29.066 159 HA ILE 16 HA ILE 16 0.318 -31.052 28.368 160 HB ILE 16 HB ILE 16 1.310 -32.088 31.012 161 HG12 ILE 16 HG12 ILE 16 -0.208 -34.170 30.169 162 HG13 ILE 16 HG13 ILE 16 0.370 -33.630 28.608 163 HG21 ILE 16 HG21 ILE 16 -1.537 -31.940 29.864 164 HG22 ILE 16 HG22 ILE 16 -1.103 -32.570 31.468 165 HG23 ILE 16 HG23 ILE 16 -0.918 -30.863 31.122 166 HD11 ILE 16 HD11 ILE 16 2.072 -34.412 31.031 167 HD12 ILE 16 HD12 ILE 16 1.766 -35.416 29.602 168 HD13 ILE 16 HD13 ILE 16 2.724 -33.940 29.452 169 H ASN 17 H ASN 17 1.846 -29.052 27.923 170 HA ASN 17 HA ASN 17 1.161 -27.043 30.032 171 HB2 ASN 17 HB2 ASN 17 3.725 -27.200 28.387 172 HB3 ASN 17 HB3 ASN 17 3.241 -25.793 29.323 173 HD21 ASN 17 HD21 ASN 17 5.138 -28.718 31.258 174 HD22 ASN 17 HD22 ASN 17 5.041 -28.650 29.505 175 H SER 18 H SER 18 0.165 -28.120 27.229 176 HA SER 18 HA SER 18 -0.539 -25.411 26.125 177 HB2 SER 18 HB2 SER 18 1.354 -26.307 24.841 178 HB3 SER 18 HB3 SER 18 0.426 -27.772 24.474 179 HG SER 18 HG SER 18 0.314 -26.181 22.799 180 H ASN 19 H ASN 19 -1.298 -28.911 25.663 181 HA ASN 19 HA ASN 19 -3.956 -28.548 24.780 182 HB2 ASN 19 HB2 ASN 19 -4.197 -30.947 25.275 183 HB3 ASN 19 HB3 ASN 19 -2.679 -30.616 24.455 184 HD21 ASN 19 HD21 ASN 19 -1.849 -33.006 27.115 185 HD22 ASN 19 HD22 ASN 19 -2.814 -33.016 25.644 186 H VAL 20 H VAL 20 -2.723 -28.393 27.959 187 HA VAL 20 HA VAL 20 -5.299 -28.605 29.333 188 HB VAL 20 HB VAL 20 -3.276 -29.566 30.254 189 HG11 VAL 20 HG11 VAL 20 -2.262 -26.738 30.711 190 HG12 VAL 20 HG12 VAL 20 -1.520 -28.234 31.290 191 HG13 VAL 20 HG13 VAL 20 -1.584 -27.909 29.556 192 HG21 VAL 20 HG21 VAL 20 -5.127 -28.901 31.772 193 HG22 VAL 20 HG22 VAL 20 -3.533 -28.937 32.545 194 HG23 VAL 20 HG23 VAL 20 -4.264 -27.382 32.112 195 H VAL 21 H VAL 21 -3.698 -26.034 27.765 196 HA VAL 21 HA VAL 21 -5.666 -24.117 28.891 197 HB VAL 21 HB VAL 21 -2.839 -23.204 28.272 198 HG11 VAL 21 HG11 VAL 21 -5.157 -21.914 29.807 199 HG12 VAL 21 HG12 VAL 21 -3.552 -21.197 29.544 200 HG13 VAL 21 HG13 VAL 21 -4.633 -21.450 28.178 201 HG21 VAL 21 HG21 VAL 21 -2.616 -24.613 30.230 202 HG22 VAL 21 HG22 VAL 21 -2.554 -22.934 30.740 203 HG23 VAL 21 HG23 VAL 21 -4.045 -23.870 30.989 204 H LEU 22 H LEU 22 -6.375 -25.504 26.844 205 HA LEU 22 HA LEU 22 -5.676 -24.129 24.331 206 HB2 LEU 22 HB2 LEU 22 -5.980 -26.725 24.734 207 HB3 LEU 22 HB3 LEU 22 -7.693 -26.358 24.575 208 HG LEU 22 HG LEU 22 -7.107 -25.282 22.304 209 HD11 LEU 22 HD11 LEU 22 -4.481 -26.764 22.786 210 HD12 LEU 22 HD12 LEU 22 -4.998 -26.038 21.249 211 HD13 LEU 22 HD13 LEU 22 -4.656 -25.006 22.639 212 HD21 LEU 22 HD21 LEU 22 -8.132 -27.505 22.475 213 HD22 LEU 22 HD22 LEU 22 -6.961 -27.448 21.148 214 HD23 LEU 22 HD23 LEU 22 -6.528 -28.245 22.679 215 H LYS 23 H LYS 23 -7.308 -23.295 22.897 216 HA LYS 23 HA LYS 23 -9.585 -21.977 24.318 217 HB2 LYS 23 HB2 LYS 23 -9.091 -19.933 23.109 218 HB3 LYS 23 HB3 LYS 23 -7.755 -20.426 24.121 219 HG2 LYS 23 HG2 LYS 23 -7.666 -21.315 21.240 220 HG3 LYS 23 HG3 LYS 23 -7.489 -19.590 21.563 221 HD2 LYS 23 HD2 LYS 23 -5.568 -19.969 23.017 222 HD3 LYS 23 HD3 LYS 23 -5.772 -21.715 22.915 223 HE2 LYS 23 HE2 LYS 23 -3.971 -21.127 21.468 224 HE3 LYS 23 HE3 LYS 23 -5.331 -21.637 20.465 225 HZ1 LYS 23 HZ1 LYS 23 -4.575 -18.808 21.003 226 HZ2 LYS 23 HZ2 LYS 23 -4.267 -19.612 19.620 227 HZ3 LYS 23 HZ3 LYS 23 -5.807 -19.280 20.036 228 H ASN 24 H ASN 24 -9.715 -24.369 22.632 229 HA ASN 24 HA ASN 24 -10.930 -25.328 20.965 230 HB2 ASN 24 HB2 ASN 24 -12.596 -24.490 22.660 231 HB3 ASN 24 HB3 ASN 24 -12.932 -23.135 21.575 232 HD21 ASN 24 HD21 ASN 24 -14.663 -25.185 19.184 233 HD22 ASN 24 HD22 ASN 24 -13.648 -23.742 19.332 234 HA PRO 25 HA PRO 25 -9.435 -22.253 17.826 235 HB2 PRO 25 HB2 PRO 25 -7.972 -23.938 16.221 236 HB3 PRO 25 HB3 PRO 25 -7.382 -23.234 17.753 237 HG2 PRO 25 HG2 PRO 25 -8.616 -25.976 17.333 238 HG3 PRO 25 HG3 PRO 25 -7.094 -25.566 18.188 239 HD2 PRO 25 HD2 PRO 25 -9.398 -25.947 19.541 240 HD3 PRO 25 HD3 PRO 25 -8.269 -24.646 20.029 241 H ARG 26 H ARG 26 -11.449 -21.834 17.118 242 HA ARG 26 HA ARG 26 -12.327 -23.101 14.546 243 HB2 ARG 26 HB2 ARG 26 -13.993 -22.473 17.020 244 HB3 ARG 26 HB3 ARG 26 -14.730 -22.527 15.425 245 HG2 ARG 26 HG2 ARG 26 -13.216 -24.876 16.643 246 HG3 ARG 26 HG3 ARG 26 -14.960 -24.628 16.750 247 HD2 ARG 26 HD2 ARG 26 -15.068 -24.585 14.224 248 HD3 ARG 26 HD3 ARG 26 -13.355 -24.992 14.187 249 HE ARG 26 HE ARG 26 -13.825 -27.179 14.764 250 HH11 ARG 26 HH11 ARG 26 -15.104 -28.969 15.019 251 HH12 ARG 26 HH12 ARG 26 -16.807 -28.790 15.327 252 HH21 ARG 26 HH21 ARG 26 -16.794 -25.364 15.252 253 HH22 ARG 26 HH22 ARG 26 -17.742 -26.810 15.461 254 H VAL 27 H VAL 27 -12.587 -20.224 16.652 255 HA VAL 27 HA VAL 27 -12.866 -18.538 14.181 256 HB VAL 27 HB VAL 27 -14.227 -17.965 16.823 257 HG11 VAL 27 HG11 VAL 27 -14.444 -16.702 14.042 258 HG12 VAL 27 HG12 VAL 27 -15.422 -16.266 15.461 259 HG13 VAL 27 HG13 VAL 27 -13.686 -15.947 15.456 260 HG21 VAL 27 HG21 VAL 27 -15.326 -19.897 15.801 261 HG22 VAL 27 HG22 VAL 27 -16.327 -18.463 15.580 262 HG23 VAL 27 HG23 VAL 27 -15.361 -19.081 14.221 263 HA PRO 28 HA PRO 28 -9.186 -16.768 16.300 264 HB2 PRO 28 HB2 PRO 28 -7.575 -16.504 14.149 265 HB3 PRO 28 HB3 PRO 28 -7.771 -18.063 15.006 266 HG2 PRO 28 HG2 PRO 28 -9.217 -17.147 12.489 267 HG3 PRO 28 HG3 PRO 28 -8.367 -18.702 12.765 268 HD2 PRO 28 HD2 PRO 28 -11.063 -18.413 13.058 269 HD3 PRO 28 HD3 PRO 28 -10.120 -19.507 14.116 270 H THR 29 H THR 29 -8.036 -14.711 15.729 271 HA THR 29 HA THR 29 -10.034 -12.668 14.931 272 HB THR 29 HB THR 29 -8.811 -11.393 16.767 273 HG1 THR 29 HG1 THR 29 -7.731 -12.655 18.273 274 HG21 THR 29 HG21 THR 29 -10.290 -13.946 17.534 275 HG22 THR 29 HG22 THR 29 -10.106 -12.495 18.548 276 HG23 THR 29 HG23 THR 29 -11.053 -12.419 17.051 277 H GLN 30 H GLN 30 -9.072 -12.927 12.767 278 HA GLN 30 HA GLN 30 -6.608 -11.282 12.415 279 HB2 GLN 30 HB2 GLN 30 -7.757 -13.526 10.737 280 HB3 GLN 30 HB3 GLN 30 -6.363 -12.562 10.244 281 HG2 GLN 30 HG2 GLN 30 -4.961 -13.382 11.910 282 HG3 GLN 30 HG3 GLN 30 -6.283 -13.953 12.929 283 HE21 GLN 30 HE21 GLN 30 -6.913 -16.925 10.983 284 HE22 GLN 30 HE22 GLN 30 -7.768 -15.642 11.837 285 H LYS 31 H LYS 31 -9.228 -10.167 12.694 286 HA LYS 31 HA LYS 31 -10.240 -9.365 10.124 287 HB2 LYS 31 HB2 LYS 31 -11.467 -9.767 12.356 288 HB3 LYS 31 HB3 LYS 31 -10.925 -8.172 12.833 289 HG2 LYS 31 HG2 LYS 31 -13.195 -8.075 12.093 290 HG3 LYS 31 HG3 LYS 31 -12.241 -7.184 10.926 291 HD2 LYS 31 HD2 LYS 31 -12.861 -10.109 10.422 292 HD3 LYS 31 HD3 LYS 31 -14.150 -8.938 10.226 293 HE2 LYS 31 HE2 LYS 31 -11.484 -8.711 8.762 294 HE3 LYS 31 HE3 LYS 31 -12.885 -9.568 8.124 295 HZ1 LYS 31 HZ1 LYS 31 -12.847 -6.678 8.815 296 HZ2 LYS 31 HZ2 LYS 31 -12.849 -7.304 7.305 297 HZ3 LYS 31 HZ3 LYS 31 -14.152 -7.492 8.261 298 H THR 32 H THR 32 -7.610 -8.652 10.150 299 HA THR 32 HA THR 32 -7.554 -5.668 10.329 300 HB THR 32 HB THR 32 -6.255 -6.950 12.024 301 HG1 THR 32 HG1 THR 32 -4.418 -5.696 11.831 302 HG21 THR 32 HG21 THR 32 -4.442 -7.701 9.691 303 HG22 THR 32 HG22 THR 32 -4.154 -8.020 11.415 304 HG23 THR 32 HG23 THR 32 -5.493 -8.824 10.583 305 H GLY 33 H GLY 33 -7.592 -7.998 8.049 306 HA2 GLY 33 HA2 GLY 33 -5.615 -7.036 6.139 307 HA3 GLY 33 HA3 GLY 33 -6.933 -8.163 5.812 308 H GLU 34 H GLU 34 -9.197 -6.871 6.138 309 HA GLU 34 HA GLU 34 -10.702 -5.492 5.232 310 HB2 GLU 34 HB2 GLU 34 -9.036 -3.984 6.811 311 HB3 GLU 34 HB3 GLU 34 -9.056 -3.016 5.349 312 HG2 GLU 34 HG2 GLU 34 -11.493 -4.086 6.831 313 HG3 GLU 34 HG3 GLU 34 -10.816 -2.478 7.075 314 H LEU 35 H LEU 35 -9.202 -6.868 3.328 315 HA LEU 35 HA LEU 35 -8.849 -5.012 1.095 316 HB2 LEU 35 HB2 LEU 35 -7.251 -7.137 2.219 317 HB3 LEU 35 HB3 LEU 35 -7.752 -7.637 0.612 318 HG LEU 35 HG LEU 35 -7.020 -5.354 -0.207 319 HD11 LEU 35 HD11 LEU 35 -5.501 -5.279 2.443 320 HD12 LEU 35 HD12 LEU 35 -5.323 -4.135 1.105 321 HD13 LEU 35 HD13 LEU 35 -6.832 -4.195 2.030 322 HD21 LEU 35 HD21 LEU 35 -5.755 -7.445 -0.574 323 HD22 LEU 35 HD22 LEU 35 -4.696 -6.040 -0.399 324 HD23 LEU 35 HD23 LEU 35 -4.901 -7.182 0.958 325 H SER 36 H SER 36 -10.745 -4.770 0.211 326 HA SER 36 HA SER 36 -12.222 -7.091 -0.972 327 HB2 SER 36 HB2 SER 36 -13.400 -4.752 0.570 328 HB3 SER 36 HB3 SER 36 -14.327 -5.950 -0.355 329 HG SER 36 HG SER 36 -14.206 -6.483 1.876 330 H GLU 37 H GLU 37 -10.801 -6.353 -2.715 331 HA GLU 37 HA GLU 37 -10.710 -5.777 -4.886 332 HB2 GLU 37 HB2 GLU 37 -13.682 -5.343 -4.475 333 HB3 GLU 37 HB3 GLU 37 -12.899 -5.587 -6.039 334 HG2 GLU 37 HG2 GLU 37 -13.136 -7.608 -3.779 335 HG3 GLU 37 HG3 GLU 37 -13.935 -7.656 -5.341 336 H GLU 38 H GLU 38 -10.890 -3.363 -2.857 337 HA GLU 38 HA GLU 38 -10.353 -1.401 -5.092 338 HB2 GLU 38 HB2 GLU 38 -11.653 -0.836 -2.403 339 HB3 GLU 38 HB3 GLU 38 -11.087 0.396 -3.533 340 HG2 GLU 38 HG2 GLU 38 -12.646 -0.495 -5.266 341 HG3 GLU 38 HG3 GLU 38 -13.271 -1.657 -4.092 342 H GLN 39 H GLN 39 -9.440 -2.604 -1.906 343 HA GLN 39 HA GLN 39 -7.429 -0.633 -1.385 344 HB2 GLN 39 HB2 GLN 39 -7.992 -3.322 -0.104 345 HB3 GLN 39 HB3 GLN 39 -6.896 -2.106 0.527 346 HG2 GLN 39 HG2 GLN 39 -8.904 -1.772 1.737 347 HG3 GLN 39 HG3 GLN 39 -8.875 -0.476 0.557 348 HE21 GLN 39 HE21 GLN 39 -12.239 -1.408 -0.080 349 HE22 GLN 39 HE22 GLN 39 -11.206 -0.251 0.781 350 H LYS 40 H LYS 40 -7.200 -4.026 -2.461 351 HA LYS 40 HA LYS 40 -4.390 -3.971 -3.052 352 HB2 LYS 40 HB2 LYS 40 -4.818 -6.034 -4.267 353 HB3 LYS 40 HB3 LYS 40 -5.714 -6.028 -2.751 354 HG2 LYS 40 HG2 LYS 40 -7.743 -5.174 -4.160 355 HG3 LYS 40 HG3 LYS 40 -6.759 -5.581 -5.567 356 HD2 LYS 40 HD2 LYS 40 -8.281 -7.373 -5.131 357 HD3 LYS 40 HD3 LYS 40 -6.655 -7.953 -4.758 358 HE2 LYS 40 HE2 LYS 40 -7.079 -7.775 -2.350 359 HE3 LYS 40 HE3 LYS 40 -8.589 -6.911 -2.623 360 HZ1 LYS 40 HZ1 LYS 40 -8.091 -9.725 -3.437 361 HZ2 LYS 40 HZ2 LYS 40 -9.020 -9.252 -2.174 362 HZ3 LYS 40 HZ3 LYS 40 -9.480 -8.896 -3.705 363 H LYS 41 H LYS 41 -7.197 -2.861 -4.930 364 HA LYS 41 HA LYS 41 -5.654 -2.200 -7.300 365 HB2 LYS 41 HB2 LYS 41 -8.310 -1.010 -6.428 366 HB3 LYS 41 HB3 LYS 41 -7.546 -0.849 -8.000 367 HG2 LYS 41 HG2 LYS 41 -7.667 -3.357 -8.265 368 HG3 LYS 41 HG3 LYS 41 -8.636 -3.405 -6.773 369 HD2 LYS 41 HD2 LYS 41 -10.284 -1.847 -7.816 370 HD3 LYS 41 HD3 LYS 41 -9.317 -1.828 -9.304 371 HE2 LYS 41 HE2 LYS 41 -9.641 -4.267 -9.564 372 HE3 LYS 41 HE3 LYS 41 -10.579 -4.310 -8.063 373 HZ1 LYS 41 HZ1 LYS 41 -11.350 -2.783 -10.495 374 HZ2 LYS 41 HZ2 LYS 41 -12.024 -4.189 -10.016 375 HZ3 LYS 41 HZ3 LYS 41 -12.212 -2.848 -9.106 376 H ILE 42 H ILE 42 -5.424 -0.868 -4.276 377 HA ILE 42 HA ILE 42 -4.129 1.598 -5.372 378 HB ILE 42 HB ILE 42 -5.024 0.844 -2.586 379 HG12 ILE 42 HG12 ILE 42 -5.908 3.363 -3.974 380 HG13 ILE 42 HG13 ILE 42 -6.563 1.874 -4.615 381 HG21 ILE 42 HG21 ILE 42 -3.568 3.388 -3.393 382 HG22 ILE 42 HG22 ILE 42 -4.263 3.010 -1.796 383 HG23 ILE 42 HG23 ILE 42 -2.907 2.076 -2.398 384 HD11 ILE 42 HD11 ILE 42 -6.734 2.628 -1.683 385 HD12 ILE 42 HD12 ILE 42 -8.042 2.757 -2.894 386 HD13 ILE 42 HD13 ILE 42 -7.379 1.173 -2.461 387 H VAL 43 H VAL 43 -3.474 -1.069 -2.973 388 HA VAL 43 HA VAL 43 -0.712 -0.305 -2.910 389 HB VAL 43 HB VAL 43 -1.737 -2.974 -1.903 390 HG11 VAL 43 HG11 VAL 43 0.548 -1.090 -1.090 391 HG12 VAL 43 HG12 VAL 43 0.155 -2.610 -0.274 392 HG13 VAL 43 HG13 VAL 43 0.736 -2.644 -1.930 393 HG21 VAL 43 HG21 VAL 43 -2.188 -0.212 -0.812 394 HG22 VAL 43 HG22 VAL 43 -3.205 -1.654 -0.749 395 HG23 VAL 43 HG23 VAL 43 -1.820 -1.499 0.331 396 H ALA 44 H ALA 44 -2.224 -3.193 -4.505 397 HA ALA 44 HA ALA 44 0.330 -4.142 -5.493 398 HB1 ALA 44 HB1 ALA 44 -2.473 -4.787 -6.493 399 HB2 ALA 44 HB2 ALA 44 -0.991 -5.709 -6.788 400 HB3 ALA 44 HB3 ALA 44 -1.650 -5.609 -5.144 401 H ASP 45 H ASP 45 -2.228 -2.032 -6.802 402 HA ASP 45 HA ASP 45 -1.087 -1.553 -9.372 403 HB2 ASP 45 HB2 ASP 45 -3.365 -0.904 -8.634 404 HB3 ASP 45 HB3 ASP 45 -2.662 0.350 -7.606 405 H TYR 46 H TYR 46 -0.278 -0.005 -6.209 406 HA TYR 46 HA TYR 46 1.586 1.863 -7.362 407 HB2 TYR 46 HB2 TYR 46 0.378 1.749 -4.999 408 HB3 TYR 46 HB3 TYR 46 1.834 0.909 -4.513 409 HD1 TYR 46 HD1 TYR 46 0.750 3.503 -3.395 410 HD2 TYR 46 HD2 TYR 46 3.605 2.749 -6.495 411 HE1 TYR 46 HE1 TYR 46 1.782 5.743 -2.986 412 HE2 TYR 46 HE2 TYR 46 4.576 4.976 -6.199 413 HH TYR 46 HH TYR 46 3.315 7.296 -3.737 414 H ILE 47 H ILE 47 1.980 -1.416 -5.964 415 HA ILE 47 HA ILE 47 4.822 -1.650 -6.304 416 HB ILE 47 HB ILE 47 2.490 -3.520 -6.017 417 HG12 ILE 47 HG12 ILE 47 3.454 -4.195 -4.013 418 HG13 ILE 47 HG13 ILE 47 5.084 -3.749 -4.506 419 HG21 ILE 47 HG21 ILE 47 5.266 -4.467 -6.761 420 HG22 ILE 47 HG22 ILE 47 3.977 -5.494 -6.102 421 HG23 ILE 47 HG23 ILE 47 3.764 -4.735 -7.686 422 HD11 ILE 47 HD11 ILE 47 2.969 -1.686 -3.804 423 HD12 ILE 47 HD12 ILE 47 4.218 -2.320 -2.710 424 HD13 ILE 47 HD13 ILE 47 4.686 -1.434 -4.170 425 H SER 48 H SER 48 2.184 -2.162 -8.667 426 HA SER 48 HA SER 48 3.940 -2.820 -10.852 427 HB2 SER 48 HB2 SER 48 1.138 -1.649 -10.831 428 HB3 SER 48 HB3 SER 48 1.979 -2.234 -12.271 429 HG SER 48 HG SER 48 0.623 -3.850 -11.352 430 H GLU 49 H GLU 49 3.603 0.281 -9.295 431 HA GLU 49 HA GLU 49 4.110 1.741 -11.834 432 HB2 GLU 49 HB2 GLU 49 2.159 2.294 -10.331 433 HB3 GLU 49 HB3 GLU 49 3.319 2.780 -9.096 434 HG2 GLU 49 HG2 GLU 49 2.561 4.740 -10.196 435 HG3 GLU 49 HG3 GLU 49 4.229 4.490 -10.692 436 H VAL 50 H VAL 50 5.473 1.366 -8.528 437 HA VAL 50 HA VAL 50 7.984 2.698 -9.504 438 HB VAL 50 HB VAL 50 8.212 3.889 -7.458 439 HG11 VAL 50 HG11 VAL 50 5.339 4.250 -8.329 440 HG12 VAL 50 HG12 VAL 50 6.420 5.437 -7.566 441 HG13 VAL 50 HG13 VAL 50 6.753 4.873 -9.208 442 HG21 VAL 50 HG21 VAL 50 7.392 2.304 -5.828 443 HG22 VAL 50 HG22 VAL 50 6.501 3.822 -5.691 444 HG23 VAL 50 HG23 VAL 50 5.754 2.414 -6.483 445 H GLY 51 H GLY 51 6.828 -0.125 -7.870 446 HA2 GLY 51 HA2 GLY 51 8.544 -1.876 -8.487 447 HA3 GLY 51 HA3 GLY 51 9.672 -0.992 -7.460 448 H LEU 52 H LEU 52 9.074 -0.717 -5.210 449 HA LEU 52 HA LEU 52 7.082 -2.428 -3.966 450 HB2 LEU 52 HB2 LEU 52 9.117 -3.981 -4.589 451 HB3 LEU 52 HB3 LEU 52 9.998 -3.111 -3.354 452 HG LEU 52 HG LEU 52 7.693 -3.750 -1.979 453 HD11 LEU 52 HD11 LEU 52 8.307 -6.089 -3.849 454 HD12 LEU 52 HD12 LEU 52 7.158 -6.107 -2.505 455 HD13 LEU 52 HD13 LEU 52 6.847 -5.081 -3.915 456 HD21 LEU 52 HD21 LEU 52 9.924 -4.133 -1.114 457 HD22 LEU 52 HD22 LEU 52 8.957 -5.590 -0.939 458 HD23 LEU 52 HD23 LEU 52 10.169 -5.495 -2.241 459 H ASN 53 H ASN 53 10.129 -0.800 -3.438 460 HA ASN 53 HA ASN 53 9.342 0.140 -0.737 461 HB2 ASN 53 HB2 ASN 53 12.048 -0.025 -2.129 462 HB3 ASN 53 HB3 ASN 53 11.797 0.487 -0.465 463 HD21 ASN 53 HD21 ASN 53 12.219 -3.400 -1.135 464 HD22 ASN 53 HD22 ASN 53 12.624 -2.172 -2.320 465 H ASN 54 H ASN 54 9.591 1.505 -3.849 466 HA ASN 54 HA ASN 54 10.603 4.119 -2.955 467 HB2 ASN 54 HB2 ASN 54 9.635 3.275 -5.706 468 HB3 ASN 54 HB3 ASN 54 10.622 4.679 -5.314 469 HD21 ASN 54 HD21 ASN 54 12.420 1.158 -5.987 470 HD22 ASN 54 HD22 ASN 54 10.770 1.543 -6.471 471 H LEU 55 H LEU 55 7.550 2.708 -3.121 472 HA LEU 55 HA LEU 55 5.890 5.008 -3.595 473 HB2 LEU 55 HB2 LEU 55 4.097 3.527 -2.835 474 HB3 LEU 55 HB3 LEU 55 5.159 2.772 -4.001 475 HG LEU 55 HG LEU 55 6.293 1.594 -2.009 476 HD11 LEU 55 HD11 LEU 55 3.753 2.599 -0.643 477 HD12 LEU 55 HD12 LEU 55 4.705 1.202 -0.103 478 HD13 LEU 55 HD13 LEU 55 5.434 2.804 -0.081 479 HD21 LEU 55 HD21 LEU 55 4.738 0.603 -3.660 480 HD22 LEU 55 HD22 LEU 55 4.594 -0.125 -2.051 481 HD23 LEU 55 HD23 LEU 55 3.363 1.029 -2.620 482 H ASN 56 H ASN 56 4.137 5.536 -1.883 483 HA ASN 56 HA ASN 56 5.532 6.344 0.628 484 HB2 ASN 56 HB2 ASN 56 4.698 7.998 -1.400 485 HB3 ASN 56 HB3 ASN 56 3.255 7.974 -0.399 486 HD21 ASN 56 HD21 ASN 56 6.637 9.858 0.836 487 HD22 ASN 56 HD22 ASN 56 6.552 8.954 -0.676 488 H ALA 57 H ALA 57 4.749 5.432 2.429 489 HA ALA 57 HA ALA 57 2.322 3.943 2.570 490 HB1 ALA 57 HB1 ALA 57 4.041 5.143 4.788 491 HB2 ALA 57 HB2 ALA 57 2.834 3.859 4.989 492 HB3 ALA 57 HB3 ALA 57 4.282 3.556 4.024 493 H THR 58 H THR 58 2.927 7.377 3.068 494 HA THR 58 HA THR 58 0.438 8.063 4.338 495 HB THR 58 HB THR 58 2.246 9.764 2.594 496 HG1 THR 58 HG1 THR 58 3.218 10.307 4.510 497 HG21 THR 58 HG21 THR 58 0.150 10.524 4.669 498 HG22 THR 58 HG22 THR 58 1.344 11.646 3.969 499 HG23 THR 58 HG23 THR 58 0.133 10.893 2.928 500 H GLU 59 H GLU 59 1.406 8.013 0.861 501 HA GLU 59 HA GLU 59 -1.169 8.821 -0.154 502 HB2 GLU 59 HB2 GLU 59 1.042 7.142 -1.393 503 HB3 GLU 59 HB3 GLU 59 -0.368 7.716 -2.278 504 HG2 GLU 59 HG2 GLU 59 1.671 9.537 -0.925 505 HG3 GLU 59 HG3 GLU 59 1.712 9.067 -2.616 506 H LEU 60 H LEU 60 0.172 5.592 0.630 507 HA LEU 60 HA LEU 60 -2.128 4.078 -0.190 508 HB2 LEU 60 HB2 LEU 60 -0.161 3.516 2.068 509 HB3 LEU 60 HB3 LEU 60 -1.342 2.378 1.442 510 HG LEU 60 HG LEU 60 1.077 3.475 -0.048 511 HD11 LEU 60 HD11 LEU 60 0.323 0.668 0.878 512 HD12 LEU 60 HD12 LEU 60 1.817 1.140 0.036 513 HD13 LEU 60 HD13 LEU 60 1.494 1.735 1.675 514 HD21 LEU 60 HD21 LEU 60 -0.702 3.180 -1.680 515 HD22 LEU 60 HD22 LEU 60 0.432 1.819 -1.818 516 HD23 LEU 60 HD23 LEU 60 -1.120 1.608 -0.984 517 H SER 61 H SER 61 -1.371 5.462 3.077 518 HA SER 61 HA SER 61 -3.783 4.540 4.262 519 HB2 SER 61 HB2 SER 61 -3.191 6.022 6.109 520 HB3 SER 61 HB3 SER 61 -1.778 5.123 5.533 521 HG SER 61 HG SER 61 -1.184 7.243 5.761 522 H LYS 62 H LYS 62 -3.146 7.375 2.383 523 HA LYS 62 HA LYS 62 -5.611 8.834 3.020 524 HB2 LYS 62 HB2 LYS 62 -3.522 9.065 0.822 525 HB3 LYS 62 HB3 LYS 62 -4.968 10.077 0.853 526 HG2 LYS 62 HG2 LYS 62 -4.353 11.148 2.883 527 HG3 LYS 62 HG3 LYS 62 -3.121 9.947 3.258 528 HD2 LYS 62 HD2 LYS 62 -2.045 11.982 2.502 529 HD3 LYS 62 HD3 LYS 62 -1.761 10.695 1.323 530 HE2 LYS 62 HE2 LYS 62 -3.640 11.622 -0.072 531 HE3 LYS 62 HE3 LYS 62 -3.824 12.940 1.094 532 HZ1 LYS 62 HZ1 LYS 62 -1.369 12.356 -0.483 533 HZ2 LYS 62 HZ2 LYS 62 -2.413 13.578 -0.792 534 HZ3 LYS 62 HZ3 LYS 62 -1.522 13.598 0.580 535 H ARG 63 H ARG 63 -4.598 6.782 0.281 536 HA ARG 63 HA ARG 63 -7.166 6.881 -1.100 537 HB2 ARG 63 HB2 ARG 63 -4.645 5.194 -1.284 538 HB3 ARG 63 HB3 ARG 63 -6.056 4.818 -2.256 539 HG2 ARG 63 HG2 ARG 63 -4.622 7.496 -2.373 540 HG3 ARG 63 HG3 ARG 63 -4.314 6.117 -3.436 541 HD2 ARG 63 HD2 ARG 63 -6.896 6.179 -3.898 542 HD3 ARG 63 HD3 ARG 63 -6.819 7.825 -3.275 543 HE ARG 63 HE ARG 63 -5.770 6.765 -5.808 544 HH11 ARG 63 HH11 ARG 63 -4.953 8.115 -7.343 545 HH12 ARG 63 HH12 ARG 63 -4.574 9.765 -6.946 546 HH21 ARG 63 HH21 ARG 63 -5.535 9.526 -3.660 547 HH22 ARG 63 HH22 ARG 63 -4.888 10.549 -4.915 548 H LEU 64 H LEU 64 -5.659 4.494 1.034 549 HA LEU 64 HA LEU 64 -7.849 2.579 0.708 550 HB2 LEU 64 HB2 LEU 64 -5.293 2.305 0.676 551 HB3 LEU 64 HB3 LEU 64 -5.368 2.343 2.435 552 HG LEU 64 HG LEU 64 -6.795 0.328 0.675 553 HD11 LEU 64 HD11 LEU 64 -4.049 0.188 1.979 554 HD12 LEU 64 HD12 LEU 64 -4.865 -1.171 1.183 555 HD13 LEU 64 HD13 LEU 64 -4.407 0.249 0.240 556 HD21 LEU 64 HD21 LEU 64 -7.682 0.235 2.956 557 HD22 LEU 64 HD22 LEU 64 -6.603 -1.135 2.743 558 HD23 LEU 64 HD23 LEU 64 -6.038 0.289 3.625 559 H ASN 65 H ASN 65 -6.938 4.977 3.057 560 HA ASN 65 HA ASN 65 -7.766 5.700 4.977 561 HB2 ASN 65 HB2 ASN 65 -9.887 5.835 3.794 562 HB3 ASN 65 HB3 ASN 65 -10.296 4.182 4.269 563 HD21 ASN 65 HD21 ASN 65 -10.307 7.059 7.225 564 HD22 ASN 65 HD22 ASN 65 -9.171 7.229 5.896 565 H ILE 66 H ILE 66 -6.022 4.506 5.691 566 HA ILE 66 HA ILE 66 -6.635 2.771 8.011 567 HB ILE 66 HB ILE 66 -4.419 1.568 7.554 568 HG12 ILE 66 HG12 ILE 66 -4.847 2.644 4.739 569 HG13 ILE 66 HG13 ILE 66 -3.544 3.092 5.854 570 HG21 ILE 66 HG21 ILE 66 -6.730 1.022 5.660 571 HG22 ILE 66 HG22 ILE 66 -5.480 -0.143 6.157 572 HG23 ILE 66 HG23 ILE 66 -6.615 0.498 7.348 573 HD11 ILE 66 HD11 ILE 66 -3.936 0.363 4.570 574 HD12 ILE 66 HD12 ILE 66 -2.767 1.608 4.121 575 HD13 ILE 66 HD13 ILE 66 -2.645 0.806 5.712 576 H THR 67 H THR 67 -4.528 2.818 9.473 577 HA THR 67 HA THR 67 -3.521 5.602 9.637 578 HB THR 67 HB THR 67 -4.105 4.525 11.731 579 HG1 THR 67 HG1 THR 67 -2.227 5.133 12.754 580 HG21 THR 67 HG21 THR 67 -1.727 2.674 11.282 581 HG22 THR 67 HG22 THR 67 -2.747 2.778 12.726 582 HG23 THR 67 HG23 THR 67 -3.430 2.163 11.216 583 H VAL 68 H VAL 68 -1.263 6.095 9.549 584 HA VAL 68 HA VAL 68 0.044 5.079 7.228 585 HB VAL 68 HB VAL 68 1.367 6.551 9.543 586 HG11 VAL 68 HG11 VAL 68 2.034 6.410 6.564 587 HG12 VAL 68 HG12 VAL 68 2.859 7.438 7.756 588 HG13 VAL 68 HG13 VAL 68 2.972 5.683 7.884 589 HG21 VAL 68 HG21 VAL 68 -0.627 7.840 8.778 590 HG22 VAL 68 HG22 VAL 68 0.887 8.641 8.363 591 HG23 VAL 68 HG23 VAL 68 -0.008 7.767 7.113 592 H ASP 69 H ASP 69 0.442 4.228 10.651 593 HA ASP 69 HA ASP 69 2.706 2.532 10.265 594 HB2 ASP 69 HB2 ASP 69 2.019 3.525 12.440 595 HB3 ASP 69 HB3 ASP 69 0.591 2.490 12.455 596 H LYS 70 H LYS 70 -0.752 1.825 9.923 597 HA LYS 70 HA LYS 70 -0.288 -1.056 9.629 598 HB2 LYS 70 HB2 LYS 70 -2.704 0.708 9.134 599 HB3 LYS 70 HB3 LYS 70 -2.620 -0.945 8.513 600 HG2 LYS 70 HG2 LYS 70 -1.995 -1.682 10.897 601 HG3 LYS 70 HG3 LYS 70 -2.531 -0.089 11.428 602 HD2 LYS 70 HD2 LYS 70 -4.191 -2.175 9.930 603 HD3 LYS 70 HD3 LYS 70 -4.258 -1.855 11.665 604 HE2 LYS 70 HE2 LYS 70 -5.049 0.456 11.220 605 HE3 LYS 70 HE3 LYS 70 -5.002 0.133 9.475 606 HZ1 LYS 70 HZ1 LYS 70 -6.701 -1.326 11.430 607 HZ2 LYS 70 HZ2 LYS 70 -7.242 -0.193 10.393 608 HZ3 LYS 70 HZ3 LYS 70 -6.668 -1.614 9.824 609 H ALA 71 H ALA 71 -0.216 1.728 7.470 610 HA ALA 71 HA ALA 71 -0.075 0.081 5.025 611 HB1 ALA 71 HB1 ALA 71 0.766 2.980 5.542 612 HB2 ALA 71 HB2 ALA 71 0.592 2.198 3.961 613 HB3 ALA 71 HB3 ALA 71 -0.827 2.466 4.992 614 H LYS 72 H LYS 72 2.321 1.785 7.048 615 HA LYS 72 HA LYS 72 4.707 1.035 5.717 616 HB2 LYS 72 HB2 LYS 72 4.061 1.696 8.597 617 HB3 LYS 72 HB3 LYS 72 5.711 1.310 8.077 618 HG2 LYS 72 HG2 LYS 72 5.766 3.199 6.573 619 HG3 LYS 72 HG3 LYS 72 4.055 3.524 6.850 620 HD2 LYS 72 HD2 LYS 72 5.411 5.114 8.104 621 HD3 LYS 72 HD3 LYS 72 4.432 4.108 9.162 622 HE2 LYS 72 HE2 LYS 72 6.561 4.372 10.189 623 HE3 LYS 72 HE3 LYS 72 6.421 2.695 9.670 624 HZ1 LYS 72 HZ1 LYS 72 7.915 4.826 8.217 625 HZ2 LYS 72 HZ2 LYS 72 8.597 3.645 9.107 626 HZ3 LYS 72 HZ3 LYS 72 7.815 3.268 7.728 627 H THR 73 H THR 73 2.943 -0.824 8.236 628 HA THR 73 HA THR 73 4.929 -2.995 8.002 629 HB THR 73 HB THR 73 3.813 -2.367 10.161 630 HG1 THR 73 HG1 THR 73 3.854 -4.514 10.796 631 HG21 THR 73 HG21 THR 73 1.554 -4.168 9.187 632 HG22 THR 73 HG22 THR 73 1.719 -3.371 10.766 633 HG23 THR 73 HG23 THR 73 1.428 -2.401 9.318 634 H TYR 74 H TYR 74 1.526 -2.528 6.879 635 HA TYR 74 HA TYR 74 1.152 -5.142 5.900 636 HB2 TYR 74 HB2 TYR 74 -0.694 -3.631 6.149 637 HB3 TYR 74 HB3 TYR 74 0.034 -2.470 5.024 638 HD1 TYR 74 HD1 TYR 74 -1.346 -5.964 5.176 639 HD2 TYR 74 HD2 TYR 74 -0.436 -2.498 2.762 640 HE1 TYR 74 HE1 TYR 74 -2.340 -7.086 3.184 641 HE2 TYR 74 HE2 TYR 74 -1.447 -3.613 0.803 642 HH TYR 74 HH TYR 74 -2.686 -6.963 0.915 643 H ILE 75 H ILE 75 2.772 -2.389 4.295 644 HA ILE 75 HA ILE 75 3.236 -3.411 1.725 645 HB ILE 75 HB ILE 75 4.949 -1.769 3.608 646 HG12 ILE 75 HG12 ILE 75 3.686 -0.851 0.998 647 HG13 ILE 75 HG13 ILE 75 2.738 -0.906 2.470 648 HG21 ILE 75 HG21 ILE 75 5.575 -2.390 0.681 649 HG22 ILE 75 HG22 ILE 75 6.398 -1.168 1.661 650 HG23 ILE 75 HG23 ILE 75 6.561 -2.857 2.086 651 HD11 ILE 75 HD11 ILE 75 5.305 0.715 2.113 652 HD12 ILE 75 HD12 ILE 75 3.658 1.347 2.181 653 HD13 ILE 75 HD13 ILE 75 4.371 0.594 3.609 654 H LYS 76 H LYS 76 5.578 -3.912 4.458 655 HA LYS 76 HA LYS 76 6.872 -6.056 3.016 656 HB2 LYS 76 HB2 LYS 76 8.395 -6.178 4.789 657 HB3 LYS 76 HB3 LYS 76 7.947 -4.476 4.711 658 HG2 LYS 76 HG2 LYS 76 6.323 -4.906 6.627 659 HG3 LYS 76 HG3 LYS 76 6.920 -6.566 6.698 660 HD2 LYS 76 HD2 LYS 76 8.083 -5.473 8.394 661 HD3 LYS 76 HD3 LYS 76 9.257 -5.563 7.069 662 HE2 LYS 76 HE2 LYS 76 8.608 -3.217 6.418 663 HE3 LYS 76 HE3 LYS 76 7.481 -3.183 7.782 664 HZ1 LYS 76 HZ1 LYS 76 10.431 -3.515 8.022 665 HZ2 LYS 76 HZ2 LYS 76 9.615 -2.141 8.350 666 HZ3 LYS 76 HZ3 LYS 76 9.388 -3.463 9.279 667 H ASN 77 H ASN 77 4.150 -6.117 5.208 668 HA ASN 77 HA ASN 77 4.495 -8.934 5.839 669 HB2 ASN 77 HB2 ASN 77 3.236 -6.961 7.134 670 HB3 ASN 77 HB3 ASN 77 1.848 -7.548 6.213 671 HD21 ASN 77 HD21 ASN 77 3.658 -9.850 9.117 672 HD22 ASN 77 HD22 ASN 77 4.493 -8.469 8.412 673 H SER 78 H SER 78 2.693 -7.178 3.375 674 HA SER 78 HA SER 78 1.459 -9.645 2.303 675 HB2 SER 78 HB2 SER 78 0.196 -7.524 2.512 676 HB3 SER 78 HB3 SER 78 1.294 -6.773 1.337 677 HG SER 78 HG SER 78 -0.598 -7.585 0.336 678 H ASN 79 H ASN 79 3.791 -7.154 1.258 679 HA ASN 79 HA ASN 79 4.722 -8.967 -0.922 680 HB2 ASN 79 HB2 ASN 79 4.988 -6.994 -2.362 681 HB3 ASN 79 HB3 ASN 79 3.333 -7.415 -1.974 682 HD21 ASN 79 HD21 ASN 79 4.783 -3.813 -0.692 683 HD22 ASN 79 HD22 ASN 79 5.906 -5.159 -0.885 684 H ARG 80 H ARG 80 6.256 -9.733 0.524 685 HA ARG 80 HA ARG 80 8.650 -8.013 0.982 686 HB2 ARG 80 HB2 ARG 80 9.540 -9.965 2.229 687 HB3 ARG 80 HB3 ARG 80 8.114 -9.253 2.916 688 HG2 ARG 80 HG2 ARG 80 7.703 -11.602 1.063 689 HG3 ARG 80 HG3 ARG 80 8.486 -11.925 2.602 690 HD2 ARG 80 HD2 ARG 80 5.789 -10.523 2.370 691 HD3 ARG 80 HD3 ARG 80 5.985 -12.251 2.629 692 HE ARG 80 HE ARG 80 6.565 -10.040 4.505 693 HH11 ARG 80 HH11 ARG 80 6.894 -10.511 6.654 694 HH12 ARG 80 HH12 ARG 80 6.999 -12.163 7.186 695 HH21 ARG 80 HH21 ARG 80 6.666 -13.524 4.057 696 HH22 ARG 80 HH22 ARG 80 6.888 -13.830 5.758 697 H MET 81 H MET 81 7.547 -9.785 -1.565 698 HA MET 81 HA MET 81 9.991 -11.237 -2.225 699 HB2 MET 81 HB2 MET 81 7.416 -10.889 -3.797 700 HB3 MET 81 HB3 MET 81 8.750 -11.980 -4.203 701 HG2 MET 81 HG2 MET 81 8.452 -13.066 -1.941 702 HG3 MET 81 HG3 MET 81 6.972 -12.128 -1.745 703 HE1 MET 81 HE1 MET 81 5.717 -12.219 -4.778 704 HE2 MET 81 HE2 MET 81 4.650 -13.619 -4.560 705 HE3 MET 81 HE3 MET 81 4.804 -12.417 -3.261 706 H GLY 82 H GLY 82 11.112 -8.991 -2.015 707 HA2 GLY 82 HA2 GLY 82 11.407 -7.635 -4.662 708 HA3 GLY 82 HA3 GLY 82 12.164 -7.172 -3.137 709 H ARG 83 H ARG 83 14.233 -7.657 -2.980 710 HA ARG 83 HA ARG 83 15.423 -10.054 -4.359 711 HB2 ARG 83 HB2 ARG 83 16.565 -7.361 -3.674 712 HB3 ARG 83 HB3 ARG 83 17.582 -8.793 -3.967 713 HG2 ARG 83 HG2 ARG 83 16.667 -9.102 -6.184 714 HG3 ARG 83 HG3 ARG 83 15.556 -7.731 -5.981 715 HD2 ARG 83 HD2 ARG 83 17.262 -6.145 -6.126 716 HD3 ARG 83 HD3 ARG 83 18.470 -7.246 -5.473 717 HE ARG 83 HE ARG 83 19.057 -7.907 -7.562 718 HH11 ARG 83 HH11 ARG 83 19.043 -8.101 -9.752 719 HH12 ARG 83 HH12 ARG 83 17.672 -7.554 -10.671 720 HH21 ARG 83 HH21 ARG 83 15.871 -6.492 -7.951 721 HH22 ARG 83 HH22 ARG 83 15.913 -6.677 -9.683 722 H THR 84 H THR 84 14.216 -10.954 -2.361 723 HA THR 84 HA THR 84 14.415 -12.186 -0.432 724 HB THR 84 HB THR 84 16.598 -13.487 -0.420 725 HG1 THR 84 HG1 THR 84 17.885 -13.242 -2.232 726 HG21 THR 84 HG21 THR 84 15.120 -13.284 -3.072 727 HG22 THR 84 HG22 THR 84 16.079 -14.664 -2.494 728 HG23 THR 84 HG23 THR 84 14.583 -14.222 -1.660 729 H ASN 85 H ASN 85 14.988 -9.386 0.156 730 HA ASN 85 HA ASN 85 16.039 -7.955 1.517 731 HB2 ASN 85 HB2 ASN 85 14.510 -9.221 3.043 732 HB3 ASN 85 HB3 ASN 85 15.876 -10.219 3.541 733 HD21 ASN 85 HD21 ASN 85 15.768 -6.282 4.778 734 HD22 ASN 85 HD22 ASN 85 15.024 -6.696 3.245 735 H ASN 86 H ASN 86 17.878 -9.557 -0.131 736 HA ASN 86 HA ASN 86 20.346 -9.561 1.491 737 HB2 ASN 86 HB2 ASN 86 21.130 -11.196 0.196 738 HB3 ASN 86 HB3 ASN 86 19.432 -11.465 -0.166 739 HD21 ASN 86 HD21 ASN 86 19.785 -10.207 -3.542 740 HD22 ASN 86 HD22 ASN 86 18.619 -10.308 -2.224 741 H PHE 87 H PHE 87 18.770 -7.388 -0.472 742 HA PHE 87 HA PHE 87 20.864 -6.235 -2.027 743 HB2 PHE 87 HB2 PHE 87 19.155 -4.529 -2.513 744 HB3 PHE 87 HB3 PHE 87 18.533 -6.161 -2.644 745 HD1 PHE 87 HD1 PHE 87 18.602 -3.168 -0.387 746 HD2 PHE 87 HD2 PHE 87 16.648 -6.881 -1.360 747 HE1 PHE 87 HE1 PHE 87 16.777 -2.619 1.196 748 HE2 PHE 87 HE2 PHE 87 14.790 -6.307 0.190 749 HZ PHE 87 HZ PHE 87 14.861 -4.181 1.483 750 H LYS 88 H LYS 88 21.378 -6.277 0.990 751 HA LYS 88 HA LYS 88 21.290 -3.494 1.913 752 HB2 LYS 88 HB2 LYS 88 22.196 -4.467 4.000 753 HB3 LYS 88 HB3 LYS 88 20.726 -5.252 3.436 754 HG2 LYS 88 HG2 LYS 88 22.859 -6.759 2.285 755 HG3 LYS 88 HG3 LYS 88 23.395 -6.372 3.921 756 HD2 LYS 88 HD2 LYS 88 21.285 -7.335 4.837 757 HD3 LYS 88 HD3 LYS 88 20.706 -7.598 3.192 758 HE2 LYS 88 HE2 LYS 88 21.442 -9.708 3.935 759 HE3 LYS 88 HE3 LYS 88 22.650 -9.141 2.779 760 HZ1 LYS 88 HZ1 LYS 88 22.910 -8.995 5.744 761 HZ2 LYS 88 HZ2 LYS 88 23.671 -10.076 4.791 762 HZ3 LYS 88 HZ3 LYS 88 24.050 -8.493 4.683 763 H THR 89 H THR 89 23.272 -4.867 -0.147 764 HA THR 89 HA THR 89 25.708 -3.295 0.510 765 HB THR 89 HB THR 89 25.509 -6.317 0.099 766 HG1 THR 89 HG1 THR 89 26.531 -6.352 2.120 767 HG21 THR 89 HG21 THR 89 27.962 -4.549 0.247 768 HG22 THR 89 HG22 THR 89 27.969 -6.330 0.415 769 HG23 THR 89 HG23 THR 89 27.444 -5.596 -1.106 770 H ILE 90 H ILE 90 24.120 -5.558 -1.780 771 HA ILE 90 HA ILE 90 25.688 -4.706 -4.056 772 HB ILE 90 HB ILE 90 23.061 -6.231 -4.152 773 HG12 ILE 90 HG12 ILE 90 25.838 -7.386 -3.602 774 HG13 ILE 90 HG13 ILE 90 24.490 -7.351 -2.464 775 HG21 ILE 90 HG21 ILE 90 25.548 -6.297 -5.937 776 HG22 ILE 90 HG22 ILE 90 24.075 -7.258 -6.183 777 HG23 ILE 90 HG23 ILE 90 24.001 -5.533 -6.357 778 HD11 ILE 90 HD11 ILE 90 24.662 -9.023 -4.975 779 HD12 ILE 90 HD12 ILE 90 24.582 -9.548 -3.290 780 HD13 ILE 90 HD13 ILE 90 23.163 -8.788 -4.035 781 H LYS 91 H LYS 91 24.808 -3.657 -5.961 782 HA LYS 91 HA LYS 91 23.853 -1.959 -7.112 783 HB2 LYS 91 HB2 LYS 91 21.489 -2.145 -5.218 784 HB3 LYS 91 HB3 LYS 91 21.481 -1.379 -6.782 785 HG2 LYS 91 HG2 LYS 91 22.035 -4.359 -6.558 786 HG3 LYS 91 HG3 LYS 91 20.415 -3.725 -6.406 787 HD2 LYS 91 HD2 LYS 91 20.793 -4.459 -8.673 788 HD3 LYS 91 HD3 LYS 91 20.500 -2.719 -8.626 789 HE2 LYS 91 HE2 LYS 91 22.917 -2.282 -8.874 790 HE3 LYS 91 HE3 LYS 91 23.253 -4.022 -8.841 791 HZ1 LYS 91 HZ1 LYS 91 21.637 -2.628 -10.914 792 HZ2 LYS 91 HZ2 LYS 91 23.164 -3.163 -11.116 793 HZ3 LYS 91 HZ3 LYS 91 21.952 -4.231 -10.896 794 H MET 92 H MET 92 24.792 -1.379 -3.950 795 HA MET 92 HA MET 92 24.017 1.493 -4.042 796 HB2 MET 92 HB2 MET 92 25.178 -0.122 -1.755 797 HB3 MET 92 HB3 MET 92 24.621 1.558 -1.702 798 HG2 MET 92 HG2 MET 92 22.359 0.624 -2.586 799 HG3 MET 92 HG3 MET 92 22.980 -0.951 -2.076 800 HE1 MET 92 HE1 MET 92 24.641 -0.065 0.652 801 HE2 MET 92 HE2 MET 92 23.355 -0.579 1.767 802 HE3 MET 92 HE3 MET 92 23.702 -1.530 0.299 803 H PHE 93 H PHE 93 27.064 -0.407 -3.700 804 HA PHE 93 HA PHE 93 28.617 2.114 -3.832 805 HB2 PHE 93 HB2 PHE 93 30.469 0.888 -3.089 806 HB3 PHE 93 HB3 PHE 93 29.106 0.378 -2.117 807 HD1 PHE 93 HD1 PHE 93 31.581 -0.632 -4.665 808 HD2 PHE 93 HD2 PHE 93 28.201 -1.924 -2.327 809 HE1 PHE 93 HE1 PHE 93 32.094 -2.996 -5.228 810 HE2 PHE 93 HE2 PHE 93 28.701 -4.286 -2.907 811 HZ PHE 93 HZ PHE 93 30.651 -4.826 -4.356 812 H GLU 94 H GLU 94 27.428 -0.048 -6.095 813 HA GLU 94 HA GLU 94 29.738 0.103 -7.951 814 HB2 GLU 94 HB2 GLU 94 27.144 -1.473 -8.109 815 HB3 GLU 94 HB3 GLU 94 28.480 -1.555 -9.263 816 HG2 GLU 94 HG2 GLU 94 29.991 -2.376 -7.476 817 HG3 GLU 94 HG3 GLU 94 28.660 -2.320 -6.315 818 H ASP 95 H ASP 95 29.563 0.843 -10.081 819 HA ASP 95 HA ASP 95 27.153 2.354 -10.934 820 HB2 ASP 95 HB2 ASP 95 29.990 3.456 -10.809 821 HB3 ASP 95 HB3 ASP 95 28.724 4.146 -11.815 822 H ASP 96 H ASP 96 26.957 2.579 -13.190 823 HA ASP 96 HA ASP 96 28.972 1.365 -14.954 824 HB2 ASP 96 HB2 ASP 96 27.506 -0.119 -16.066 825 HB3 ASP 96 HB3 ASP 96 27.412 -0.494 -14.355 826 H VAL 97 H VAL 97 28.915 2.065 -17.061 827 HA VAL 97 HA VAL 97 26.991 4.224 -17.837 828 HB VAL 97 HB VAL 97 30.011 4.440 -18.155 829 HG11 VAL 97 HG11 VAL 97 27.770 6.410 -18.792 830 HG12 VAL 97 HG12 VAL 97 29.510 6.758 -18.886 831 HG13 VAL 97 HG13 VAL 97 28.798 5.571 -19.976 832 HG21 VAL 97 HG21 VAL 97 29.439 4.835 -15.804 833 HG22 VAL 97 HG22 VAL 97 29.842 6.362 -16.584 834 HG23 VAL 97 HG23 VAL 97 28.140 5.950 -16.281 835 H SER 98 H SER 98 29.661 2.132 -18.991 836 HA SER 98 HA SER 98 28.290 1.843 -21.630 837 HB2 SER 98 HB2 SER 98 31.257 1.704 -21.018 838 HB3 SER 98 HB3 SER 98 30.494 1.576 -22.617 839 HG SER 98 HG SER 98 31.252 3.697 -22.208 840 H SER 99 H SER 99 27.819 0.148 -19.262 841 HA SER 99 HA SER 99 27.622 -1.999 -18.614 842 HB2 SER 99 HB2 SER 99 26.416 -1.836 -20.879 843 HB3 SER 99 HB3 SER 99 27.733 -2.837 -21.509 844 HG SER 99 HG SER 99 25.942 -4.085 -20.762 845 H ALA 100 H ALA 100 30.258 -1.169 -18.380 846 HA ALA 100 HA ALA 100 32.072 -3.246 -19.333 847 HB1 ALA 100 HB1 ALA 100 32.472 -0.982 -17.336 848 HB2 ALA 100 HB2 ALA 100 33.748 -2.003 -18.031 849 HB3 ALA 100 HB3 ALA 100 32.814 -0.921 -19.082 850 H SER 101 H SER 101 32.474 -5.141 -18.410 851 HA SER 101 HA SER 101 32.201 -5.597 -15.483 852 HB2 SER 101 HB2 SER 101 30.811 -7.265 -17.624 853 HB3 SER 101 HB3 SER 101 31.008 -7.746 -15.930 854 HG SER 101 HG SER 101 28.963 -6.777 -16.341 855 H ALA 102 H ALA 102 34.091 -6.442 -14.873 856 HA ALA 102 HA ALA 102 36.116 -7.404 -14.865 857 HB1 ALA 102 HB1 ALA 102 34.773 -9.567 -16.506 858 HB2 ALA 102 HB2 ALA 102 36.211 -9.744 -15.479 859 HB3 ALA 102 HB3 ALA 102 34.640 -9.374 -14.741 860 H GLN 103 H GLN 103 35.631 -5.547 -17.097 861 HA GLN 103 HA GLN 103 37.850 -6.341 -18.932 862 HB2 GLN 103 HB2 GLN 103 35.245 -4.940 -19.553 863 HB3 GLN 103 HB3 GLN 103 36.633 -4.883 -20.635 864 HG2 GLN 103 HG2 GLN 103 35.289 -7.460 -19.713 865 HG3 GLN 103 HG3 GLN 103 34.946 -6.636 -21.224 866 HE21 GLN 103 HE21 GLN 103 37.360 -9.343 -22.011 867 HE22 GLN 103 HE22 GLN 103 35.720 -9.258 -21.382 868 HA PRO 104 HA PRO 104 39.248 -2.421 -17.016 869 HB2 PRO 104 HB2 PRO 104 41.888 -2.961 -16.760 870 HB3 PRO 104 HB3 PRO 104 40.658 -3.734 -15.723 871 HG2 PRO 104 HG2 PRO 104 41.932 -4.876 -18.233 872 HG3 PRO 104 HG3 PRO 104 41.770 -5.651 -16.625 873 HD2 PRO 104 HD2 PRO 104 39.995 -6.076 -18.671 874 HD3 PRO 104 HD3 PRO 104 39.489 -6.076 -16.955 875 H ASN 105 H ASN 105 38.386 -1.924 -19.305 876 HA ASN 105 HA ASN 105 40.577 -1.139 -21.183 877 HB2 ASN 105 HB2 ASN 105 38.918 -3.071 -21.727 878 HB3 ASN 105 HB3 ASN 105 37.740 -1.795 -22.019 879 HD21 ASN 105 HD21 ASN 105 39.524 -0.644 -24.989 880 HD22 ASN 105 HD22 ASN 105 38.643 -0.006 -23.593 881 H LEU 106 H LEU 106 39.917 0.587 -19.110 882 HA LEU 106 HA LEU 106 38.782 2.925 -20.550 883 HB2 LEU 106 HB2 LEU 106 38.100 1.988 -17.736 884 HB3 LEU 106 HB3 LEU 106 37.746 3.607 -18.314 885 HG LEU 106 HG LEU 106 36.608 1.061 -19.551 886 HD11 LEU 106 HD11 LEU 106 35.325 3.112 -17.700 887 HD12 LEU 106 HD12 LEU 106 34.508 1.731 -18.469 888 HD13 LEU 106 HD13 LEU 106 35.775 1.447 -17.266 889 HD21 LEU 106 HD21 LEU 106 36.674 2.912 -21.183 890 HD22 LEU 106 HD22 LEU 106 35.017 2.629 -20.650 891 HD23 LEU 106 HD23 LEU 106 35.929 4.008 -19.997 892 HA PRO 107 HA PRO 107 42.442 4.950 -19.092 893 HB2 PRO 107 HB2 PRO 107 41.721 7.589 -19.084 894 HB3 PRO 107 HB3 PRO 107 41.934 6.630 -20.581 895 HG2 PRO 107 HG2 PRO 107 39.346 7.236 -19.111 896 HG3 PRO 107 HG3 PRO 107 39.692 7.410 -20.862 897 HD2 PRO 107 HD2 PRO 107 38.442 5.213 -19.866 898 HD3 PRO 107 HD3 PRO 107 39.617 5.076 -21.205 Start of MODEL 20 1 H1 GLY -5 H1 GLY -5 -30.941 16.343 57.211 2 H2 GLY -5 H2 GLY -5 -32.509 16.806 57.285 3 H3 GLY -5 H3 GLY -5 -31.342 17.913 56.973 4 HA2 GLY -5 HA2 GLY -5 -32.521 17.386 54.948 5 HA3 GLY -5 HA3 GLY -5 -30.824 16.879 54.869 6 H SER -4 H SER -4 -31.763 15.508 53.123 7 HA SER -4 HA SER -4 -32.273 12.788 54.137 8 HB2 SER -4 HB2 SER -4 -34.535 13.841 53.733 9 HB3 SER -4 HB3 SER -4 -34.087 14.016 52.024 10 HG SER -4 HG SER -4 -35.272 12.064 52.530 11 H HIS -3 H HIS -3 -31.934 11.157 52.459 12 HA HIS -3 HA HIS -3 -30.100 12.052 50.253 13 HB2 HIS -3 HB2 HIS -3 -28.999 10.964 52.275 14 HB3 HIS -3 HB3 HIS -3 -29.809 9.470 51.813 15 HD2 HIS -3 HD2 HIS -3 -29.164 8.619 49.138 16 HE1 HIS -3 HE1 HIS -3 -25.319 10.470 49.217 17 HE2 HIS -3 HE2 HIS -3 -26.788 8.782 48.003 18 H MET -2 H MET -2 -30.911 11.695 48.349 19 HA MET -2 HA MET -2 -32.331 9.144 47.740 20 HB2 MET -2 HB2 MET -2 -33.256 11.942 46.966 21 HB3 MET -2 HB3 MET -2 -33.825 10.453 46.198 22 HG2 MET -2 HG2 MET -2 -34.631 9.629 48.391 23 HG3 MET -2 HG3 MET -2 -34.135 11.152 49.141 24 HE1 MET -2 HE1 MET -2 -36.616 11.260 50.147 25 HE2 MET -2 HE2 MET -2 -38.085 11.245 49.147 26 HE3 MET -2 HE3 MET -2 -37.079 9.785 49.266 27 H ALA -1 H ALA -1 -31.031 8.140 46.425 28 HA ALA -1 HA ALA -1 -30.189 9.424 43.897 29 HB1 ALA -1 HB1 ALA -1 -28.204 8.026 45.748 30 HB2 ALA -1 HB2 ALA -1 -27.882 8.559 44.082 31 HB3 ALA -1 HB3 ALA -1 -28.238 9.753 45.341 32 H SER 0 H SER 0 -29.713 6.316 45.652 33 HA SER 0 HA SER 0 -29.946 4.156 45.032 34 HB2 SER 0 HB2 SER 0 -32.483 5.191 43.762 35 HB3 SER 0 HB3 SER 0 -32.158 3.517 44.261 36 HG SER 0 HG SER 0 -33.337 4.671 45.861 37 H MET 1 H MET 1 -28.309 5.533 43.223 38 HA MET 1 HA MET 1 -28.228 3.631 41.036 39 HB2 MET 1 HB2 MET 1 -28.380 5.190 39.150 40 HB3 MET 1 HB3 MET 1 -29.858 5.176 40.092 41 HG2 MET 1 HG2 MET 1 -29.596 7.412 39.667 42 HG3 MET 1 HG3 MET 1 -28.922 7.281 41.282 43 HE1 MET 1 HE1 MET 1 -27.729 9.543 41.264 44 HE2 MET 1 HE2 MET 1 -26.778 10.164 39.897 45 HE3 MET 1 HE3 MET 1 -28.519 9.865 39.704 46 H ASP 2 H ASP 2 -26.772 6.272 42.635 47 HA ASP 2 HA ASP 2 -24.181 5.994 41.251 48 HB2 ASP 2 HB2 ASP 2 -25.238 8.194 41.843 49 HB3 ASP 2 HB3 ASP 2 -25.008 7.809 43.545 50 H GLN 3 H GLN 3 -25.605 4.410 43.806 51 HA GLN 3 HA GLN 3 -23.077 3.750 45.242 52 HB2 GLN 3 HB2 GLN 3 -24.247 5.757 46.187 53 HB3 GLN 3 HB3 GLN 3 -25.674 4.781 46.448 54 HG2 GLN 3 HG2 GLN 3 -23.493 3.429 47.769 55 HG3 GLN 3 HG3 GLN 3 -23.301 5.142 48.105 56 HE21 GLN 3 HE21 GLN 3 -26.808 3.313 49.370 57 HE22 GLN 3 HE22 GLN 3 -25.975 2.728 47.919 58 H LEU 4 H LEU 4 -24.523 2.115 43.376 59 HA LEU 4 HA LEU 4 -25.802 -0.004 45.071 60 HB2 LEU 4 HB2 LEU 4 -26.220 0.925 42.239 61 HB3 LEU 4 HB3 LEU 4 -26.451 -0.778 42.616 62 HG LEU 4 HG LEU 4 -28.144 -0.315 44.262 63 HD11 LEU 4 HD11 LEU 4 -27.677 2.625 43.652 64 HD12 LEU 4 HD12 LEU 4 -29.102 1.978 44.512 65 HD13 LEU 4 HD13 LEU 4 -27.501 1.807 45.224 66 HD21 LEU 4 HD21 LEU 4 -28.786 -0.520 41.885 67 HD22 LEU 4 HD22 LEU 4 -29.880 0.561 42.763 68 HD23 LEU 4 HD23 LEU 4 -28.638 1.240 41.690 69 H ASP 5 H ASP 5 -23.865 -0.781 45.856 70 HA ASP 5 HA ASP 5 -22.207 -2.391 43.939 71 HB2 ASP 5 HB2 ASP 5 -21.342 -0.832 46.402 72 HB3 ASP 5 HB3 ASP 5 -20.303 -1.918 45.485 73 H GLU 6 H GLU 6 -24.439 -2.796 46.350 74 HA GLU 6 HA GLU 6 -23.104 -5.166 47.593 75 HB2 GLU 6 HB2 GLU 6 -25.281 -3.277 48.506 76 HB3 GLU 6 HB3 GLU 6 -25.189 -4.930 49.160 77 HG2 GLU 6 HG2 GLU 6 -22.892 -4.660 49.767 78 HG3 GLU 6 HG3 GLU 6 -22.842 -3.028 49.081 79 H ILE 7 H ILE 7 -23.313 -6.591 45.929 80 HA ILE 7 HA ILE 7 -26.037 -7.720 45.730 81 HB ILE 7 HB ILE 7 -24.252 -7.688 43.270 82 HG12 ILE 7 HG12 ILE 7 -26.135 -5.895 42.512 83 HG13 ILE 7 HG13 ILE 7 -26.032 -5.443 44.205 84 HG21 ILE 7 HG21 ILE 7 -27.252 -8.057 43.646 85 HG22 ILE 7 HG22 ILE 7 -26.368 -8.156 42.108 86 HG23 ILE 7 HG23 ILE 7 -26.070 -9.355 43.364 87 HD11 ILE 7 HD11 ILE 7 -23.765 -5.519 42.166 88 HD12 ILE 7 HD12 ILE 7 -24.515 -4.079 42.884 89 HD13 ILE 7 HD13 ILE 7 -23.525 -5.159 43.885 90 H ILE 8 H ILE 8 -22.559 -8.388 45.133 91 HA ILE 8 HA ILE 8 -22.852 -11.081 46.265 92 HB ILE 8 HB ILE 8 -23.440 -11.325 43.884 93 HG12 ILE 8 HG12 ILE 8 -20.772 -12.660 44.465 94 HG13 ILE 8 HG13 ILE 8 -22.301 -13.128 45.218 95 HG21 ILE 8 HG21 ILE 8 -20.590 -10.466 43.219 96 HG22 ILE 8 HG22 ILE 8 -21.845 -10.990 42.080 97 HG23 ILE 8 HG23 ILE 8 -22.038 -9.473 42.950 98 HD11 ILE 8 HD11 ILE 8 -21.645 -13.262 42.247 99 HD12 ILE 8 HD12 ILE 8 -21.844 -14.613 43.372 100 HD13 ILE 8 HD13 ILE 8 -23.244 -13.607 42.952 101 H GLU 9 H GLU 9 -20.907 -12.026 46.938 102 HA GLU 9 HA GLU 9 -18.513 -10.229 47.060 103 HB2 GLU 9 HB2 GLU 9 -19.458 -12.288 49.091 104 HB3 GLU 9 HB3 GLU 9 -17.938 -11.410 49.141 105 HG2 GLU 9 HG2 GLU 9 -19.321 -10.268 50.640 106 HG3 GLU 9 HG3 GLU 9 -19.220 -9.244 49.215 107 H GLN 10 H GLN 10 -16.456 -11.145 46.832 108 HA GLN 10 HA GLN 10 -16.149 -13.951 46.002 109 HB2 GLN 10 HB2 GLN 10 -16.938 -12.615 43.993 110 HB3 GLN 10 HB3 GLN 10 -15.462 -11.661 44.102 111 HG2 GLN 10 HG2 GLN 10 -14.111 -13.701 43.666 112 HG3 GLN 10 HG3 GLN 10 -15.577 -14.690 43.699 113 HE21 GLN 10 HE21 GLN 10 -16.620 -13.653 40.403 114 HE22 GLN 10 HE22 GLN 10 -17.210 -14.303 41.927 115 H ILE 11 H ILE 11 -13.889 -14.586 45.846 116 HA ILE 11 HA ILE 11 -12.211 -13.137 47.765 117 HB ILE 11 HB ILE 11 -10.774 -15.184 47.608 118 HG12 ILE 11 HG12 ILE 11 -13.133 -16.436 46.113 119 HG13 ILE 11 HG13 ILE 11 -11.644 -15.957 45.307 120 HG21 ILE 11 HG21 ILE 11 -13.713 -15.522 48.362 121 HG22 ILE 11 HG22 ILE 11 -12.341 -16.428 49.042 122 HG23 ILE 11 HG23 ILE 11 -12.488 -14.691 49.335 123 HD11 ILE 11 HD11 ILE 11 -11.886 -18.056 47.496 124 HD12 ILE 11 HD12 ILE 11 -11.562 -18.319 45.775 125 HD13 ILE 11 HD13 ILE 11 -10.352 -17.499 46.780 126 H GLN 12 H GLN 12 -11.787 -11.258 46.538 127 HA GLN 12 HA GLN 12 -9.373 -11.421 44.893 128 HB2 GLN 12 HB2 GLN 12 -10.571 -9.968 43.099 129 HB3 GLN 12 HB3 GLN 12 -10.726 -11.710 43.080 130 HG2 GLN 12 HG2 GLN 12 -12.841 -10.783 42.531 131 HG3 GLN 12 HG3 GLN 12 -12.988 -11.570 44.084 132 HE21 GLN 12 HE21 GLN 12 -13.965 -8.514 45.701 133 HE22 GLN 12 HE22 GLN 12 -13.668 -10.232 45.931 134 H LYS 13 H LYS 13 -8.405 -9.336 44.479 135 HA LYS 13 HA LYS 13 -8.944 -7.392 46.676 136 HB2 LYS 13 HB2 LYS 13 -6.489 -7.833 44.937 137 HB3 LYS 13 HB3 LYS 13 -6.698 -6.480 46.058 138 HG2 LYS 13 HG2 LYS 13 -7.081 -8.137 47.920 139 HG3 LYS 13 HG3 LYS 13 -6.605 -9.429 46.797 140 HD2 LYS 13 HD2 LYS 13 -4.400 -8.344 46.476 141 HD3 LYS 13 HD3 LYS 13 -4.898 -7.002 47.528 142 HE2 LYS 13 HE2 LYS 13 -5.227 -8.634 49.401 143 HE3 LYS 13 HE3 LYS 13 -4.611 -9.923 48.357 144 HZ1 LYS 13 HZ1 LYS 13 -3.083 -7.505 49.178 145 HZ2 LYS 13 HZ2 LYS 13 -2.855 -9.008 49.768 146 HZ3 LYS 13 HZ3 LYS 13 -2.505 -8.687 48.206 147 H GLU 14 H GLU 14 -10.950 -7.015 45.280 148 HA GLU 14 HA GLU 14 -10.414 -4.476 43.858 149 HB2 GLU 14 HB2 GLU 14 -11.177 -6.762 42.449 150 HB3 GLU 14 HB3 GLU 14 -12.711 -5.913 42.721 151 HG2 GLU 14 HG2 GLU 14 -11.744 -3.868 41.736 152 HG3 GLU 14 HG3 GLU 14 -10.203 -4.710 41.512 153 H ALA 15 H ALA 15 -11.715 -2.894 44.318 154 HA ALA 15 HA ALA 15 -14.263 -3.251 45.805 155 HB1 ALA 15 HB1 ALA 15 -11.914 -1.592 46.813 156 HB2 ALA 15 HB2 ALA 15 -13.564 -1.565 47.480 157 HB3 ALA 15 HB3 ALA 15 -12.595 -3.048 47.558 158 H ILE 16 H ILE 16 -12.307 -0.367 45.189 159 HA ILE 16 HA ILE 16 -14.426 0.684 43.377 160 HB ILE 16 HB ILE 16 -12.943 1.882 45.713 161 HG12 ILE 16 HG12 ILE 16 -15.922 1.726 45.071 162 HG13 ILE 16 HG13 ILE 16 -15.048 0.635 46.142 163 HG21 ILE 16 HG21 ILE 16 -14.585 3.487 43.702 164 HG22 ILE 16 HG22 ILE 16 -13.936 4.115 45.235 165 HG23 ILE 16 HG23 ILE 16 -12.830 3.627 43.970 166 HD11 ILE 16 HD11 ILE 16 -15.592 3.575 46.639 167 HD12 ILE 16 HD12 ILE 16 -16.201 2.174 47.525 168 HD13 ILE 16 HD13 ILE 16 -14.478 2.588 47.621 169 H ASN 17 H ASN 17 -11.330 -0.207 43.357 170 HA ASN 17 HA ASN 17 -10.250 1.984 41.826 171 HB2 ASN 17 HB2 ASN 17 -9.138 -0.834 42.242 172 HB3 ASN 17 HB3 ASN 17 -8.233 0.524 41.583 173 HD21 ASN 17 HD21 ASN 17 -8.375 0.134 45.553 174 HD22 ASN 17 HD22 ASN 17 -8.836 -1.145 44.441 175 H SER 18 H SER 18 -12.177 -0.642 40.869 176 HA SER 18 HA SER 18 -11.236 -0.689 38.058 177 HB2 SER 18 HB2 SER 18 -11.805 -2.785 39.153 178 HB3 SER 18 HB3 SER 18 -13.466 -2.223 39.426 179 HG SER 18 HG SER 18 -13.232 -3.531 37.537 180 H ASN 19 H ASN 19 -14.365 0.071 39.745 181 HA ASN 19 HA ASN 19 -15.539 0.962 37.296 182 HB2 ASN 19 HB2 ASN 19 -17.493 1.456 38.559 183 HB3 ASN 19 HB3 ASN 19 -16.804 -0.018 39.217 184 HD21 ASN 19 HD21 ASN 19 -16.472 1.408 42.445 185 HD22 ASN 19 HD22 ASN 19 -16.319 -0.035 41.459 186 H VAL 20 H VAL 20 -13.536 2.649 39.461 187 HA VAL 20 HA VAL 20 -14.302 5.341 38.501 188 HB VAL 20 HB VAL 20 -12.127 4.413 40.406 189 HG11 VAL 20 HG11 VAL 20 -12.992 7.250 39.700 190 HG12 VAL 20 HG12 VAL 20 -11.957 6.810 41.076 191 HG13 VAL 20 HG13 VAL 20 -11.386 6.534 39.434 192 HG21 VAL 20 HG21 VAL 20 -14.437 4.168 41.288 193 HG22 VAL 20 HG22 VAL 20 -13.578 5.462 42.123 194 HG23 VAL 20 HG23 VAL 20 -14.781 5.858 40.875 195 H VAL 21 H VAL 21 -11.969 2.858 37.664 196 HA VAL 21 HA VAL 21 -10.681 4.666 35.663 197 HB VAL 21 HB VAL 21 -9.115 2.685 37.357 198 HG11 VAL 21 HG11 VAL 21 -8.253 4.936 35.476 199 HG12 VAL 21 HG12 VAL 21 -7.172 3.880 36.412 200 HG13 VAL 21 HG13 VAL 21 -8.155 3.198 35.114 201 HG21 VAL 21 HG21 VAL 21 -9.796 4.477 38.863 202 HG22 VAL 21 HG22 VAL 21 -8.099 4.681 38.442 203 HG23 VAL 21 HG23 VAL 21 -9.324 5.709 37.666 204 H LEU 22 H LEU 22 -12.193 3.727 34.222 205 HA LEU 22 HA LEU 22 -11.394 1.044 33.206 206 HB2 LEU 22 HB2 LEU 22 -13.607 1.201 34.628 207 HB3 LEU 22 HB3 LEU 22 -14.268 2.014 33.222 208 HG LEU 22 HG LEU 22 -13.642 -0.046 31.861 209 HD11 LEU 22 HD11 LEU 22 -13.142 -1.223 34.633 210 HD12 LEU 22 HD12 LEU 22 -13.288 -2.163 33.134 211 HD13 LEU 22 HD13 LEU 22 -11.934 -1.051 33.345 212 HD21 LEU 22 HD21 LEU 22 -15.931 0.329 32.669 213 HD22 LEU 22 HD22 LEU 22 -15.526 -1.394 32.699 214 HD23 LEU 22 HD23 LEU 22 -15.529 -0.461 34.211 215 H LYS 23 H LYS 23 -11.536 0.713 30.989 216 HA LYS 23 HA LYS 23 -11.890 3.141 29.265 217 HB2 LYS 23 HB2 LYS 23 -9.759 0.985 29.026 218 HB3 LYS 23 HB3 LYS 23 -10.016 2.329 27.904 219 HG2 LYS 23 HG2 LYS 23 -9.625 3.935 29.806 220 HG3 LYS 23 HG3 LYS 23 -9.166 2.550 30.818 221 HD2 LYS 23 HD2 LYS 23 -7.365 1.975 29.194 222 HD3 LYS 23 HD3 LYS 23 -7.825 3.379 28.205 223 HE2 LYS 23 HE2 LYS 23 -7.367 4.872 30.160 224 HE3 LYS 23 HE3 LYS 23 -6.841 3.465 31.093 225 HZ1 LYS 23 HZ1 LYS 23 -5.561 4.433 28.590 226 HZ2 LYS 23 HZ2 LYS 23 -4.951 4.609 30.092 227 HZ3 LYS 23 HZ3 LYS 23 -5.076 3.121 29.436 228 H ASN 24 H ASN 24 -14.031 1.565 29.688 229 HA ASN 24 HA ASN 24 -15.705 0.374 28.709 230 HB2 ASN 24 HB2 ASN 24 -15.422 2.613 27.486 231 HB3 ASN 24 HB3 ASN 24 -14.758 1.675 26.143 232 HD21 ASN 24 HD21 ASN 24 -17.931 0.253 25.266 233 HD22 ASN 24 HD22 ASN 24 -16.188 -0.070 25.273 234 HA PRO 25 HA PRO 25 -13.009 -3.044 26.961 235 HB2 PRO 25 HB2 PRO 25 -13.463 -4.998 28.814 236 HB3 PRO 25 HB3 PRO 25 -12.276 -3.683 29.042 237 HG2 PRO 25 HG2 PRO 25 -15.134 -3.782 30.073 238 HG3 PRO 25 HG3 PRO 25 -13.637 -3.418 30.992 239 HD2 PRO 25 HD2 PRO 25 -15.202 -1.434 30.010 240 HD3 PRO 25 HD3 PRO 25 -13.416 -1.300 29.979 241 H ARG 26 H ARG 26 -14.461 -2.925 25.249 242 HA ARG 26 HA ARG 26 -16.638 -4.989 25.190 243 HB2 ARG 26 HB2 ARG 26 -16.585 -2.114 24.337 244 HB3 ARG 26 HB3 ARG 26 -17.393 -3.207 23.236 245 HG2 ARG 26 HG2 ARG 26 -18.106 -3.218 26.192 246 HG3 ARG 26 HG3 ARG 26 -18.776 -2.029 25.074 247 HD2 ARG 26 HD2 ARG 26 -20.375 -3.785 25.154 248 HD3 ARG 26 HD3 ARG 26 -19.572 -3.849 23.588 249 HE ARG 26 HE ARG 26 -18.750 -5.945 24.071 250 HH11 ARG 26 HH11 ARG 26 -18.456 -7.820 25.202 251 HH12 ARG 26 HH12 ARG 26 -18.875 -7.898 26.888 252 HH21 ARG 26 HH21 ARG 26 -19.913 -4.638 27.111 253 HH22 ARG 26 HH22 ARG 26 -19.671 -6.145 27.949 254 H VAL 27 H VAL 27 -14.432 -3.218 23.131 255 HA VAL 27 HA VAL 27 -13.395 -3.650 21.159 256 HB VAL 27 HB VAL 27 -12.983 -6.290 22.524 257 HG11 VAL 27 HG11 VAL 27 -11.336 -4.881 20.352 258 HG12 VAL 27 HG12 VAL 27 -10.841 -6.351 21.221 259 HG13 VAL 27 HG13 VAL 27 -12.227 -6.399 20.135 260 HG21 VAL 27 HG21 VAL 27 -12.290 -4.433 23.956 261 HG22 VAL 27 HG22 VAL 27 -10.868 -5.245 23.311 262 HG23 VAL 27 HG23 VAL 27 -11.386 -3.698 22.610 263 HA PRO 28 HA PRO 28 -16.940 -5.636 18.976 264 HB2 PRO 28 HB2 PRO 28 -17.151 -3.847 16.904 265 HB3 PRO 28 HB3 PRO 28 -17.851 -3.578 18.528 266 HG2 PRO 28 HG2 PRO 28 -15.186 -2.575 17.471 267 HG3 PRO 28 HG3 PRO 28 -16.474 -1.634 18.294 268 HD2 PRO 28 HD2 PRO 28 -14.325 -2.574 19.629 269 HD3 PRO 28 HD3 PRO 28 -15.944 -2.599 20.394 270 H THR 29 H THR 29 -17.149 -6.605 16.859 271 HA THR 29 HA THR 29 -14.520 -7.559 15.831 272 HB THR 29 HB THR 29 -15.461 -9.176 17.246 273 HG1 THR 29 HG1 THR 29 -15.517 -10.872 15.783 274 HG21 THR 29 HG21 THR 29 -17.967 -9.278 15.519 275 HG22 THR 29 HG22 THR 29 -17.549 -10.353 16.864 276 HG23 THR 29 HG23 THR 29 -17.868 -8.644 17.175 277 H GLN 30 H GLN 30 -14.519 -5.937 14.360 278 HA GLN 30 HA GLN 30 -16.336 -6.197 12.008 279 HB2 GLN 30 HB2 GLN 30 -14.545 -3.946 12.949 280 HB3 GLN 30 HB3 GLN 30 -15.432 -3.905 11.422 281 HG2 GLN 30 HG2 GLN 30 -17.534 -3.825 12.422 282 HG3 GLN 30 HG3 GLN 30 -16.969 -4.459 13.968 283 HE21 GLN 30 HE21 GLN 30 -15.555 -1.335 15.087 284 HE22 GLN 30 HE22 GLN 30 -15.219 -3.067 15.075 285 H LYS 31 H LYS 31 -14.312 -8.099 12.444 286 HA LYS 31 HA LYS 31 -11.967 -7.618 10.853 287 HB2 LYS 31 HB2 LYS 31 -12.587 -9.286 12.922 288 HB3 LYS 31 HB3 LYS 31 -12.811 -10.409 11.606 289 HG2 LYS 31 HG2 LYS 31 -10.589 -10.785 11.950 290 HG3 LYS 31 HG3 LYS 31 -10.382 -9.409 10.870 291 HD2 LYS 31 HD2 LYS 31 -10.338 -9.410 13.922 292 HD3 LYS 31 HD3 LYS 31 -8.953 -9.189 12.846 293 HE2 LYS 31 HE2 LYS 31 -9.904 -7.053 12.029 294 HE3 LYS 31 HE3 LYS 31 -11.329 -7.279 13.054 295 HZ1 LYS 31 HZ1 LYS 31 -8.547 -6.976 14.060 296 HZ2 LYS 31 HZ2 LYS 31 -9.701 -5.825 14.121 297 HZ3 LYS 31 HZ3 LYS 31 -9.863 -7.188 15.003 298 H THR 32 H THR 32 -14.196 -7.163 9.226 299 HA THR 32 HA THR 32 -14.086 -9.325 7.157 300 HB THR 32 HB THR 32 -15.893 -9.646 8.815 301 HG1 THR 32 HG1 THR 32 -17.485 -10.052 7.319 302 HG21 THR 32 HG21 THR 32 -17.117 -7.114 7.648 303 HG22 THR 32 HG22 THR 32 -17.892 -8.242 8.782 304 HG23 THR 32 HG23 THR 32 -16.481 -7.309 9.299 305 H GLY 33 H GLY 33 -13.191 -6.332 7.355 306 HA2 GLY 33 HA2 GLY 33 -14.186 -5.517 4.654 307 HA3 GLY 33 HA3 GLY 33 -14.438 -4.447 6.031 308 H GLU 34 H GLU 34 -11.437 -6.317 5.699 309 HA GLU 34 HA GLU 34 -9.910 -3.852 5.909 310 HB2 GLU 34 HB2 GLU 34 -8.999 -6.733 5.605 311 HB3 GLU 34 HB3 GLU 34 -7.945 -5.352 5.944 312 HG2 GLU 34 HG2 GLU 34 -9.231 -4.897 8.035 313 HG3 GLU 34 HG3 GLU 34 -10.213 -6.333 7.734 314 H LEU 35 H LEU 35 -10.029 -6.353 3.347 315 HA LEU 35 HA LEU 35 -9.560 -4.377 1.266 316 HB2 LEU 35 HB2 LEU 35 -7.697 -6.765 1.694 317 HB3 LEU 35 HB3 LEU 35 -7.944 -5.970 0.151 318 HG LEU 35 HG LEU 35 -7.293 -3.775 1.566 319 HD11 LEU 35 HD11 LEU 35 -5.674 -6.021 2.861 320 HD12 LEU 35 HD12 LEU 35 -5.394 -4.278 3.057 321 HD13 LEU 35 HD13 LEU 35 -6.868 -5.014 3.696 322 HD21 LEU 35 HD21 LEU 35 -6.210 -4.564 -0.518 323 HD22 LEU 35 HD22 LEU 35 -5.009 -4.061 0.673 324 HD23 LEU 35 HD23 LEU 35 -5.328 -5.788 0.401 325 H SER 36 H SER 36 -10.592 -4.889 -0.488 326 HA SER 36 HA SER 36 -11.914 -7.555 -0.861 327 HB2 SER 36 HB2 SER 36 -13.034 -4.837 -1.560 328 HB3 SER 36 HB3 SER 36 -13.773 -6.406 -1.936 329 HG SER 36 HG SER 36 -14.637 -5.489 -0.019 330 H GLU 37 H GLU 37 -11.175 -4.736 -2.834 331 HA GLU 37 HA GLU 37 -9.803 -6.368 -4.836 332 HB2 GLU 37 HB2 GLU 37 -12.582 -6.506 -4.855 333 HB3 GLU 37 HB3 GLU 37 -12.319 -5.095 -5.885 334 HG2 GLU 37 HG2 GLU 37 -10.524 -6.571 -7.060 335 HG3 GLU 37 HG3 GLU 37 -11.257 -7.908 -6.154 336 H GLU 38 H GLU 38 -11.683 -3.409 -4.293 337 HA GLU 38 HA GLU 38 -10.186 -1.760 -6.082 338 HB2 GLU 38 HB2 GLU 38 -12.512 -1.474 -4.583 339 HB3 GLU 38 HB3 GLU 38 -11.391 -0.451 -3.697 340 HG2 GLU 38 HG2 GLU 38 -12.331 1.007 -5.231 341 HG3 GLU 38 HG3 GLU 38 -10.812 0.589 -6.021 342 H GLN 39 H GLN 39 -9.638 -2.705 -2.721 343 HA GLN 39 HA GLN 39 -7.613 -0.738 -2.116 344 HB2 GLN 39 HB2 GLN 39 -8.173 -3.449 -0.871 345 HB3 GLN 39 HB3 GLN 39 -7.107 -2.196 -0.227 346 HG2 GLN 39 HG2 GLN 39 -9.077 -1.915 0.994 347 HG3 GLN 39 HG3 GLN 39 -9.132 -0.630 -0.203 348 HE21 GLN 39 HE21 GLN 39 -12.534 -1.892 -0.316 349 HE22 GLN 39 HE22 GLN 39 -11.509 -0.776 0.587 350 H LYS 40 H LYS 40 -7.444 -3.978 -3.601 351 HA LYS 40 HA LYS 40 -4.521 -4.006 -3.695 352 HB2 LYS 40 HB2 LYS 40 -6.635 -5.501 -5.306 353 HB3 LYS 40 HB3 LYS 40 -4.909 -5.815 -5.465 354 HG2 LYS 40 HG2 LYS 40 -4.716 -6.899 -3.493 355 HG3 LYS 40 HG3 LYS 40 -5.849 -5.857 -2.658 356 HD2 LYS 40 HD2 LYS 40 -7.534 -7.237 -4.425 357 HD3 LYS 40 HD3 LYS 40 -6.355 -8.465 -3.984 358 HE2 LYS 40 HE2 LYS 40 -7.790 -6.658 -1.985 359 HE3 LYS 40 HE3 LYS 40 -8.481 -8.187 -2.532 360 HZ1 LYS 40 HZ1 LYS 40 -5.863 -7.959 -1.133 361 HZ2 LYS 40 HZ2 LYS 40 -7.248 -8.540 -0.474 362 HZ3 LYS 40 HZ3 LYS 40 -6.518 -9.349 -1.681 363 H LYS 41 H LYS 41 -7.057 -2.879 -5.819 364 HA LYS 41 HA LYS 41 -5.271 -1.950 -7.910 365 HB2 LYS 41 HB2 LYS 41 -8.037 -0.899 -7.250 366 HB3 LYS 41 HB3 LYS 41 -7.165 -0.624 -8.751 367 HG2 LYS 41 HG2 LYS 41 -7.302 -2.955 -9.384 368 HG3 LYS 41 HG3 LYS 41 -7.899 -3.415 -7.794 369 HD2 LYS 41 HD2 LYS 41 -9.854 -1.706 -8.342 370 HD3 LYS 41 HD3 LYS 41 -9.374 -2.007 -10.017 371 HE2 LYS 41 HE2 LYS 41 -9.751 -4.414 -9.731 372 HE3 LYS 41 HE3 LYS 41 -9.944 -4.210 -7.985 373 HZ1 LYS 41 HZ1 LYS 41 -11.822 -3.214 -10.044 374 HZ2 LYS 41 HZ2 LYS 41 -12.095 -4.409 -8.949 375 HZ3 LYS 41 HZ3 LYS 41 -11.935 -2.839 -8.453 376 H ILE 42 H ILE 42 -5.383 -0.852 -4.793 377 HA ILE 42 HA ILE 42 -4.113 1.767 -5.509 378 HB ILE 42 HB ILE 42 -5.485 0.771 -3.010 379 HG12 ILE 42 HG12 ILE 42 -6.215 3.368 -4.352 380 HG13 ILE 42 HG13 ILE 42 -6.666 1.895 -5.197 381 HG21 ILE 42 HG21 ILE 42 -4.005 3.415 -3.308 382 HG22 ILE 42 HG22 ILE 42 -5.068 2.948 -1.965 383 HG23 ILE 42 HG23 ILE 42 -3.579 2.076 -2.214 384 HD11 ILE 42 HD11 ILE 42 -7.442 2.518 -2.329 385 HD12 ILE 42 HD12 ILE 42 -8.496 2.565 -3.767 386 HD13 ILE 42 HD13 ILE 42 -7.797 1.037 -3.204 387 H VAL 43 H VAL 43 -3.524 -1.362 -3.920 388 HA VAL 43 HA VAL 43 -0.805 -0.413 -3.106 389 HB VAL 43 HB VAL 43 -2.293 -2.876 -2.151 390 HG11 VAL 43 HG11 VAL 43 0.300 -1.534 -1.244 391 HG12 VAL 43 HG12 VAL 43 -0.521 -2.845 -0.375 392 HG13 VAL 43 HG13 VAL 43 0.148 -3.144 -1.975 393 HG21 VAL 43 HG21 VAL 43 -3.427 -0.856 -1.347 394 HG22 VAL 43 HG22 VAL 43 -2.509 -1.569 -0.024 395 HG23 VAL 43 HG23 VAL 43 -1.877 -0.147 -0.875 396 H ALA 44 H ALA 44 -2.230 -3.417 -4.522 397 HA ALA 44 HA ALA 44 0.312 -4.472 -5.365 398 HB1 ALA 44 HB1 ALA 44 -2.520 -5.076 -6.346 399 HB2 ALA 44 HB2 ALA 44 -1.085 -6.096 -6.570 400 HB3 ALA 44 HB3 ALA 44 -1.734 -5.836 -4.939 401 H ASP 45 H ASP 45 -2.241 -2.602 -7.016 402 HA ASP 45 HA ASP 45 -0.927 -2.450 -9.580 403 HB2 ASP 45 HB2 ASP 45 -3.323 -1.960 -9.157 404 HB3 ASP 45 HB3 ASP 45 -2.854 -0.487 -8.298 405 H TYR 46 H TYR 46 -0.651 -0.340 -6.699 406 HA TYR 46 HA TYR 46 0.992 1.658 -7.954 407 HB2 TYR 46 HB2 TYR 46 -0.452 2.040 -6.039 408 HB3 TYR 46 HB3 TYR 46 0.483 0.905 -5.059 409 HD1 TYR 46 HD1 TYR 46 2.143 3.408 -7.284 410 HD2 TYR 46 HD2 TYR 46 0.866 2.423 -3.283 411 HE1 TYR 46 HE1 TYR 46 3.373 5.348 -6.420 412 HE2 TYR 46 HE2 TYR 46 2.135 4.425 -2.394 413 HH TYR 46 HH TYR 46 3.965 6.578 -4.576 414 H ILE 47 H ILE 47 1.740 -1.316 -6.139 415 HA ILE 47 HA ILE 47 4.584 -1.081 -6.112 416 HB ILE 47 HB ILE 47 2.511 -3.153 -5.718 417 HG12 ILE 47 HG12 ILE 47 4.341 -4.104 -4.211 418 HG13 ILE 47 HG13 ILE 47 5.340 -2.761 -4.761 419 HG21 ILE 47 HG21 ILE 47 5.052 -4.236 -6.981 420 HG22 ILE 47 HG22 ILE 47 3.775 -5.173 -6.186 421 HG23 ILE 47 HG23 ILE 47 3.412 -4.312 -7.676 422 HD11 ILE 47 HD11 ILE 47 2.758 -2.609 -3.170 423 HD12 ILE 47 HD12 ILE 47 4.409 -2.168 -2.653 424 HD13 ILE 47 HD13 ILE 47 3.547 -1.187 -3.864 425 H SER 48 H SER 48 2.411 -1.756 -8.786 426 HA SER 48 HA SER 48 4.534 -2.603 -10.605 427 HB2 SER 48 HB2 SER 48 1.986 -3.141 -10.694 428 HB3 SER 48 HB3 SER 48 1.846 -1.567 -11.504 429 HG SER 48 HG SER 48 2.156 -3.313 -12.979 430 H GLU 49 H GLU 49 3.481 0.507 -9.435 431 HA GLU 49 HA GLU 49 4.572 1.979 -11.770 432 HB2 GLU 49 HB2 GLU 49 3.363 2.945 -9.150 433 HB3 GLU 49 HB3 GLU 49 3.825 3.970 -10.504 434 HG2 GLU 49 HG2 GLU 49 1.680 1.817 -10.562 435 HG3 GLU 49 HG3 GLU 49 1.385 3.525 -10.297 436 H VAL 50 H VAL 50 5.161 1.516 -8.292 437 HA VAL 50 HA VAL 50 7.676 3.085 -8.503 438 HB VAL 50 HB VAL 50 5.914 2.279 -6.183 439 HG11 VAL 50 HG11 VAL 50 8.471 3.910 -6.260 440 HG12 VAL 50 HG12 VAL 50 7.308 3.967 -4.922 441 HG13 VAL 50 HG13 VAL 50 8.112 2.439 -5.293 442 HG21 VAL 50 HG21 VAL 50 4.868 3.920 -7.544 443 HG22 VAL 50 HG22 VAL 50 5.512 4.739 -6.108 444 HG23 VAL 50 HG23 VAL 50 6.364 4.891 -7.662 445 H GLY 51 H GLY 51 6.653 -0.023 -7.019 446 HA2 GLY 51 HA2 GLY 51 8.550 -1.666 -7.976 447 HA3 GLY 51 HA3 GLY 51 9.499 -0.862 -6.722 448 H LEU 52 H LEU 52 8.622 -0.866 -4.580 449 HA LEU 52 HA LEU 52 6.968 -2.910 -3.496 450 HB2 LEU 52 HB2 LEU 52 8.764 -4.376 -4.576 451 HB3 LEU 52 HB3 LEU 52 9.958 -3.634 -3.535 452 HG LEU 52 HG LEU 52 7.611 -4.632 -2.064 453 HD11 LEU 52 HD11 LEU 52 9.321 -6.626 -3.619 454 HD12 LEU 52 HD12 LEU 52 8.160 -7.044 -2.347 455 HD13 LEU 52 HD13 LEU 52 7.581 -6.322 -3.850 456 HD21 LEU 52 HD21 LEU 52 9.683 -4.042 -0.904 457 HD22 LEU 52 HD22 LEU 52 9.288 -5.742 -0.657 458 HD23 LEU 52 HD23 LEU 52 10.567 -5.296 -1.810 459 H ASN 53 H ASN 53 9.894 -1.229 -3.067 460 HA ASN 53 HA ASN 53 9.390 -0.764 -0.171 461 HB2 ASN 53 HB2 ASN 53 11.629 -1.149 0.238 462 HB3 ASN 53 HB3 ASN 53 11.290 -2.281 -1.067 463 HD21 ASN 53 HD21 ASN 53 13.506 -0.651 -3.342 464 HD22 ASN 53 HD22 ASN 53 12.265 -1.882 -3.180 465 H ASN 54 H ASN 54 9.482 1.071 -2.996 466 HA ASN 54 HA ASN 54 10.656 3.456 -1.636 467 HB2 ASN 54 HB2 ASN 54 10.033 3.613 -4.538 468 HB3 ASN 54 HB3 ASN 54 11.364 4.263 -3.630 469 HD21 ASN 54 HD21 ASN 54 11.783 0.736 -5.554 470 HD22 ASN 54 HD22 ASN 54 10.305 1.660 -5.680 471 H LEU 55 H LEU 55 7.612 2.275 -2.026 472 HA LEU 55 HA LEU 55 6.095 4.395 -3.110 473 HB2 LEU 55 HB2 LEU 55 5.203 2.201 -1.204 474 HB3 LEU 55 HB3 LEU 55 4.202 3.089 -2.328 475 HG LEU 55 HG LEU 55 6.282 1.932 -3.905 476 HD11 LEU 55 HD11 LEU 55 5.046 -0.053 -1.985 477 HD12 LEU 55 HD12 LEU 55 6.054 -0.437 -3.402 478 HD13 LEU 55 HD13 LEU 55 6.747 0.432 -2.013 479 HD21 LEU 55 HD21 LEU 55 4.025 2.348 -4.659 480 HD22 LEU 55 HD22 LEU 55 4.477 0.669 -4.904 481 HD23 LEU 55 HD23 LEU 55 3.393 1.102 -3.554 482 H ASN 56 H ASN 56 4.425 5.717 -2.149 483 HA ASN 56 HA ASN 56 5.187 6.916 0.422 484 HB2 ASN 56 HB2 ASN 56 3.113 7.513 -1.714 485 HB3 ASN 56 HB3 ASN 56 3.363 8.514 -0.275 486 HD21 ASN 56 HD21 ASN 56 6.539 9.754 -1.470 487 HD22 ASN 56 HD22 ASN 56 5.733 9.236 0.011 488 H ALA 57 H ALA 57 4.591 5.612 2.108 489 HA ALA 57 HA ALA 57 2.195 4.103 2.377 490 HB1 ALA 57 HB1 ALA 57 3.928 5.492 4.468 491 HB2 ALA 57 HB2 ALA 57 2.749 4.206 4.787 492 HB3 ALA 57 HB3 ALA 57 4.182 3.859 3.806 493 H THR 58 H THR 58 2.759 7.557 2.695 494 HA THR 58 HA THR 58 0.367 8.471 3.871 495 HB THR 58 HB THR 58 1.974 9.732 1.618 496 HG1 THR 58 HG1 THR 58 3.127 10.690 3.314 497 HG21 THR 58 HG21 THR 58 0.165 10.937 3.752 498 HG22 THR 58 HG22 THR 58 1.285 11.877 2.734 499 HG23 THR 58 HG23 THR 58 -0.042 10.991 1.983 500 H GLU 59 H GLU 59 1.012 7.747 0.375 501 HA GLU 59 HA GLU 59 -1.651 8.414 -0.498 502 HB2 GLU 59 HB2 GLU 59 0.431 6.573 -1.761 503 HB3 GLU 59 HB3 GLU 59 -1.100 7.046 -2.499 504 HG2 GLU 59 HG2 GLU 59 -0.148 9.519 -1.904 505 HG3 GLU 59 HG3 GLU 59 1.382 8.651 -2.032 506 H LEU 60 H LEU 60 -0.261 5.316 0.662 507 HA LEU 60 HA LEU 60 -2.668 3.782 0.255 508 HB2 LEU 60 HB2 LEU 60 -0.321 3.463 2.154 509 HB3 LEU 60 HB3 LEU 60 -1.723 2.405 2.202 510 HG LEU 60 HG LEU 60 -1.313 1.904 -0.266 511 HD11 LEU 60 HD11 LEU 60 1.386 3.147 0.409 512 HD12 LEU 60 HD12 LEU 60 1.082 2.082 -0.974 513 HD13 LEU 60 HD13 LEU 60 0.270 3.649 -0.880 514 HD21 LEU 60 HD21 LEU 60 -0.866 0.314 1.528 515 HD22 LEU 60 HD22 LEU 60 0.462 0.239 0.361 516 HD23 LEU 60 HD23 LEU 60 0.675 1.112 1.899 517 H SER 61 H SER 61 -1.554 5.562 3.218 518 HA SER 61 HA SER 61 -3.846 4.878 4.772 519 HB2 SER 61 HB2 SER 61 -3.095 6.677 6.279 520 HB3 SER 61 HB3 SER 61 -1.783 5.576 5.809 521 HG SER 61 HG SER 61 -1.048 7.672 5.617 522 H LYS 62 H LYS 62 -3.426 7.295 2.339 523 HA LYS 62 HA LYS 62 -5.824 8.878 3.038 524 HB2 LYS 62 HB2 LYS 62 -3.881 8.880 0.700 525 HB3 LYS 62 HB3 LYS 62 -5.304 9.922 0.745 526 HG2 LYS 62 HG2 LYS 62 -4.538 11.113 2.674 527 HG3 LYS 62 HG3 LYS 62 -3.269 9.949 3.001 528 HD2 LYS 62 HD2 LYS 62 -2.239 11.891 2.016 529 HD3 LYS 62 HD3 LYS 62 -2.122 10.554 0.874 530 HE2 LYS 62 HE2 LYS 62 -2.676 12.517 -0.374 531 HE3 LYS 62 HE3 LYS 62 -4.108 11.490 -0.365 532 HZ1 LYS 62 HZ1 LYS 62 -3.679 13.846 1.405 533 HZ2 LYS 62 HZ2 LYS 62 -4.649 13.823 0.097 534 HZ3 LYS 62 HZ3 LYS 62 -5.026 12.920 1.401 535 H ARG 63 H ARG 63 -5.312 5.963 1.345 536 HA ARG 63 HA ARG 63 -7.912 6.193 -0.162 537 HB2 ARG 63 HB2 ARG 63 -5.293 4.782 -0.750 538 HB3 ARG 63 HB3 ARG 63 -6.777 4.465 -1.647 539 HG2 ARG 63 HG2 ARG 63 -5.468 7.208 -1.512 540 HG3 ARG 63 HG3 ARG 63 -5.178 6.003 -2.771 541 HD2 ARG 63 HD2 ARG 63 -7.699 5.971 -3.180 542 HD3 ARG 63 HD3 ARG 63 -7.813 7.402 -2.157 543 HE ARG 63 HE ARG 63 -6.609 7.158 -4.856 544 HH11 ARG 63 HH11 ARG 63 -6.147 8.976 -6.012 545 HH12 ARG 63 HH12 ARG 63 -6.202 10.537 -5.250 546 HH21 ARG 63 HH21 ARG 63 -7.112 9.344 -2.161 547 HH22 ARG 63 HH22 ARG 63 -6.745 10.749 -3.128 548 H LEU 64 H LEU 64 -5.904 3.840 1.654 549 HA LEU 64 HA LEU 64 -8.194 1.980 1.909 550 HB2 LEU 64 HB2 LEU 64 -5.272 1.892 2.715 551 HB3 LEU 64 HB3 LEU 64 -6.445 0.817 3.460 552 HG LEU 64 HG LEU 64 -7.079 -0.125 1.300 553 HD11 LEU 64 HD11 LEU 64 -4.823 1.584 0.179 554 HD12 LEU 64 HD12 LEU 64 -5.602 0.229 -0.671 555 HD13 LEU 64 HD13 LEU 64 -6.549 1.661 -0.264 556 HD21 LEU 64 HD21 LEU 64 -5.326 -1.176 2.675 557 HD22 LEU 64 HD22 LEU 64 -5.009 -1.410 0.951 558 HD23 LEU 64 HD23 LEU 64 -4.086 -0.195 1.862 559 H ASN 65 H ASN 65 -7.062 4.733 3.606 560 HA ASN 65 HA ASN 65 -7.634 5.730 5.544 561 HB2 ASN 65 HB2 ASN 65 -9.898 5.383 4.507 562 HB3 ASN 65 HB3 ASN 65 -10.118 3.988 5.562 563 HD21 ASN 65 HD21 ASN 65 -10.475 6.027 8.529 564 HD22 ASN 65 HD22 ASN 65 -9.801 4.487 7.984 565 H ILE 66 H ILE 66 -5.686 4.556 6.150 566 HA ILE 66 HA ILE 66 -6.030 2.907 8.607 567 HB ILE 66 HB ILE 66 -3.784 1.819 7.912 568 HG12 ILE 66 HG12 ILE 66 -4.692 2.692 5.139 569 HG13 ILE 66 HG13 ILE 66 -3.260 3.254 6.028 570 HG21 ILE 66 HG21 ILE 66 -6.298 0.990 6.456 571 HG22 ILE 66 HG22 ILE 66 -4.903 -0.031 6.912 572 HG23 ILE 66 HG23 ILE 66 -5.910 0.671 8.170 573 HD11 ILE 66 HD11 ILE 66 -3.744 0.453 4.967 574 HD12 ILE 66 HD12 ILE 66 -2.611 1.670 4.361 575 HD13 ILE 66 HD13 ILE 66 -2.355 0.950 5.975 576 H THR 67 H THR 67 -4.061 2.867 9.932 577 HA THR 67 HA THR 67 -2.912 5.468 10.501 578 HB THR 67 HB THR 67 -2.420 2.611 11.402 579 HG1 THR 67 HG1 THR 67 -3.347 3.415 13.286 580 HG21 THR 67 HG21 THR 67 -0.990 5.110 12.355 581 HG22 THR 67 HG22 THR 67 -1.076 3.582 13.272 582 HG23 THR 67 HG23 THR 67 -0.289 3.603 11.699 583 H VAL 68 H VAL 68 -0.882 6.265 9.874 584 HA VAL 68 HA VAL 68 0.193 5.421 7.395 585 HB VAL 68 HB VAL 68 1.745 6.980 9.496 586 HG11 VAL 68 HG11 VAL 68 1.819 7.006 6.441 587 HG12 VAL 68 HG12 VAL 68 2.768 8.063 7.509 588 HG13 VAL 68 HG13 VAL 68 3.067 6.326 7.508 589 HG21 VAL 68 HG21 VAL 68 -0.419 8.100 9.271 590 HG22 VAL 68 HG22 VAL 68 0.816 9.033 8.430 591 HG23 VAL 68 HG23 VAL 68 -0.309 8.021 7.501 592 H ASP 69 H ASP 69 1.201 4.548 10.678 593 HA ASP 69 HA ASP 69 3.501 3.040 9.804 594 HB2 ASP 69 HB2 ASP 69 3.223 4.086 12.071 595 HB3 ASP 69 HB3 ASP 69 2.002 2.867 12.443 596 H LYS 70 H LYS 70 0.106 2.188 10.141 597 HA LYS 70 HA LYS 70 0.546 -0.687 9.817 598 HB2 LYS 70 HB2 LYS 70 -1.888 1.114 9.436 599 HB3 LYS 70 HB3 LYS 70 -1.918 -0.591 9.039 600 HG2 LYS 70 HG2 LYS 70 -1.170 0.415 11.818 601 HG3 LYS 70 HG3 LYS 70 -2.833 0.071 11.318 602 HD2 LYS 70 HD2 LYS 70 -2.216 -2.254 10.763 603 HD3 LYS 70 HD3 LYS 70 -0.549 -1.950 11.300 604 HE2 LYS 70 HE2 LYS 70 -1.377 -1.405 13.571 605 HE3 LYS 70 HE3 LYS 70 -3.041 -1.684 13.039 606 HZ1 LYS 70 HZ1 LYS 70 -0.901 -3.749 13.081 607 HZ2 LYS 70 HZ2 LYS 70 -2.130 -3.643 14.147 608 HZ3 LYS 70 HZ3 LYS 70 -2.439 -4.004 12.588 609 H ALA 71 H ALA 71 0.119 2.082 7.645 610 HA ALA 71 HA ALA 71 0.036 0.469 5.215 611 HB1 ALA 71 HB1 ALA 71 0.809 3.398 5.650 612 HB2 ALA 71 HB2 ALA 71 0.476 2.626 4.092 613 HB3 ALA 71 HB3 ALA 71 -0.811 2.808 5.302 614 H LYS 72 H LYS 72 2.661 2.232 6.872 615 HA LYS 72 HA LYS 72 4.845 1.589 5.186 616 HB2 LYS 72 HB2 LYS 72 4.642 2.083 8.181 617 HB3 LYS 72 HB3 LYS 72 6.191 1.823 7.375 618 HG2 LYS 72 HG2 LYS 72 5.987 3.793 6.060 619 HG3 LYS 72 HG3 LYS 72 4.296 4.012 6.502 620 HD2 LYS 72 HD2 LYS 72 5.842 5.591 7.638 621 HD3 LYS 72 HD3 LYS 72 4.810 4.662 8.728 622 HE2 LYS 72 HE2 LYS 72 6.636 3.153 9.289 623 HE3 LYS 72 HE3 LYS 72 7.695 3.919 8.089 624 HZ1 LYS 72 HZ1 LYS 72 6.605 5.248 10.516 625 HZ2 LYS 72 HZ2 LYS 72 8.143 4.746 10.324 626 HZ3 LYS 72 HZ3 LYS 72 7.574 5.970 9.410 627 H THR 73 H THR 73 3.506 -0.404 7.858 628 HA THR 73 HA THR 73 5.572 -2.456 7.316 629 HB THR 73 HB THR 73 4.815 -1.800 9.625 630 HG1 THR 73 HG1 THR 73 5.151 -3.887 10.306 631 HG21 THR 73 HG21 THR 73 2.541 -3.762 9.092 632 HG22 THR 73 HG22 THR 73 2.947 -2.955 10.621 633 HG23 THR 73 HG23 THR 73 2.334 -2.004 9.263 634 H TYR 74 H TYR 74 2.079 -2.084 6.715 635 HA TYR 74 HA TYR 74 1.545 -4.726 5.836 636 HB2 TYR 74 HB2 TYR 74 -0.194 -3.176 6.452 637 HB3 TYR 74 HB3 TYR 74 0.294 -2.043 5.184 638 HD1 TYR 74 HD1 TYR 74 -1.140 -5.449 5.767 639 HD2 TYR 74 HD2 TYR 74 -0.561 -2.172 3.011 640 HE1 TYR 74 HE1 TYR 74 -2.571 -6.605 4.088 641 HE2 TYR 74 HE2 TYR 74 -1.992 -3.315 1.355 642 HH TYR 74 HH TYR 74 -3.334 -6.601 1.948 643 H ILE 75 H ILE 75 2.805 -1.919 4.011 644 HA ILE 75 HA ILE 75 2.782 -2.886 1.384 645 HB ILE 75 HB ILE 75 4.719 -1.163 2.949 646 HG12 ILE 75 HG12 ILE 75 2.952 -0.477 0.556 647 HG13 ILE 75 HG13 ILE 75 2.357 -0.441 2.207 648 HG21 ILE 75 HG21 ILE 75 4.974 -1.829 -0.016 649 HG22 ILE 75 HG22 ILE 75 5.843 -0.519 0.815 650 HG23 ILE 75 HG23 ILE 75 6.165 -2.183 1.251 651 HD11 ILE 75 HD11 ILE 75 4.591 1.298 1.078 652 HD12 ILE 75 HD12 ILE 75 2.981 1.805 1.592 653 HD13 ILE 75 HD13 ILE 75 4.143 1.231 2.798 654 H LYS 76 H LYS 76 5.006 -3.886 3.985 655 HA LYS 76 HA LYS 76 6.346 -5.830 2.145 656 HB2 LYS 76 HB2 LYS 76 6.854 -4.897 5.007 657 HB3 LYS 76 HB3 LYS 76 7.690 -6.291 4.322 658 HG2 LYS 76 HG2 LYS 76 8.785 -5.064 2.679 659 HG3 LYS 76 HG3 LYS 76 7.723 -3.665 2.822 660 HD2 LYS 76 HD2 LYS 76 9.654 -4.576 4.999 661 HD3 LYS 76 HD3 LYS 76 10.037 -3.334 3.809 662 HE2 LYS 76 HE2 LYS 76 7.683 -3.168 5.751 663 HE3 LYS 76 HE3 LYS 76 9.266 -2.470 6.072 664 HZ1 LYS 76 HZ1 LYS 76 7.691 -1.731 3.671 665 HZ2 LYS 76 HZ2 LYS 76 7.565 -0.927 5.077 666 HZ3 LYS 76 HZ3 LYS 76 9.003 -0.958 4.275 667 H ASN 77 H ASN 77 4.335 -5.856 5.089 668 HA ASN 77 HA ASN 77 4.588 -8.677 5.355 669 HB2 ASN 77 HB2 ASN 77 2.700 -6.636 6.577 670 HB3 ASN 77 HB3 ASN 77 2.475 -8.355 6.876 671 HD21 ASN 77 HD21 ASN 77 5.637 -6.477 8.637 672 HD22 ASN 77 HD22 ASN 77 4.761 -5.656 7.363 673 H SER 78 H SER 78 2.367 -6.846 3.351 674 HA SER 78 HA SER 78 0.681 -9.167 2.723 675 HB2 SER 78 HB2 SER 78 -0.102 -6.797 2.773 676 HB3 SER 78 HB3 SER 78 0.871 -6.474 1.331 677 HG SER 78 HG SER 78 -1.352 -7.032 0.892 678 H ASN 79 H ASN 79 3.426 -7.498 1.222 679 HA ASN 79 HA ASN 79 3.624 -9.575 -0.884 680 HB2 ASN 79 HB2 ASN 79 3.638 -7.841 -2.658 681 HB3 ASN 79 HB3 ASN 79 2.092 -7.996 -1.831 682 HD21 ASN 79 HD21 ASN 79 4.256 -4.579 -1.297 683 HD22 ASN 79 HD22 ASN 79 5.044 -6.022 -1.902 684 H ARG 80 H ARG 80 5.436 -9.677 1.001 685 HA ARG 80 HA ARG 80 7.599 -7.944 0.974 686 HB2 ARG 80 HB2 ARG 80 7.177 -9.696 2.690 687 HB3 ARG 80 HB3 ARG 80 7.588 -10.950 1.529 688 HG2 ARG 80 HG2 ARG 80 9.418 -10.545 3.104 689 HG3 ARG 80 HG3 ARG 80 9.910 -10.191 1.455 690 HD2 ARG 80 HD2 ARG 80 9.442 -7.707 1.965 691 HD3 ARG 80 HD3 ARG 80 9.167 -8.192 3.635 692 HE ARG 80 HE ARG 80 11.457 -8.471 3.930 693 HH11 ARG 80 HH11 ARG 80 13.583 -8.104 3.442 694 HH12 ARG 80 HH12 ARG 80 14.073 -7.842 1.795 695 HH21 ARG 80 HH21 ARG 80 10.930 -8.154 0.446 696 HH22 ARG 80 HH22 ARG 80 12.619 -7.837 0.161 697 H MET 81 H MET 81 7.081 -10.566 -1.261 698 HA MET 81 HA MET 81 9.503 -9.730 -2.835 699 HB2 MET 81 HB2 MET 81 8.440 -12.520 -2.270 700 HB3 MET 81 HB3 MET 81 9.622 -12.176 -3.538 701 HG2 MET 81 HG2 MET 81 11.232 -11.344 -1.973 702 HG3 MET 81 HG3 MET 81 10.090 -11.407 -0.635 703 HE1 MET 81 HE1 MET 81 8.677 -14.063 -0.489 704 HE2 MET 81 HE2 MET 81 9.848 -15.057 0.402 705 HE3 MET 81 HE3 MET 81 9.609 -13.355 0.851 706 H GLY 82 H GLY 82 6.100 -10.082 -2.939 707 HA2 GLY 82 HA2 GLY 82 4.809 -9.184 -4.716 708 HA3 GLY 82 HA3 GLY 82 6.065 -9.591 -5.878 709 H ARG 83 H ARG 83 3.094 -10.281 -5.345 710 HA ARG 83 HA ARG 83 1.594 -12.045 -5.509 711 HB2 ARG 83 HB2 ARG 83 3.731 -12.769 -7.533 712 HB3 ARG 83 HB3 ARG 83 2.191 -13.623 -7.454 713 HG2 ARG 83 HG2 ARG 83 2.492 -10.641 -7.997 714 HG3 ARG 83 HG3 ARG 83 2.268 -11.902 -9.212 715 HD2 ARG 83 HD2 ARG 83 0.093 -12.533 -8.023 716 HD3 ARG 83 HD3 ARG 83 0.297 -11.083 -7.043 717 HE ARG 83 HE ARG 83 -0.218 -9.723 -8.864 718 HH11 ARG 83 HH11 ARG 83 -1.180 -9.291 -10.815 719 HH12 ARG 83 HH12 ARG 83 -1.413 -10.566 -11.974 720 HH21 ARG 83 HH21 ARG 83 -0.016 -13.024 -10.039 721 HH22 ARG 83 HH22 ARG 83 -0.777 -12.621 -11.553 722 H THR 84 H THR 84 3.212 -12.344 -3.311 723 HA THR 84 HA THR 84 4.200 -13.716 -1.812 724 HB THR 84 HB THR 84 2.106 -15.803 -2.351 725 HG1 THR 84 HG1 THR 84 0.584 -14.462 -1.392 726 HG21 THR 84 HG21 THR 84 3.058 -14.313 0.150 727 HG22 THR 84 HG22 THR 84 1.888 -15.656 0.119 728 HG23 THR 84 HG23 THR 84 3.577 -15.943 -0.321 729 H ASN 85 H ASN 85 5.456 -14.010 -4.345 730 HA ASN 85 HA ASN 85 6.818 -15.249 -5.597 731 HB2 ASN 85 HB2 ASN 85 8.019 -15.283 -3.436 732 HB3 ASN 85 HB3 ASN 85 7.230 -16.796 -3.005 733 HD21 ASN 85 HD21 ASN 85 10.262 -16.881 -5.770 734 HD22 ASN 85 HD22 ASN 85 9.370 -15.385 -5.554 735 H ASN 86 H ASN 86 3.883 -16.414 -5.128 736 HA ASN 86 HA ASN 86 4.258 -19.206 -5.798 737 HB2 ASN 86 HB2 ASN 86 2.115 -19.454 -5.209 738 HB3 ASN 86 HB3 ASN 86 2.308 -17.854 -4.499 739 HD21 ASN 86 HD21 ASN 86 0.384 -16.281 -7.153 740 HD22 ASN 86 HD22 ASN 86 1.816 -16.003 -6.157 741 H PHE 87 H PHE 87 4.328 -16.477 -7.754 742 HA PHE 87 HA PHE 87 3.067 -17.413 -10.152 743 HB2 PHE 87 HB2 PHE 87 3.818 -15.347 -11.071 744 HB3 PHE 87 HB3 PHE 87 3.332 -15.047 -9.412 745 HD1 PHE 87 HD1 PHE 87 6.095 -14.994 -11.802 746 HD2 PHE 87 HD2 PHE 87 5.073 -14.613 -7.628 747 HE1 PHE 87 HE1 PHE 87 8.315 -13.976 -11.345 748 HE2 PHE 87 HE2 PHE 87 7.273 -13.562 -7.186 749 HZ PHE 87 HZ PHE 87 8.906 -13.257 -9.036 750 H LYS 88 H LYS 88 5.400 -19.050 -9.003 751 HA LYS 88 HA LYS 88 7.579 -18.836 -10.980 752 HB2 LYS 88 HB2 LYS 88 8.758 -20.297 -9.351 753 HB3 LYS 88 HB3 LYS 88 8.154 -18.786 -8.662 754 HG2 LYS 88 HG2 LYS 88 6.191 -20.050 -7.714 755 HG3 LYS 88 HG3 LYS 88 6.904 -21.554 -8.307 756 HD2 LYS 88 HD2 LYS 88 8.729 -21.407 -6.788 757 HD3 LYS 88 HD3 LYS 88 8.484 -19.669 -6.530 758 HE2 LYS 88 HE2 LYS 88 6.279 -20.147 -5.451 759 HE3 LYS 88 HE3 LYS 88 6.613 -21.881 -5.580 760 HZ1 LYS 88 HZ1 LYS 88 8.291 -19.909 -4.113 761 HZ2 LYS 88 HZ2 LYS 88 7.272 -20.980 -3.401 762 HZ3 LYS 88 HZ3 LYS 88 8.597 -21.518 -4.192 763 H THR 89 H THR 89 4.814 -20.559 -10.828 764 HA THR 89 HA THR 89 5.818 -22.867 -12.447 765 HB THR 89 HB THR 89 3.959 -22.913 -10.031 766 HG1 THR 89 HG1 THR 89 5.575 -24.254 -9.197 767 HG21 THR 89 HG21 THR 89 4.776 -25.123 -11.944 768 HG22 THR 89 HG22 THR 89 3.992 -25.382 -10.358 769 HG23 THR 89 HG23 THR 89 3.130 -24.506 -11.631 770 H ILE 90 H ILE 90 2.918 -21.077 -11.291 771 HA ILE 90 HA ILE 90 1.229 -21.910 -13.490 772 HB ILE 90 HB ILE 90 -0.323 -20.259 -12.596 773 HG12 ILE 90 HG12 ILE 90 1.726 -19.688 -10.416 774 HG13 ILE 90 HG13 ILE 90 1.390 -18.602 -11.770 775 HG21 ILE 90 HG21 ILE 90 0.835 -22.073 -10.440 776 HG22 ILE 90 HG22 ILE 90 -0.843 -21.512 -10.588 777 HG23 ILE 90 HG23 ILE 90 -0.181 -22.617 -11.792 778 HD11 ILE 90 HD11 ILE 90 -0.588 -19.455 -9.627 779 HD12 ILE 90 HD12 ILE 90 0.142 -17.855 -9.848 780 HD13 ILE 90 HD13 ILE 90 -0.995 -18.484 -11.062 781 H LYS 91 H LYS 91 0.165 -20.347 -14.915 782 HA LYS 91 HA LYS 91 0.145 -18.927 -16.663 783 HB2 LYS 91 HB2 LYS 91 2.159 -17.234 -15.158 784 HB3 LYS 91 HB3 LYS 91 1.109 -16.681 -16.440 785 HG2 LYS 91 HG2 LYS 91 -0.030 -17.714 -13.804 786 HG3 LYS 91 HG3 LYS 91 0.593 -16.090 -13.983 787 HD2 LYS 91 HD2 LYS 91 -1.783 -16.044 -14.231 788 HD3 LYS 91 HD3 LYS 91 -1.024 -15.588 -15.758 789 HE2 LYS 91 HE2 LYS 91 -1.485 -17.813 -16.692 790 HE3 LYS 91 HE3 LYS 91 -2.121 -18.369 -15.135 791 HZ1 LYS 91 HZ1 LYS 91 -3.305 -16.199 -16.792 792 HZ2 LYS 91 HZ2 LYS 91 -3.903 -17.711 -16.657 793 HZ3 LYS 91 HZ3 LYS 91 -3.904 -16.720 -15.363 794 H MET 92 H MET 92 3.087 -20.491 -16.050 795 HA MET 92 HA MET 92 4.441 -19.415 -18.435 796 HB2 MET 92 HB2 MET 92 5.312 -21.574 -16.487 797 HB3 MET 92 HB3 MET 92 6.295 -20.850 -17.768 798 HG2 MET 92 HG2 MET 92 5.842 -18.587 -16.633 799 HG3 MET 92 HG3 MET 92 5.253 -19.519 -15.256 800 HE1 MET 92 HE1 MET 92 7.494 -22.096 -15.594 801 HE2 MET 92 HE2 MET 92 8.518 -21.549 -14.253 802 HE3 MET 92 HE3 MET 92 6.747 -21.451 -14.115 803 H PHE 93 H PHE 93 2.979 -22.542 -17.496 804 HA PHE 93 HA PHE 93 3.441 -23.545 -20.274 805 HB2 PHE 93 HB2 PHE 93 3.880 -25.676 -19.434 806 HB3 PHE 93 HB3 PHE 93 4.809 -24.581 -18.434 807 HD1 PHE 93 HD1 PHE 93 2.104 -27.054 -18.527 808 HD2 PHE 93 HD2 PHE 93 4.114 -24.153 -16.046 809 HE1 PHE 93 HE1 PHE 93 1.100 -28.084 -16.506 810 HE2 PHE 93 HE2 PHE 93 3.106 -25.189 -14.031 811 HZ PHE 93 HZ PHE 93 1.598 -27.153 -14.252 812 H GLU 94 H GLU 94 0.951 -22.391 -18.521 813 HA GLU 94 HA GLU 94 -1.033 -24.507 -18.944 814 HB2 GLU 94 HB2 GLU 94 -1.272 -21.663 -17.898 815 HB3 GLU 94 HB3 GLU 94 -2.590 -22.843 -17.964 816 HG2 GLU 94 HG2 GLU 94 -1.335 -24.358 -16.465 817 HG3 GLU 94 HG3 GLU 94 0.003 -23.206 -16.391 818 H ASP 95 H ASP 95 -1.718 -24.895 -20.944 819 HA ASP 95 HA ASP 95 -2.809 -22.719 -22.649 820 HB2 ASP 95 HB2 ASP 95 -0.710 -24.770 -23.473 821 HB3 ASP 95 HB3 ASP 95 -1.736 -23.935 -24.630 822 H ASP 96 H ASP 96 -4.284 -23.475 -24.269 823 HA ASP 96 HA ASP 96 -5.554 -26.128 -23.706 824 HB2 ASP 96 HB2 ASP 96 -6.790 -23.533 -24.685 825 HB3 ASP 96 HB3 ASP 96 -7.615 -25.091 -24.664 826 H VAL 97 H VAL 97 -6.009 -27.484 -25.349 827 HA VAL 97 HA VAL 97 -5.268 -26.732 -28.157 828 HB VAL 97 HB VAL 97 -4.499 -29.333 -26.779 829 HG11 VAL 97 HG11 VAL 97 -3.886 -28.284 -29.580 830 HG12 VAL 97 HG12 VAL 97 -3.193 -29.751 -28.855 831 HG13 VAL 97 HG13 VAL 97 -4.922 -29.673 -29.182 832 HG21 VAL 97 HG21 VAL 97 -3.037 -27.526 -25.986 833 HG22 VAL 97 HG22 VAL 97 -2.153 -28.561 -27.105 834 HG23 VAL 97 HG23 VAL 97 -2.761 -26.985 -27.657 835 H SER 98 H SER 98 -7.045 -29.081 -26.090 836 HA SER 98 HA SER 98 -8.615 -30.203 -28.192 837 HB2 SER 98 HB2 SER 98 -8.263 -31.176 -25.916 838 HB3 SER 98 HB3 SER 98 -9.337 -29.932 -25.249 839 HG SER 98 HG SER 98 -10.419 -31.924 -25.715 840 H SER 99 H SER 99 -9.141 -27.345 -26.146 841 HA SER 99 HA SER 99 -11.564 -26.598 -27.658 842 HB2 SER 99 HB2 SER 99 -10.405 -25.440 -25.106 843 HB3 SER 99 HB3 SER 99 -11.858 -24.855 -25.940 844 HG SER 99 HG SER 99 -12.353 -26.331 -24.239 845 H ALA 100 H ALA 100 -11.176 -25.445 -29.437 846 HA ALA 100 HA ALA 100 -9.431 -23.079 -29.379 847 HB1 ALA 100 HB1 ALA 100 -9.001 -25.382 -31.342 848 HB2 ALA 100 HB2 ALA 100 -8.199 -23.800 -31.410 849 HB3 ALA 100 HB3 ALA 100 -7.886 -24.889 -30.047 850 H SER 101 H SER 101 -9.818 -21.625 -31.143 851 HA SER 101 HA SER 101 -12.226 -22.075 -32.830 852 HB2 SER 101 HB2 SER 101 -11.896 -19.727 -30.919 853 HB3 SER 101 HB3 SER 101 -13.145 -19.876 -32.167 854 HG SER 101 HG SER 101 -13.900 -20.541 -30.102 855 H ALA 102 H ALA 102 -12.117 -21.111 -34.764 856 HA ALA 102 HA ALA 102 -11.222 -20.250 -36.621 857 HB1 ALA 102 HB1 ALA 102 -10.415 -17.947 -34.819 858 HB2 ALA 102 HB2 ALA 102 -10.671 -17.887 -36.576 859 HB3 ALA 102 HB3 ALA 102 -12.039 -18.215 -35.496 860 H GLN 103 H GLN 103 -9.291 -21.866 -34.852 861 HA GLN 103 HA GLN 103 -6.670 -20.871 -35.653 862 HB2 GLN 103 HB2 GLN 103 -7.490 -23.405 -34.206 863 HB3 GLN 103 HB3 GLN 103 -5.828 -22.945 -34.557 864 HG2 GLN 103 HG2 GLN 103 -7.759 -21.438 -32.761 865 HG3 GLN 103 HG3 GLN 103 -6.365 -22.381 -32.264 866 HE21 GLN 103 HE21 GLN 103 -5.824 -18.517 -33.392 867 HE22 GLN 103 HE22 GLN 103 -7.429 -19.245 -33.338 868 HA PRO 104 HA PRO 104 -6.979 -23.177 -39.506 869 HB2 PRO 104 HB2 PRO 104 -4.823 -22.235 -40.833 870 HB3 PRO 104 HB3 PRO 104 -6.165 -21.164 -40.347 871 HG2 PRO 104 HG2 PRO 104 -3.552 -21.621 -38.860 872 HG3 PRO 104 HG3 PRO 104 -4.281 -20.058 -39.351 873 HD2 PRO 104 HD2 PRO 104 -4.644 -21.139 -36.853 874 HD3 PRO 104 HD3 PRO 104 -5.912 -20.182 -37.676 875 H ASN 105 H ASN 105 -6.494 -24.954 -37.668 876 HA ASN 105 HA ASN 105 -3.959 -26.426 -38.316 877 HB2 ASN 105 HB2 ASN 105 -5.431 -26.048 -35.681 878 HB3 ASN 105 HB3 ASN 105 -4.150 -27.234 -35.925 879 HD21 ASN 105 HD21 ASN 105 -1.522 -24.841 -35.923 880 HD22 ASN 105 HD22 ASN 105 -1.958 -26.500 -36.308 881 H LEU 106 H LEU 106 -5.340 -27.238 -40.090 882 HA LEU 106 HA LEU 106 -6.720 -29.774 -39.288 883 HB2 LEU 106 HB2 LEU 106 -7.468 -27.817 -41.478 884 HB3 LEU 106 HB3 LEU 106 -8.103 -29.455 -41.366 885 HG LEU 106 HG LEU 106 -8.483 -27.319 -39.219 886 HD11 LEU 106 HD11 LEU 106 -10.401 -28.361 -41.346 887 HD12 LEU 106 HD12 LEU 106 -10.795 -27.206 -40.050 888 HD13 LEU 106 HD13 LEU 106 -9.644 -26.751 -41.316 889 HD21 LEU 106 HD21 LEU 106 -8.651 -29.586 -38.271 890 HD22 LEU 106 HD22 LEU 106 -10.255 -28.865 -38.391 891 HD23 LEU 106 HD23 LEU 106 -9.744 -30.079 -39.585 892 HA PRO 107 HA PRO 107 -3.061 -30.794 -41.906 893 HB2 PRO 107 HB2 PRO 107 -2.325 -33.113 -40.667 894 HB3 PRO 107 HB3 PRO 107 -1.911 -31.488 -40.038 895 HG2 PRO 107 HG2 PRO 107 -4.213 -33.280 -39.201 896 HG3 PRO 107 HG3 PRO 107 -3.044 -32.418 -38.153 897 HD2 PRO 107 HD2 PRO 107 -5.514 -31.416 -38.704 898 HD3 PRO 107 HD3 PRO 107 -4.094 -30.342 -38.530 Start of MODEL 21 1 H1 GLY -5 H1 GLY -5 27.027 -17.802 25.428 2 H2 GLY -5 H2 GLY -5 26.309 -18.804 26.507 3 H3 GLY -5 H3 GLY -5 27.653 -19.290 25.705 4 HA2 GLY -5 HA2 GLY -5 28.239 -18.725 27.956 5 HA3 GLY -5 HA3 GLY -5 28.991 -17.609 26.801 6 H SER -4 H SER -4 29.133 -15.848 28.179 7 HA SER -4 HA SER -4 26.579 -14.534 28.996 8 HB2 SER -4 HB2 SER -4 27.732 -15.871 30.852 9 HB3 SER -4 HB3 SER -4 28.997 -14.634 30.818 10 HG SER -4 HG SER -4 27.321 -14.176 32.345 11 H HIS -3 H HIS -3 27.682 -13.817 26.710 12 HA HIS -3 HA HIS -3 28.614 -12.187 25.436 13 HB2 HIS -3 HB2 HIS -3 26.615 -11.176 26.694 14 HB3 HIS -3 HB3 HIS -3 27.796 -10.250 27.605 15 HD2 HIS -3 HD2 HIS -3 29.526 -9.980 24.521 16 HE1 HIS -3 HE1 HIS -3 26.282 -7.312 23.799 17 HE2 HIS -3 HE2 HIS -3 28.593 -8.042 23.015 18 H MET -2 H MET -2 30.611 -13.476 26.634 19 HA MET -2 HA MET -2 32.505 -11.742 28.016 20 HB2 MET -2 HB2 MET -2 32.710 -14.535 26.828 21 HB3 MET -2 HB3 MET -2 34.025 -13.731 27.698 22 HG2 MET -2 HG2 MET -2 32.806 -13.694 29.746 23 HG3 MET -2 HG3 MET -2 31.284 -14.077 28.951 24 HE1 MET -2 HE1 MET -2 34.780 -15.483 30.099 25 HE2 MET -2 HE2 MET -2 34.670 -17.188 29.611 26 HE3 MET -2 HE3 MET -2 34.804 -15.924 28.374 27 H ALA -1 H ALA -1 33.476 -10.145 26.971 28 HA ALA -1 HA ALA -1 34.753 -10.612 24.321 29 HB1 ALA -1 HB1 ALA -1 32.818 -8.330 24.943 30 HB2 ALA -1 HB2 ALA -1 33.768 -8.514 23.452 31 HB3 ALA -1 HB3 ALA -1 32.517 -9.701 23.856 32 H SER 0 H SER 0 34.287 -8.177 26.888 33 HA SER 0 HA SER 0 35.583 -6.835 28.078 34 HB2 SER 0 HB2 SER 0 36.718 -9.008 28.538 35 HB3 SER 0 HB3 SER 0 37.939 -8.581 27.324 36 HG SER 0 HG SER 0 38.546 -7.996 29.480 37 H MET 1 H MET 1 37.115 -7.339 24.910 38 HA MET 1 HA MET 1 38.165 -4.542 25.015 39 HB2 MET 1 HB2 MET 1 39.941 -5.250 23.559 40 HB3 MET 1 HB3 MET 1 39.856 -6.319 24.958 41 HG2 MET 1 HG2 MET 1 38.652 -8.010 23.586 42 HG3 MET 1 HG3 MET 1 38.748 -6.932 22.189 43 HE1 MET 1 HE1 MET 1 39.751 -8.835 20.719 44 HE2 MET 1 HE2 MET 1 41.159 -9.817 21.177 45 HE3 MET 1 HE3 MET 1 39.645 -9.952 22.099 46 H ASP 2 H ASP 2 35.614 -6.028 23.650 47 HA ASP 2 HA ASP 2 35.617 -4.291 21.199 48 HB2 ASP 2 HB2 ASP 2 34.530 -7.075 21.696 49 HB3 ASP 2 HB3 ASP 2 33.952 -6.087 20.364 50 H GLN 3 H GLN 3 34.291 -4.255 24.200 51 HA GLN 3 HA GLN 3 31.649 -3.224 23.259 52 HB2 GLN 3 HB2 GLN 3 30.572 -4.279 25.117 53 HB3 GLN 3 HB3 GLN 3 31.483 -5.437 24.178 54 HG2 GLN 3 HG2 GLN 3 32.003 -6.162 26.278 55 HG3 GLN 3 HG3 GLN 3 33.377 -5.116 25.983 56 HE21 GLN 3 HE21 GLN 3 32.661 -3.591 29.115 57 HE22 GLN 3 HE22 GLN 3 33.870 -4.292 28.050 58 H LEU 4 H LEU 4 34.273 -1.794 24.129 59 HA LEU 4 HA LEU 4 33.359 -0.197 26.430 60 HB2 LEU 4 HB2 LEU 4 35.894 -0.396 24.804 61 HB3 LEU 4 HB3 LEU 4 35.563 1.091 25.683 62 HG LEU 4 HG LEU 4 35.351 -0.129 27.803 63 HD11 LEU 4 HD11 LEU 4 36.196 -2.564 26.178 64 HD12 LEU 4 HD12 LEU 4 36.153 -2.474 27.954 65 HD13 LEU 4 HD13 LEU 4 34.652 -2.341 27.033 66 HD21 LEU 4 HD21 LEU 4 37.521 0.817 27.101 67 HD22 LEU 4 HD22 LEU 4 37.739 -0.654 28.062 68 HD23 LEU 4 HD23 LEU 4 37.936 -0.713 26.295 69 H ASP 5 H ASP 5 33.977 0.474 22.966 70 HA ASP 5 HA ASP 5 32.800 3.189 23.306 71 HB2 ASP 5 HB2 ASP 5 35.122 2.917 22.452 72 HB3 ASP 5 HB3 ASP 5 34.492 2.022 21.069 73 H GLU 6 H GLU 6 32.086 0.148 21.714 74 HA GLU 6 HA GLU 6 29.661 1.348 20.476 75 HB2 GLU 6 HB2 GLU 6 31.245 0.442 18.808 76 HB3 GLU 6 HB3 GLU 6 31.300 -1.092 19.679 77 HG2 GLU 6 HG2 GLU 6 29.867 -1.384 17.817 78 HG3 GLU 6 HG3 GLU 6 28.863 -1.390 19.262 79 H ILE 7 H ILE 7 27.775 0.668 21.326 80 HA ILE 7 HA ILE 7 27.710 -1.693 23.145 81 HB ILE 7 HB ILE 7 26.486 0.989 23.893 82 HG12 ILE 7 HG12 ILE 7 28.313 0.683 25.842 83 HG13 ILE 7 HG13 ILE 7 29.222 -0.115 24.571 84 HG21 ILE 7 HG21 ILE 7 26.910 -1.598 25.455 85 HG22 ILE 7 HG22 ILE 7 26.167 -0.108 26.072 86 HG23 ILE 7 HG23 ILE 7 25.358 -1.020 24.802 87 HD11 ILE 7 HD11 ILE 7 28.110 2.731 24.526 88 HD12 ILE 7 HD12 ILE 7 29.804 2.264 24.761 89 HD13 ILE 7 HD13 ILE 7 29.025 1.998 23.195 90 H ILE 8 H ILE 8 26.149 -3.000 22.592 91 HA ILE 8 HA ILE 8 23.657 -2.068 21.238 92 HB ILE 8 HB ILE 8 25.528 -4.300 20.347 93 HG12 ILE 8 HG12 ILE 8 26.372 -2.098 19.630 94 HG13 ILE 8 HG13 ILE 8 25.903 -3.121 18.296 95 HG21 ILE 8 HG21 ILE 8 22.791 -3.528 19.273 96 HG22 ILE 8 HG22 ILE 8 23.956 -4.537 18.388 97 HG23 ILE 8 HG23 ILE 8 23.324 -5.095 19.931 98 HD11 ILE 8 HD11 ILE 8 24.190 -0.831 19.361 99 HD12 ILE 8 HD12 ILE 8 25.258 -0.761 17.950 100 HD13 ILE 8 HD13 ILE 8 23.850 -1.831 17.933 101 H GLU 9 H GLU 9 21.843 -3.262 21.730 102 HA GLU 9 HA GLU 9 20.429 -4.479 23.045 103 HB2 GLU 9 HB2 GLU 9 22.455 -6.586 22.239 104 HB3 GLU 9 HB3 GLU 9 20.923 -6.970 23.019 105 HG2 GLU 9 HG2 GLU 9 21.076 -5.416 20.409 106 HG3 GLU 9 HG3 GLU 9 20.987 -7.169 20.497 107 H GLN 10 H GLN 10 21.302 -3.006 24.814 108 HA GLN 10 HA GLN 10 22.174 -4.683 27.140 109 HB2 GLN 10 HB2 GLN 10 24.031 -3.301 26.245 110 HB3 GLN 10 HB3 GLN 10 23.082 -1.843 26.559 111 HG2 GLN 10 HG2 GLN 10 23.032 -2.426 28.994 112 HG3 GLN 10 HG3 GLN 10 23.955 -3.892 28.656 113 HE21 GLN 10 HE21 GLN 10 25.883 -0.265 28.759 114 HE22 GLN 10 HE22 GLN 10 24.128 -0.306 28.723 115 H ILE 11 H ILE 11 20.800 -1.404 26.486 116 HA ILE 11 HA ILE 11 18.653 -1.933 28.453 117 HB ILE 11 HB ILE 11 18.935 0.463 29.252 118 HG12 ILE 11 HG12 ILE 11 21.850 0.073 28.437 119 HG13 ILE 11 HG13 ILE 11 20.728 1.118 27.571 120 HG21 ILE 11 HG21 ILE 11 21.010 -1.582 30.138 121 HG22 ILE 11 HG22 ILE 11 20.323 -0.265 31.111 122 HG23 ILE 11 HG23 ILE 11 19.295 -1.599 30.596 123 HD11 ILE 11 HD11 ILE 11 21.635 1.475 30.451 124 HD12 ILE 11 HD12 ILE 11 22.043 2.478 29.050 125 HD13 ILE 11 HD13 ILE 11 20.376 2.451 29.655 126 H GLN 12 H GLN 12 16.904 -1.823 27.434 127 HA GLN 12 HA GLN 12 15.996 0.520 26.001 128 HB2 GLN 12 HB2 GLN 12 15.420 -0.595 23.909 129 HB3 GLN 12 HB3 GLN 12 17.146 -0.536 24.146 130 HG2 GLN 12 HG2 GLN 12 15.417 -2.992 24.602 131 HG3 GLN 12 HG3 GLN 12 16.319 -2.658 23.139 132 HE21 GLN 12 HE21 GLN 12 18.225 -4.703 25.934 133 HE22 GLN 12 HE22 GLN 12 16.467 -4.610 25.727 134 H LYS 13 H LYS 13 13.616 -0.271 25.029 135 HA LYS 13 HA LYS 13 12.057 -0.372 27.362 136 HB2 LYS 13 HB2 LYS 13 11.371 -0.895 24.442 137 HB3 LYS 13 HB3 LYS 13 10.129 -0.794 25.676 138 HG2 LYS 13 HG2 LYS 13 12.074 1.512 25.430 139 HG3 LYS 13 HG3 LYS 13 10.831 1.300 24.205 140 HD2 LYS 13 HD2 LYS 13 10.060 2.857 25.875 141 HD3 LYS 13 HD3 LYS 13 9.054 1.405 25.881 142 HE2 LYS 13 HE2 LYS 13 10.237 0.572 27.887 143 HE3 LYS 13 HE3 LYS 13 11.308 1.983 27.856 144 HZ1 LYS 13 HZ1 LYS 13 8.362 2.081 28.253 145 HZ2 LYS 13 HZ2 LYS 13 9.478 2.290 29.424 146 HZ3 LYS 13 HZ3 LYS 13 9.346 3.386 28.225 147 H GLU 14 H GLU 14 13.279 -3.147 25.707 148 HA GLU 14 HA GLU 14 12.114 -4.893 27.728 149 HB2 GLU 14 HB2 GLU 14 11.323 -6.564 26.109 150 HB3 GLU 14 HB3 GLU 14 10.393 -5.071 26.033 151 HG2 GLU 14 HG2 GLU 14 11.660 -4.379 23.997 152 HG3 GLU 14 HG3 GLU 14 12.584 -5.882 24.069 153 H ALA 15 H ALA 15 13.252 -6.789 27.996 154 HA ALA 15 HA ALA 15 15.814 -7.138 26.491 155 HB1 ALA 15 HB1 ALA 15 15.503 -7.184 29.518 156 HB2 ALA 15 HB2 ALA 15 16.960 -7.652 28.609 157 HB3 ALA 15 HB3 ALA 15 16.371 -5.980 28.548 158 H ILE 16 H ILE 16 14.356 -8.932 29.181 159 HA ILE 16 HA ILE 16 14.071 -11.313 27.414 160 HB ILE 16 HB ILE 16 15.497 -11.004 30.060 161 HG12 ILE 16 HG12 ILE 16 16.369 -12.219 27.399 162 HG13 ILE 16 HG13 ILE 16 16.781 -10.607 27.978 163 HG21 ILE 16 HG21 ILE 16 14.698 -13.670 28.806 164 HG22 ILE 16 HG22 ILE 16 15.796 -13.475 30.193 165 HG23 ILE 16 HG23 ILE 16 14.116 -13.017 30.355 166 HD11 ILE 16 HD11 ILE 16 17.757 -13.223 29.149 167 HD12 ILE 16 HD12 ILE 16 18.685 -11.960 28.336 168 HD13 ILE 16 HD13 ILE 16 17.977 -11.635 29.930 169 H ASN 17 H ASN 17 12.434 -9.374 29.425 170 HA ASN 17 HA ASN 17 10.705 -11.429 30.569 171 HB2 ASN 17 HB2 ASN 17 10.478 -8.385 30.612 172 HB3 ASN 17 HB3 ASN 17 9.457 -9.482 31.537 173 HD21 ASN 17 HD21 ASN 17 12.986 -8.458 33.107 174 HD22 ASN 17 HD22 ASN 17 12.266 -7.620 31.743 175 H SER 18 H SER 18 10.743 -9.971 27.526 176 HA SER 18 HA SER 18 7.827 -9.940 27.093 177 HB2 SER 18 HB2 SER 18 8.469 -9.152 24.823 178 HB3 SER 18 HB3 SER 18 9.080 -8.139 26.143 179 HG SER 18 HG SER 18 10.615 -8.636 24.462 180 H ASN 19 H ASN 19 10.617 -11.712 25.685 181 HA ASN 19 HA ASN 19 9.045 -13.315 23.972 182 HB2 ASN 19 HB2 ASN 19 11.077 -14.539 23.514 183 HB3 ASN 19 HB3 ASN 19 11.458 -12.831 23.660 184 HD21 ASN 19 HD21 ASN 19 13.708 -13.383 26.334 185 HD22 ASN 19 HD22 ASN 19 13.061 -12.246 25.157 186 H VAL 20 H VAL 20 9.468 -13.705 27.302 187 HA VAL 20 HA VAL 20 8.836 -16.543 27.529 188 HB VAL 20 HB VAL 20 8.750 -14.249 29.528 189 HG11 VAL 20 HG11 VAL 20 8.522 -17.249 30.040 190 HG12 VAL 20 HG12 VAL 20 8.803 -16.016 31.290 191 HG13 VAL 20 HG13 VAL 20 7.289 -16.015 30.393 192 HG21 VAL 20 HG21 VAL 20 11.025 -14.787 28.684 193 HG22 VAL 20 HG22 VAL 20 10.845 -15.241 30.378 194 HG23 VAL 20 HG23 VAL 20 10.781 -16.490 29.113 195 H VAL 21 H VAL 21 6.939 -13.632 27.081 196 HA VAL 21 HA VAL 21 4.399 -15.187 27.288 197 HB VAL 21 HB VAL 21 4.666 -12.329 28.294 198 HG11 VAL 21 HG11 VAL 21 2.491 -14.457 28.638 199 HG12 VAL 21 HG12 VAL 21 2.463 -12.814 29.313 200 HG13 VAL 21 HG13 VAL 21 2.378 -13.046 27.567 201 HG21 VAL 21 HG21 VAL 21 5.950 -13.701 29.849 202 HG22 VAL 21 HG22 VAL 21 4.405 -13.282 30.582 203 HG23 VAL 21 HG23 VAL 21 4.646 -14.912 29.913 204 H LEU 22 H LEU 22 5.175 -15.334 24.985 205 HA LEU 22 HA LEU 22 4.040 -13.124 23.353 206 HB2 LEU 22 HB2 LEU 22 6.698 -13.265 23.692 207 HB3 LEU 22 HB3 LEU 22 6.568 -14.530 22.485 208 HG LEU 22 HG LEU 22 5.414 -12.817 20.974 209 HD11 LEU 22 HD11 LEU 22 6.385 -10.890 23.140 210 HD12 LEU 22 HD12 LEU 22 5.792 -10.418 21.533 211 HD13 LEU 22 HD13 LEU 22 4.693 -11.172 22.690 212 HD21 LEU 22 HD21 LEU 22 7.800 -13.373 20.730 213 HD22 LEU 22 HD22 LEU 22 7.531 -11.648 20.427 214 HD23 LEU 22 HD23 LEU 22 8.224 -12.171 21.972 215 H LYS 23 H LYS 23 3.210 -13.703 21.313 216 HA LYS 23 HA LYS 23 2.430 -16.550 21.054 217 HB2 LYS 23 HB2 LYS 23 0.758 -14.826 21.827 218 HB3 LYS 23 HB3 LYS 23 0.879 -14.058 20.238 219 HG2 LYS 23 HG2 LYS 23 0.089 -16.125 19.170 220 HG3 LYS 23 HG3 LYS 23 0.131 -16.970 20.727 221 HD2 LYS 23 HD2 LYS 23 -1.641 -15.503 21.602 222 HD3 LYS 23 HD3 LYS 23 -1.647 -14.571 20.086 223 HE2 LYS 23 HE2 LYS 23 -2.327 -16.579 18.826 224 HE3 LYS 23 HE3 LYS 23 -2.259 -17.554 20.300 225 HZ1 LYS 23 HZ1 LYS 23 -4.111 -15.268 19.868 226 HZ2 LYS 23 HZ2 LYS 23 -4.531 -16.843 19.799 227 HZ3 LYS 23 HZ3 LYS 23 -4.055 -16.193 21.217 228 H ASN 24 H ASN 24 4.719 -16.215 20.007 229 HA ASN 24 HA ASN 24 6.045 -16.349 18.142 230 HB2 ASN 24 HB2 ASN 24 4.925 -18.473 18.424 231 HB3 ASN 24 HB3 ASN 24 3.580 -17.944 17.408 232 HD21 ASN 24 HD21 ASN 24 7.183 -18.693 15.531 233 HD22 ASN 24 HD22 ASN 24 7.209 -18.013 17.147 234 HA PRO 25 HA PRO 25 4.121 -13.050 15.592 235 HB2 PRO 25 HB2 PRO 25 6.068 -11.138 15.691 236 HB3 PRO 25 HB3 PRO 25 4.949 -11.456 17.046 237 HG2 PRO 25 HG2 PRO 25 7.759 -12.560 16.680 238 HG3 PRO 25 HG3 PRO 25 7.077 -11.725 18.111 239 HD2 PRO 25 HD2 PRO 25 7.154 -14.439 17.932 240 HD3 PRO 25 HD3 PRO 25 5.766 -13.604 18.695 241 H ARG 26 H ARG 26 4.315 -14.730 13.997 242 HA ARG 26 HA ARG 26 6.226 -13.949 11.810 243 HB2 ARG 26 HB2 ARG 26 5.431 -16.773 12.636 244 HB3 ARG 26 HB3 ARG 26 6.158 -16.356 11.076 245 HG2 ARG 26 HG2 ARG 26 8.124 -15.368 12.298 246 HG3 ARG 26 HG3 ARG 26 7.422 -15.936 13.817 247 HD2 ARG 26 HD2 ARG 26 9.113 -17.523 13.070 248 HD3 ARG 26 HD3 ARG 26 7.519 -18.266 13.026 249 HE ARG 26 HE ARG 26 7.691 -18.533 10.743 250 HH11 ARG 26 HH11 ARG 26 8.598 -18.474 8.728 251 HH12 ARG 26 HH12 ARG 26 9.999 -17.488 8.431 252 HH21 ARG 26 HH21 ARG 26 10.214 -16.258 11.622 253 HH22 ARG 26 HH22 ARG 26 10.887 -16.258 10.016 254 H VAL 27 H VAL 27 3.215 -15.847 12.305 255 HA VAL 27 HA VAL 27 2.020 -14.472 9.930 256 HB VAL 27 HB VAL 27 1.879 -17.479 10.326 257 HG11 VAL 27 HG11 VAL 27 1.123 -15.659 7.983 258 HG12 VAL 27 HG12 VAL 27 0.993 -17.431 8.017 259 HG13 VAL 27 HG13 VAL 27 -0.030 -16.458 9.072 260 HG21 VAL 27 HG21 VAL 27 4.178 -16.977 9.700 261 HG22 VAL 27 HG22 VAL 27 3.324 -17.633 8.309 262 HG23 VAL 27 HG23 VAL 27 3.626 -15.884 8.408 263 HA PRO 28 HA PRO 28 -1.230 -14.559 13.208 264 HB2 PRO 28 HB2 PRO 28 -1.923 -11.939 13.162 265 HB3 PRO 28 HB3 PRO 28 -0.560 -12.563 14.145 266 HG2 PRO 28 HG2 PRO 28 -0.440 -11.258 11.412 267 HG3 PRO 28 HG3 PRO 28 0.577 -10.904 12.841 268 HD2 PRO 28 HD2 PRO 28 1.385 -12.548 10.800 269 HD3 PRO 28 HD3 PRO 28 1.875 -12.835 12.497 270 H THR 29 H THR 29 -3.501 -13.937 12.936 271 HA THR 29 HA THR 29 -4.406 -14.456 10.173 272 HB THR 29 HB THR 29 -6.409 -15.361 11.487 273 HG1 THR 29 HG1 THR 29 -6.010 -15.856 13.635 274 HG21 THR 29 HG21 THR 29 -3.704 -16.674 11.972 275 HG22 THR 29 HG22 THR 29 -5.291 -17.475 12.035 276 HG23 THR 29 HG23 THR 29 -4.686 -16.835 10.499 277 H GLN 30 H GLN 30 -3.941 -11.888 10.308 278 HA GLN 30 HA GLN 30 -6.241 -10.472 11.272 279 HB2 GLN 30 HB2 GLN 30 -5.052 -8.448 10.708 280 HB3 GLN 30 HB3 GLN 30 -3.940 -9.582 11.456 281 HG2 GLN 30 HG2 GLN 30 -3.951 -9.909 8.524 282 HG3 GLN 30 HG3 GLN 30 -3.668 -8.234 8.967 283 HE21 GLN 30 HE21 GLN 30 -0.574 -10.706 9.152 284 HE22 GLN 30 HE22 GLN 30 -2.040 -11.044 8.251 285 H LYS 31 H LYS 31 -6.704 -12.280 9.000 286 HA LYS 31 HA LYS 31 -7.378 -10.634 6.684 287 HB2 LYS 31 HB2 LYS 31 -6.309 -12.954 6.708 288 HB3 LYS 31 HB3 LYS 31 -7.856 -13.585 7.228 289 HG2 LYS 31 HG2 LYS 31 -8.053 -13.970 4.986 290 HG3 LYS 31 HG3 LYS 31 -8.749 -12.357 5.004 291 HD2 LYS 31 HD2 LYS 31 -5.884 -13.107 4.268 292 HD3 LYS 31 HD3 LYS 31 -7.180 -12.681 3.146 293 HE2 LYS 31 HE2 LYS 31 -7.289 -10.398 4.167 294 HE3 LYS 31 HE3 LYS 31 -5.931 -10.826 5.221 295 HZ1 LYS 31 HZ1 LYS 31 -5.831 -10.739 2.253 296 HZ2 LYS 31 HZ2 LYS 31 -5.142 -9.656 3.267 297 HZ3 LYS 31 HZ3 LYS 31 -4.585 -11.188 3.212 298 H THR 32 H THR 32 -8.806 -9.385 8.263 299 HA THR 32 HA THR 32 -11.633 -10.304 7.965 300 HB THR 32 HB THR 32 -10.624 -10.900 10.179 301 HG1 THR 32 HG1 THR 32 -12.418 -10.284 11.330 302 HG21 THR 32 HG21 THR 32 -10.758 -7.910 10.746 303 HG22 THR 32 HG22 THR 32 -10.367 -9.202 11.900 304 HG23 THR 32 HG23 THR 32 -9.268 -8.859 10.558 305 H GLY 33 H GLY 33 -9.715 -7.940 6.999 306 HA2 GLY 33 HA2 GLY 33 -11.593 -6.241 5.959 307 HA3 GLY 33 HA3 GLY 33 -11.393 -5.589 7.585 308 H GLU 34 H GLU 34 -9.423 -6.564 4.730 309 HA GLU 34 HA GLU 34 -7.794 -4.081 5.066 310 HB2 GLU 34 HB2 GLU 34 -6.660 -6.840 4.494 311 HB3 GLU 34 HB3 GLU 34 -5.765 -5.313 4.446 312 HG2 GLU 34 HG2 GLU 34 -6.280 -4.967 6.863 313 HG3 GLU 34 HG3 GLU 34 -7.073 -6.548 6.908 314 H LEU 35 H LEU 35 -7.317 -6.609 2.660 315 HA LEU 35 HA LEU 35 -8.010 -4.646 0.540 316 HB2 LEU 35 HB2 LEU 35 -5.847 -6.711 0.774 317 HB3 LEU 35 HB3 LEU 35 -6.537 -6.377 -0.812 318 HG LEU 35 HG LEU 35 -6.099 -3.966 -0.535 319 HD11 LEU 35 HD11 LEU 35 -4.755 -4.821 2.046 320 HD12 LEU 35 HD12 LEU 35 -4.370 -3.301 1.216 321 HD13 LEU 35 HD13 LEU 35 -6.006 -3.580 1.809 322 HD21 LEU 35 HD21 LEU 35 -4.539 -5.315 -1.786 323 HD22 LEU 35 HD22 LEU 35 -3.615 -4.155 -0.823 324 HD23 LEU 35 HD23 LEU 35 -3.742 -5.857 -0.325 325 H SER 36 H SER 36 -9.984 -4.890 0.144 326 HA SER 36 HA SER 36 -11.219 -7.559 -0.367 327 HB2 SER 36 HB2 SER 36 -12.403 -6.040 1.150 328 HB3 SER 36 HB3 SER 36 -12.547 -4.851 -0.156 329 HG SER 36 HG SER 36 -14.410 -6.215 0.051 330 H GLU 37 H GLU 37 -11.480 -4.469 -2.037 331 HA GLU 37 HA GLU 37 -10.719 -5.662 -4.603 332 HB2 GLU 37 HB2 GLU 37 -12.860 -5.692 -5.620 333 HB3 GLU 37 HB3 GLU 37 -13.042 -6.514 -4.059 334 HG2 GLU 37 HG2 GLU 37 -14.047 -4.465 -3.092 335 HG3 GLU 37 HG3 GLU 37 -13.914 -3.660 -4.659 336 H GLU 38 H GLU 38 -12.021 -2.902 -2.829 337 HA GLU 38 HA GLU 38 -11.121 -1.046 -4.936 338 HB2 GLU 38 HB2 GLU 38 -13.402 -1.039 -3.806 339 HB3 GLU 38 HB3 GLU 38 -12.597 -0.416 -2.369 340 HG2 GLU 38 HG2 GLU 38 -11.862 1.577 -3.669 341 HG3 GLU 38 HG3 GLU 38 -12.567 0.883 -5.131 342 H GLN 39 H GLN 39 -9.618 -2.535 -2.343 343 HA GLN 39 HA GLN 39 -7.794 -0.184 -1.846 344 HB2 GLN 39 HB2 GLN 39 -8.287 -2.725 -0.279 345 HB3 GLN 39 HB3 GLN 39 -6.956 -1.625 0.039 346 HG2 GLN 39 HG2 GLN 39 -8.618 -1.005 1.587 347 HG3 GLN 39 HG3 GLN 39 -8.685 0.240 0.336 348 HE21 GLN 39 HE21 GLN 39 -11.815 -2.420 0.634 349 HE22 GLN 39 HE22 GLN 39 -10.237 -2.852 1.317 350 H LYS 40 H LYS 40 -7.703 -3.605 -2.947 351 HA LYS 40 HA LYS 40 -4.864 -3.637 -3.415 352 HB2 LYS 40 HB2 LYS 40 -5.244 -5.676 -4.620 353 HB3 LYS 40 HB3 LYS 40 -6.274 -5.645 -3.190 354 HG2 LYS 40 HG2 LYS 40 -8.186 -4.882 -4.691 355 HG3 LYS 40 HG3 LYS 40 -7.105 -5.119 -6.071 356 HD2 LYS 40 HD2 LYS 40 -8.673 -7.010 -5.706 357 HD3 LYS 40 HD3 LYS 40 -6.977 -7.508 -5.640 358 HE2 LYS 40 HE2 LYS 40 -7.028 -7.649 -3.213 359 HE3 LYS 40 HE3 LYS 40 -8.626 -6.898 -3.146 360 HZ1 LYS 40 HZ1 LYS 40 -8.088 -9.540 -4.401 361 HZ2 LYS 40 HZ2 LYS 40 -8.716 -9.321 -2.905 362 HZ3 LYS 40 HZ3 LYS 40 -9.560 -8.834 -4.201 363 H LYS 41 H LYS 41 -7.544 -2.460 -5.357 364 HA LYS 41 HA LYS 41 -6.043 -1.854 -7.742 365 HB2 LYS 41 HB2 LYS 41 -8.572 -0.629 -6.551 366 HB3 LYS 41 HB3 LYS 41 -7.947 -0.225 -8.154 367 HG2 LYS 41 HG2 LYS 41 -8.194 -2.538 -8.913 368 HG3 LYS 41 HG3 LYS 41 -8.739 -3.040 -7.308 369 HD2 LYS 41 HD2 LYS 41 -10.665 -1.412 -7.518 370 HD3 LYS 41 HD3 LYS 41 -10.154 -1.096 -9.189 371 HE2 LYS 41 HE2 LYS 41 -10.449 -3.495 -9.737 372 HE3 LYS 41 HE3 LYS 41 -10.885 -3.834 -8.055 373 HZ1 LYS 41 HZ1 LYS 41 -12.436 -2.075 -9.882 374 HZ2 LYS 41 HZ2 LYS 41 -12.859 -3.590 -9.448 375 HZ3 LYS 41 HZ3 LYS 41 -12.832 -2.404 -8.328 376 H ILE 42 H ILE 42 -5.649 -0.521 -4.677 377 HA ILE 42 HA ILE 42 -4.180 1.825 -5.808 378 HB ILE 42 HB ILE 42 -5.224 1.332 -2.999 379 HG12 ILE 42 HG12 ILE 42 -6.071 3.818 -3.753 380 HG13 ILE 42 HG13 ILE 42 -6.019 3.068 -5.331 381 HG21 ILE 42 HG21 ILE 42 -3.421 3.585 -3.959 382 HG22 ILE 42 HG22 ILE 42 -4.251 3.501 -2.386 383 HG23 ILE 42 HG23 ILE 42 -3.011 2.322 -2.769 384 HD11 ILE 42 HD11 ILE 42 -7.531 2.010 -2.889 385 HD12 ILE 42 HD12 ILE 42 -8.246 2.881 -4.258 386 HD13 ILE 42 HD13 ILE 42 -7.546 1.275 -4.506 387 H VAL 43 H VAL 43 -3.800 -0.816 -3.331 388 HA VAL 43 HA VAL 43 -1.022 -0.268 -3.005 389 HB VAL 43 HB VAL 43 -2.429 -2.905 -2.452 390 HG11 VAL 43 HG11 VAL 43 0.169 -1.738 -1.348 391 HG12 VAL 43 HG12 VAL 43 -0.626 -3.215 -0.763 392 HG13 VAL 43 HG13 VAL 43 0.026 -3.164 -2.399 393 HG21 VAL 43 HG21 VAL 43 -3.553 -1.139 -1.247 394 HG22 VAL 43 HG22 VAL 43 -2.544 -2.027 -0.103 395 HG23 VAL 43 HG23 VAL 43 -2.008 -0.446 -0.704 396 H ALA 44 H ALA 44 -2.540 -2.945 -4.922 397 HA ALA 44 HA ALA 44 0.080 -3.851 -5.798 398 HB1 ALA 44 HB1 ALA 44 -2.673 -4.605 -6.829 399 HB2 ALA 44 HB2 ALA 44 -1.129 -5.466 -7.108 400 HB3 ALA 44 HB3 ALA 44 -1.801 -5.379 -5.471 401 H ASP 45 H ASP 45 -2.427 -1.776 -7.255 402 HA ASP 45 HA ASP 45 -1.101 -1.300 -9.750 403 HB2 ASP 45 HB2 ASP 45 -2.974 0.321 -8.024 404 HB3 ASP 45 HB3 ASP 45 -2.231 1.035 -9.448 405 H TYR 46 H TYR 46 -0.426 0.122 -6.505 406 HA TYR 46 HA TYR 46 1.633 1.896 -7.489 407 HB2 TYR 46 HB2 TYR 46 0.253 1.750 -5.187 408 HB3 TYR 46 HB3 TYR 46 1.681 0.888 -4.662 409 HD1 TYR 46 HD1 TYR 46 0.352 3.673 -3.889 410 HD2 TYR 46 HD2 TYR 46 3.763 2.522 -6.216 411 HE1 TYR 46 HE1 TYR 46 1.480 5.807 -3.280 412 HE2 TYR 46 HE2 TYR 46 4.792 4.727 -5.861 413 HH TYR 46 HH TYR 46 3.267 7.208 -3.731 414 H ILE 47 H ILE 47 1.696 -1.460 -6.188 415 HA ILE 47 HA ILE 47 4.538 -1.828 -6.329 416 HB ILE 47 HB ILE 47 2.311 -3.867 -6.713 417 HG12 ILE 47 HG12 ILE 47 1.885 -3.193 -4.556 418 HG13 ILE 47 HG13 ILE 47 3.038 -4.453 -4.251 419 HG21 ILE 47 HG21 ILE 47 5.205 -4.375 -5.967 420 HG22 ILE 47 HG22 ILE 47 3.892 -5.577 -6.046 421 HG23 ILE 47 HG23 ILE 47 4.430 -4.783 -7.517 422 HD11 ILE 47 HD11 ILE 47 3.557 -1.447 -4.216 423 HD12 ILE 47 HD12 ILE 47 3.532 -2.561 -2.839 424 HD13 ILE 47 HD13 ILE 47 4.835 -2.673 -4.043 425 H SER 48 H SER 48 2.091 -1.916 -8.854 426 HA SER 48 HA SER 48 3.887 -2.728 -10.981 427 HB2 SER 48 HB2 SER 48 1.274 -2.791 -10.814 428 HB3 SER 48 HB3 SER 48 1.368 -1.117 -11.396 429 HG SER 48 HG SER 48 1.173 -2.674 -13.099 430 H GLU 49 H GLU 49 3.711 0.309 -9.280 431 HA GLU 49 HA GLU 49 4.261 1.913 -11.707 432 HB2 GLU 49 HB2 GLU 49 2.369 2.412 -10.096 433 HB3 GLU 49 HB3 GLU 49 3.588 2.796 -8.884 434 HG2 GLU 49 HG2 GLU 49 2.873 4.842 -9.802 435 HG3 GLU 49 HG3 GLU 49 4.480 4.568 -10.459 436 H VAL 50 H VAL 50 5.673 1.310 -8.450 437 HA VAL 50 HA VAL 50 8.175 2.674 -9.381 438 HB VAL 50 HB VAL 50 8.410 3.780 -7.276 439 HG11 VAL 50 HG11 VAL 50 5.537 4.191 -8.128 440 HG12 VAL 50 HG12 VAL 50 6.622 5.336 -7.314 441 HG13 VAL 50 HG13 VAL 50 6.951 4.850 -8.982 442 HG21 VAL 50 HG21 VAL 50 7.552 2.099 -5.738 443 HG22 VAL 50 HG22 VAL 50 6.728 3.641 -5.513 444 HG23 VAL 50 HG23 VAL 50 5.917 2.313 -6.379 445 H GLY 51 H GLY 51 7.057 -0.233 -7.921 446 HA2 GLY 51 HA2 GLY 51 8.966 -1.915 -8.394 447 HA3 GLY 51 HA3 GLY 51 9.856 -1.004 -7.165 448 H LEU 52 H LEU 52 9.108 -0.891 -5.112 449 HA LEU 52 HA LEU 52 6.938 -2.443 -4.037 450 HB2 LEU 52 HB2 LEU 52 8.690 -4.240 -4.582 451 HB3 LEU 52 HB3 LEU 52 9.765 -3.459 -3.444 452 HG LEU 52 HG LEU 52 7.315 -3.795 -2.031 453 HD11 LEU 52 HD11 LEU 52 8.035 -6.309 -3.598 454 HD12 LEU 52 HD12 LEU 52 6.865 -6.210 -2.279 455 HD13 LEU 52 HD13 LEU 52 6.560 -5.338 -3.786 456 HD21 LEU 52 HD21 LEU 52 9.557 -3.955 -1.060 457 HD22 LEU 52 HD22 LEU 52 8.575 -5.364 -0.657 458 HD23 LEU 52 HD23 LEU 52 9.833 -5.495 -1.901 459 H ASN 53 H ASN 53 10.096 -1.131 -3.402 460 HA ASN 53 HA ASN 53 9.375 -0.250 -0.691 461 HB2 ASN 53 HB2 ASN 53 11.673 -0.409 -0.209 462 HB3 ASN 53 HB3 ASN 53 11.296 -1.793 -1.237 463 HD21 ASN 53 HD21 ASN 53 13.661 -0.863 -3.675 464 HD22 ASN 53 HD22 ASN 53 12.524 -2.073 -3.105 465 H ASN 54 H ASN 54 9.722 1.267 -3.713 466 HA ASN 54 HA ASN 54 10.751 3.804 -2.663 467 HB2 ASN 54 HB2 ASN 54 9.738 3.119 -5.446 468 HB3 ASN 54 HB3 ASN 54 10.658 4.547 -4.991 469 HD21 ASN 54 HD21 ASN 54 12.618 1.153 -5.869 470 HD22 ASN 54 HD22 ASN 54 10.923 1.432 -6.254 471 H LEU 55 H LEU 55 7.631 2.421 -3.038 472 HA LEU 55 HA LEU 55 6.068 4.767 -3.450 473 HB2 LEU 55 HB2 LEU 55 4.183 3.371 -2.909 474 HB3 LEU 55 HB3 LEU 55 5.319 2.520 -3.929 475 HG LEU 55 HG LEU 55 6.171 1.452 -1.656 476 HD11 LEU 55 HD11 LEU 55 3.354 2.409 -0.983 477 HD12 LEU 55 HD12 LEU 55 4.152 1.062 -0.175 478 HD13 LEU 55 HD13 LEU 55 4.835 2.683 -0.036 479 HD21 LEU 55 HD21 LEU 55 5.112 0.263 -3.536 480 HD22 LEU 55 HD22 LEU 55 4.522 -0.339 -1.984 481 HD23 LEU 55 HD23 LEU 55 3.503 0.755 -2.952 482 H ASN 56 H ASN 56 4.487 5.722 -2.002 483 HA ASN 56 HA ASN 56 5.639 6.227 0.700 484 HB2 ASN 56 HB2 ASN 56 5.540 8.128 -0.844 485 HB3 ASN 56 HB3 ASN 56 3.803 7.885 -1.054 486 HD21 ASN 56 HD21 ASN 56 3.996 10.564 1.383 487 HD22 ASN 56 HD22 ASN 56 4.151 10.287 -0.348 488 H ALA 57 H ALA 57 4.688 5.230 2.310 489 HA ALA 57 HA ALA 57 2.248 3.795 2.228 490 HB1 ALA 57 HB1 ALA 57 3.855 4.910 4.565 491 HB2 ALA 57 HB2 ALA 57 2.660 3.597 4.659 492 HB3 ALA 57 HB3 ALA 57 4.156 3.363 3.741 493 H THR 58 H THR 58 2.815 7.221 2.955 494 HA THR 58 HA THR 58 0.270 7.772 4.194 495 HB THR 58 HB THR 58 2.148 9.592 2.661 496 HG1 THR 58 HG1 THR 58 2.886 10.098 4.715 497 HG21 THR 58 HG21 THR 58 -0.152 10.226 4.554 498 HG22 THR 58 HG22 THR 58 1.084 11.400 4.034 499 HG23 THR 58 HG23 THR 58 0.004 10.678 2.838 500 H GLU 59 H GLU 59 1.354 7.840 0.770 501 HA GLU 59 HA GLU 59 -1.175 8.763 -0.247 502 HB2 GLU 59 HB2 GLU 59 1.043 7.203 -1.628 503 HB3 GLU 59 HB3 GLU 59 -0.296 7.997 -2.453 504 HG2 GLU 59 HG2 GLU 59 1.938 9.306 -0.874 505 HG3 GLU 59 HG3 GLU 59 1.714 9.353 -2.609 506 H LEU 60 H LEU 60 0.030 5.513 0.452 507 HA LEU 60 HA LEU 60 -2.324 4.093 -0.475 508 HB2 LEU 60 HB2 LEU 60 -0.110 3.501 1.505 509 HB3 LEU 60 HB3 LEU 60 -1.558 2.514 1.516 510 HG LEU 60 HG LEU 60 -1.225 1.902 -0.845 511 HD11 LEU 60 HD11 LEU 60 1.364 3.482 -0.572 512 HD12 LEU 60 HD12 LEU 60 0.981 2.366 -1.904 513 HD13 LEU 60 HD13 LEU 60 0.019 3.836 -1.671 514 HD21 LEU 60 HD21 LEU 60 -0.296 0.500 0.967 515 HD22 LEU 60 HD22 LEU 60 0.752 0.464 -0.463 516 HD23 LEU 60 HD23 LEU 60 1.204 1.452 0.940 517 H SER 61 H SER 61 -1.485 5.240 2.867 518 HA SER 61 HA SER 61 -3.896 4.412 4.053 519 HB2 SER 61 HB2 SER 61 -3.243 5.727 5.941 520 HB3 SER 61 HB3 SER 61 -1.821 4.931 5.249 521 HG SER 61 HG SER 61 -1.276 7.039 5.622 522 H LYS 62 H LYS 62 -3.248 7.308 2.250 523 HA LYS 62 HA LYS 62 -5.589 8.869 2.935 524 HB2 LYS 62 HB2 LYS 62 -3.588 8.831 0.655 525 HB3 LYS 62 HB3 LYS 62 -5.007 9.873 0.560 526 HG2 LYS 62 HG2 LYS 62 -4.427 11.097 2.504 527 HG3 LYS 62 HG3 LYS 62 -3.156 9.964 2.970 528 HD2 LYS 62 HD2 LYS 62 -1.783 10.568 1.069 529 HD3 LYS 62 HD3 LYS 62 -3.064 11.564 0.367 530 HE2 LYS 62 HE2 LYS 62 -1.747 12.111 3.067 531 HE3 LYS 62 HE3 LYS 62 -1.201 12.818 1.543 532 HZ1 LYS 62 HZ1 LYS 62 -3.894 13.231 2.733 533 HZ2 LYS 62 HZ2 LYS 62 -2.688 14.326 2.700 534 HZ3 LYS 62 HZ3 LYS 62 -3.392 13.859 1.307 535 H ARG 63 H ARG 63 -5.224 6.145 0.796 536 HA ARG 63 HA ARG 63 -8.016 6.516 -0.292 537 HB2 ARG 63 HB2 ARG 63 -5.455 5.409 -1.429 538 HB3 ARG 63 HB3 ARG 63 -6.989 4.717 -1.960 539 HG2 ARG 63 HG2 ARG 63 -7.706 6.594 -3.038 540 HG3 ARG 63 HG3 ARG 63 -6.858 7.712 -1.968 541 HD2 ARG 63 HD2 ARG 63 -5.353 5.932 -3.916 542 HD3 ARG 63 HD3 ARG 63 -6.002 7.495 -4.392 543 HE ARG 63 HE ARG 63 -3.865 6.994 -2.357 544 HH11 ARG 63 HH11 ARG 63 -2.563 8.508 -1.861 545 HH12 ARG 63 HH12 ARG 63 -2.618 10.121 -2.524 546 HH21 ARG 63 HH21 ARG 63 -5.635 9.455 -4.162 547 HH22 ARG 63 HH22 ARG 63 -4.505 10.695 -3.685 548 H LEU 64 H LEU 64 -5.826 4.112 1.153 549 HA LEU 64 HA LEU 64 -7.925 2.103 1.429 550 HB2 LEU 64 HB2 LEU 64 -5.117 2.413 2.574 551 HB3 LEU 64 HB3 LEU 64 -6.224 1.149 3.095 552 HG LEU 64 HG LEU 64 -6.436 0.596 0.540 553 HD11 LEU 64 HD11 LEU 64 -3.692 1.891 0.583 554 HD12 LEU 64 HD12 LEU 64 -4.389 0.933 -0.737 555 HD13 LEU 64 HD13 LEU 64 -5.099 2.492 -0.324 556 HD21 LEU 64 HD21 LEU 64 -5.480 -0.865 2.303 557 HD22 LEU 64 HD22 LEU 64 -4.633 -1.005 0.766 558 HD23 LEU 64 HD23 LEU 64 -3.903 -0.066 2.089 559 H ASN 65 H ASN 65 -7.074 4.946 3.213 560 HA ASN 65 HA ASN 65 -7.879 5.934 5.036 561 HB2 ASN 65 HB2 ASN 65 -10.021 5.504 3.718 562 HB3 ASN 65 HB3 ASN 65 -10.361 4.193 4.845 563 HD21 ASN 65 HD21 ASN 65 -11.014 6.481 7.589 564 HD22 ASN 65 HD22 ASN 65 -10.262 4.915 7.256 565 H ILE 66 H ILE 66 -6.008 4.391 5.599 566 HA ILE 66 HA ILE 66 -6.607 2.890 8.114 567 HB ILE 66 HB ILE 66 -4.337 1.736 7.630 568 HG12 ILE 66 HG12 ILE 66 -4.961 2.683 4.823 569 HG13 ILE 66 HG13 ILE 66 -3.582 3.157 5.833 570 HG21 ILE 66 HG21 ILE 66 -6.695 0.969 5.912 571 HG22 ILE 66 HG22 ILE 66 -5.375 -0.075 6.513 572 HG23 ILE 66 HG23 ILE 66 -6.503 0.637 7.660 573 HD11 ILE 66 HD11 ILE 66 -4.109 0.407 4.653 574 HD12 ILE 66 HD12 ILE 66 -2.903 1.593 4.140 575 HD13 ILE 66 HD13 ILE 66 -2.760 0.822 5.746 576 H THR 67 H THR 67 -4.545 2.727 9.394 577 HA THR 67 HA THR 67 -3.468 5.351 10.165 578 HB THR 67 HB THR 67 -3.088 2.479 11.093 579 HG1 THR 67 HG1 THR 67 -4.156 3.278 12.907 580 HG21 THR 67 HG21 THR 67 -1.767 4.987 12.179 581 HG22 THR 67 HG22 THR 67 -1.891 3.438 13.059 582 HG23 THR 67 HG23 THR 67 -0.986 3.507 11.549 583 H VAL 68 H VAL 68 -1.443 6.106 9.530 584 HA VAL 68 HA VAL 68 -0.222 5.148 7.176 585 HB VAL 68 HB VAL 68 1.291 6.685 9.320 586 HG11 VAL 68 HG11 VAL 68 1.446 6.705 6.269 587 HG12 VAL 68 HG12 VAL 68 2.418 7.707 7.364 588 HG13 VAL 68 HG13 VAL 68 2.625 5.955 7.363 589 HG21 VAL 68 HG21 VAL 68 -0.817 7.896 9.040 590 HG22 VAL 68 HG22 VAL 68 0.492 8.774 8.255 591 HG23 VAL 68 HG23 VAL 68 -0.647 7.838 7.271 592 H ASP 69 H ASP 69 0.623 4.445 10.546 593 HA ASP 69 HA ASP 69 2.916 2.851 9.892 594 HB2 ASP 69 HB2 ASP 69 2.519 4.031 12.072 595 HB3 ASP 69 HB3 ASP 69 1.258 2.853 12.442 596 H LYS 70 H LYS 70 -0.502 2.019 9.993 597 HA LYS 70 HA LYS 70 0.023 -0.870 9.935 598 HB2 LYS 70 HB2 LYS 70 -2.468 0.787 9.354 599 HB3 LYS 70 HB3 LYS 70 -2.355 -0.937 8.991 600 HG2 LYS 70 HG2 LYS 70 -1.722 -1.378 11.380 601 HG3 LYS 70 HG3 LYS 70 -2.052 0.325 11.746 602 HD2 LYS 70 HD2 LYS 70 -4.402 0.038 11.042 603 HD3 LYS 70 HD3 LYS 70 -4.063 -1.629 10.526 604 HE2 LYS 70 HE2 LYS 70 -3.405 -2.195 12.873 605 HE3 LYS 70 HE3 LYS 70 -3.854 -0.562 13.378 606 HZ1 LYS 70 HZ1 LYS 70 -5.711 -2.555 12.179 607 HZ2 LYS 70 HZ2 LYS 70 -5.660 -2.145 13.756 608 HZ3 LYS 70 HZ3 LYS 70 -6.137 -1.047 12.648 609 H ALA 71 H ALA 71 -0.287 1.733 7.545 610 HA ALA 71 HA ALA 71 -0.193 -0.067 5.234 611 HB1 ALA 71 HB1 ALA 71 0.655 2.870 5.432 612 HB2 ALA 71 HB2 ALA 71 0.259 1.968 3.959 613 HB3 ALA 71 HB3 ALA 71 -0.996 2.343 5.155 614 H LYS 72 H LYS 72 2.285 1.823 6.972 615 HA LYS 72 HA LYS 72 4.594 1.100 5.507 616 HB2 LYS 72 HB2 LYS 72 4.193 1.786 8.439 617 HB3 LYS 72 HB3 LYS 72 5.789 1.539 7.720 618 HG2 LYS 72 HG2 LYS 72 5.544 3.394 6.239 619 HG3 LYS 72 HG3 LYS 72 3.837 3.581 6.635 620 HD2 LYS 72 HD2 LYS 72 5.292 5.304 7.662 621 HD3 LYS 72 HD3 LYS 72 4.291 4.417 8.817 622 HE2 LYS 72 HE2 LYS 72 6.161 3.063 9.535 623 HE3 LYS 72 HE3 LYS 72 7.198 3.712 8.250 624 HZ1 LYS 72 HZ1 LYS 72 6.094 5.288 10.517 625 HZ2 LYS 72 HZ2 LYS 72 7.641 4.796 10.373 626 HZ3 LYS 72 HZ3 LYS 72 7.043 5.896 9.328 627 H THR 73 H THR 73 3.134 -0.704 8.251 628 HA THR 73 HA THR 73 5.206 -2.795 7.926 629 HB THR 73 HB THR 73 4.361 -2.027 10.161 630 HG1 THR 73 HG1 THR 73 4.635 -4.107 10.941 631 HG21 THR 73 HG21 THR 73 2.096 -4.005 9.634 632 HG22 THR 73 HG22 THR 73 2.441 -3.114 11.130 633 HG23 THR 73 HG23 THR 73 1.888 -2.240 9.695 634 H TYR 74 H TYR 74 1.762 -2.436 7.085 635 HA TYR 74 HA TYR 74 1.245 -5.126 6.375 636 HB2 TYR 74 HB2 TYR 74 -0.519 -3.517 6.665 637 HB3 TYR 74 HB3 TYR 74 0.119 -2.497 5.362 638 HD1 TYR 74 HD1 TYR 74 -0.428 -2.878 3.100 639 HD2 TYR 74 HD2 TYR 74 -1.445 -5.798 6.118 640 HE1 TYR 74 HE1 TYR 74 -1.582 -4.223 1.396 641 HE2 TYR 74 HE2 TYR 74 -2.602 -7.168 4.397 642 HH TYR 74 HH TYR 74 -2.515 -6.316 0.941 643 H ILE 75 H ILE 75 2.646 -2.475 4.421 644 HA ILE 75 HA ILE 75 2.893 -3.628 1.896 645 HB ILE 75 HB ILE 75 4.742 -1.850 3.508 646 HG12 ILE 75 HG12 ILE 75 3.225 -1.089 0.987 647 HG13 ILE 75 HG13 ILE 75 2.395 -1.123 2.528 648 HG21 ILE 75 HG21 ILE 75 5.112 -2.617 0.574 649 HG22 ILE 75 HG22 ILE 75 5.966 -1.301 1.401 650 HG23 ILE 75 HG23 ILE 75 6.242 -2.955 1.906 651 HD11 ILE 75 HD11 ILE 75 4.864 0.573 1.918 652 HD12 ILE 75 HD12 ILE 75 3.196 1.146 2.090 653 HD13 ILE 75 HD13 ILE 75 4.053 0.476 3.483 654 H LYS 76 H LYS 76 5.364 -4.006 4.525 655 HA LYS 76 HA LYS 76 6.720 -6.094 3.029 656 HB2 LYS 76 HB2 LYS 76 8.181 -6.316 4.955 657 HB3 LYS 76 HB3 LYS 76 8.005 -4.636 4.456 658 HG2 LYS 76 HG2 LYS 76 6.493 -4.178 6.322 659 HG3 LYS 76 HG3 LYS 76 6.501 -5.890 6.797 660 HD2 LYS 76 HD2 LYS 76 8.921 -5.761 7.264 661 HD3 LYS 76 HD3 LYS 76 8.927 -4.046 6.791 662 HE2 LYS 76 HE2 LYS 76 7.315 -3.528 8.594 663 HE3 LYS 76 HE3 LYS 76 7.230 -5.235 9.039 664 HZ1 LYS 76 HZ1 LYS 76 9.681 -3.558 9.206 665 HZ2 LYS 76 HZ2 LYS 76 8.765 -4.019 10.476 666 HZ3 LYS 76 HZ3 LYS 76 9.594 -5.137 9.624 667 H ASN 77 H ASN 77 4.253 -6.233 5.561 668 HA ASN 77 HA ASN 77 4.657 -9.033 6.122 669 HB2 ASN 77 HB2 ASN 77 2.462 -7.044 6.718 670 HB3 ASN 77 HB3 ASN 77 2.157 -8.759 6.949 671 HD21 ASN 77 HD21 ASN 77 4.726 -6.889 9.511 672 HD22 ASN 77 HD22 ASN 77 4.256 -6.082 8.025 673 H SER 78 H SER 78 2.628 -7.444 3.678 674 HA SER 78 HA SER 78 1.651 -10.071 2.709 675 HB2 SER 78 HB2 SER 78 1.139 -7.219 1.864 676 HB3 SER 78 HB3 SER 78 0.578 -8.619 0.925 677 HG SER 78 HG SER 78 -1.001 -7.939 2.449 678 H ASN 79 H ASN 79 3.955 -7.581 1.622 679 HA ASN 79 HA ASN 79 5.080 -9.552 -0.282 680 HB2 ASN 79 HB2 ASN 79 5.094 -7.807 -2.101 681 HB3 ASN 79 HB3 ASN 79 3.560 -8.558 -1.721 682 HD21 ASN 79 HD21 ASN 79 3.972 -4.566 -0.882 683 HD22 ASN 79 HD22 ASN 79 5.394 -5.602 -0.784 684 H ARG 80 H ARG 80 6.771 -9.732 1.128 685 HA ARG 80 HA ARG 80 8.770 -7.512 1.082 686 HB2 ARG 80 HB2 ARG 80 10.119 -8.823 2.600 687 HB3 ARG 80 HB3 ARG 80 8.544 -8.474 3.252 688 HG2 ARG 80 HG2 ARG 80 8.968 -11.154 1.898 689 HG3 ARG 80 HG3 ARG 80 9.710 -10.860 3.469 690 HD2 ARG 80 HD2 ARG 80 7.479 -10.244 4.409 691 HD3 ARG 80 HD3 ARG 80 6.734 -10.670 2.873 692 HE ARG 80 HE ARG 80 7.109 -12.954 3.288 693 HH11 ARG 80 HH11 ARG 80 7.276 -14.677 4.681 694 HH12 ARG 80 HH12 ARG 80 7.951 -14.452 6.266 695 HH21 ARG 80 HH21 ARG 80 8.543 -11.099 5.897 696 HH22 ARG 80 HH22 ARG 80 8.649 -12.487 6.944 697 H MET 81 H MET 81 7.965 -9.799 -1.066 698 HA MET 81 HA MET 81 10.584 -10.890 -1.685 699 HB2 MET 81 HB2 MET 81 9.412 -12.254 -3.310 700 HB3 MET 81 HB3 MET 81 8.597 -12.274 -1.752 701 HG2 MET 81 HG2 MET 81 6.878 -10.725 -2.574 702 HG3 MET 81 HG3 MET 81 7.749 -10.517 -4.090 703 HE1 MET 81 HE1 MET 81 5.506 -12.871 -1.902 704 HE2 MET 81 HE2 MET 81 5.422 -14.351 -2.882 705 HE3 MET 81 HE3 MET 81 6.938 -13.918 -2.068 706 H GLY 82 H GLY 82 10.275 -7.925 -2.168 707 HA2 GLY 82 HA2 GLY 82 10.037 -7.537 -5.056 708 HA3 GLY 82 HA3 GLY 82 10.410 -6.304 -3.860 709 H ARG 83 H ARG 83 12.710 -6.810 -2.785 710 HA ARG 83 HA ARG 83 14.709 -7.882 -4.687 711 HB2 ARG 83 HB2 ARG 83 15.083 -5.101 -3.510 712 HB3 ARG 83 HB3 ARG 83 16.274 -6.072 -4.360 713 HG2 ARG 83 HG2 ARG 83 15.645 -4.633 -6.019 714 HG3 ARG 83 HG3 ARG 83 14.620 -6.020 -6.376 715 HD2 ARG 83 HD2 ARG 83 12.722 -4.823 -5.173 716 HD3 ARG 83 HD3 ARG 83 13.825 -3.499 -4.844 717 HE ARG 83 HE ARG 83 13.568 -2.725 -6.995 718 HH11 ARG 83 HH11 ARG 83 12.627 -2.549 -8.981 719 HH12 ARG 83 HH12 ARG 83 11.792 -3.904 -9.677 720 HH21 ARG 83 HH21 ARG 83 12.373 -6.052 -7.066 721 HH22 ARG 83 HH22 ARG 83 11.627 -5.808 -8.620 722 H THR 84 H THR 84 13.889 -9.261 -2.720 723 HA THR 84 HA THR 84 14.516 -10.485 -0.887 724 HB THR 84 HB THR 84 16.955 -11.092 -1.000 725 HG1 THR 84 HG1 THR 84 18.105 -10.321 -2.756 726 HG21 THR 84 HG21 THR 84 15.439 -11.043 -3.643 727 HG22 THR 84 HG22 THR 84 16.746 -12.164 -3.193 728 HG23 THR 84 HG23 THR 84 15.193 -12.225 -2.342 729 H ASN 85 H ASN 85 14.207 -7.694 -0.145 730 HA ASN 85 HA ASN 85 14.759 -6.088 1.316 731 HB2 ASN 85 HB2 ASN 85 13.715 -7.943 2.701 732 HB3 ASN 85 HB3 ASN 85 15.340 -8.401 3.210 733 HD21 ASN 85 HD21 ASN 85 13.714 -4.883 4.620 734 HD22 ASN 85 HD22 ASN 85 13.170 -5.503 3.071 735 H ASN 86 H ASN 86 17.000 -6.912 -0.386 736 HA ASN 86 HA ASN 86 19.341 -6.362 1.329 737 HB2 ASN 86 HB2 ASN 86 20.575 -7.559 -0.089 738 HB3 ASN 86 HB3 ASN 86 19.027 -8.263 -0.529 739 HD21 ASN 86 HD21 ASN 86 19.012 -6.559 -3.743 740 HD22 ASN 86 HD22 ASN 86 17.905 -7.079 -2.476 741 H PHE 87 H PHE 87 17.269 -4.510 -0.511 742 HA PHE 87 HA PHE 87 18.990 -2.823 -1.985 743 HB2 PHE 87 HB2 PHE 87 16.928 -1.598 -2.477 744 HB3 PHE 87 HB3 PHE 87 16.721 -3.331 -2.606 745 HD1 PHE 87 HD1 PHE 87 16.012 -0.408 -0.369 746 HD2 PHE 87 HD2 PHE 87 15.098 -4.522 -1.292 747 HE1 PHE 87 HE1 PHE 87 14.142 -0.360 1.257 748 HE2 PHE 87 HE2 PHE 87 13.194 -4.451 0.299 749 HZ PHE 87 HZ PHE 87 12.733 -2.382 1.598 750 H LYS 88 H LYS 88 19.370 -2.775 1.109 751 HA LYS 88 HA LYS 88 18.688 -0.002 1.873 752 HB2 LYS 88 HB2 LYS 88 19.290 -0.756 4.122 753 HB3 LYS 88 HB3 LYS 88 18.146 -1.849 3.361 754 HG2 LYS 88 HG2 LYS 88 20.773 -2.851 2.726 755 HG3 LYS 88 HG3 LYS 88 20.807 -2.391 4.427 756 HD2 LYS 88 HD2 LYS 88 18.916 -3.866 4.913 757 HD3 LYS 88 HD3 LYS 88 18.639 -4.125 3.189 758 HE2 LYS 88 HE2 LYS 88 19.707 -6.087 4.025 759 HE3 LYS 88 HE3 LYS 88 20.847 -5.243 2.975 760 HZ1 LYS 88 HZ1 LYS 88 20.861 -5.135 5.952 761 HZ2 LYS 88 HZ2 LYS 88 21.905 -5.991 5.039 762 HZ3 LYS 88 HZ3 LYS 88 21.932 -4.361 4.987 763 H THR 89 H THR 89 21.330 -1.426 0.468 764 HA THR 89 HA THR 89 23.345 0.504 1.547 765 HB THR 89 HB THR 89 23.586 -2.523 1.268 766 HG1 THR 89 HG1 THR 89 23.918 -2.361 3.537 767 HG21 THR 89 HG21 THR 89 25.603 -0.446 2.183 768 HG22 THR 89 HG22 THR 89 25.788 -2.213 2.367 769 HG23 THR 89 HG23 THR 89 25.718 -1.500 0.751 770 H ILE 90 H ILE 90 22.584 -1.957 -0.973 771 HA ILE 90 HA ILE 90 24.449 -1.014 -2.947 772 HB ILE 90 HB ILE 90 23.076 -2.288 -4.499 773 HG12 ILE 90 HG12 ILE 90 21.284 -3.125 -2.197 774 HG13 ILE 90 HG13 ILE 90 20.843 -1.790 -3.259 775 HG21 ILE 90 HG21 ILE 90 23.593 -3.850 -1.934 776 HG22 ILE 90 HG22 ILE 90 23.579 -4.478 -3.590 777 HG23 ILE 90 HG23 ILE 90 24.842 -3.353 -3.089 778 HD11 ILE 90 HD11 ILE 90 21.365 -4.649 -4.156 779 HD12 ILE 90 HD12 ILE 90 19.790 -3.838 -4.045 780 HD13 ILE 90 HD13 ILE 90 20.996 -3.285 -5.227 781 H LYS 91 H LYS 91 23.712 -0.124 -5.058 782 HA LYS 91 HA LYS 91 22.816 1.449 -6.410 783 HB2 LYS 91 HB2 LYS 91 20.452 1.668 -4.517 784 HB3 LYS 91 HB3 LYS 91 20.495 2.156 -6.193 785 HG2 LYS 91 HG2 LYS 91 20.845 -0.751 -5.341 786 HG3 LYS 91 HG3 LYS 91 19.272 -0.013 -5.596 787 HD2 LYS 91 HD2 LYS 91 19.720 0.426 -7.898 788 HD3 LYS 91 HD3 LYS 91 21.435 -0.037 -7.733 789 HE2 LYS 91 HE2 LYS 91 20.807 -2.341 -7.217 790 HE3 LYS 91 HE3 LYS 91 19.087 -1.919 -7.240 791 HZ1 LYS 91 HZ1 LYS 91 20.908 -1.767 -9.589 792 HZ2 LYS 91 HZ2 LYS 91 19.784 -2.925 -9.342 793 HZ3 LYS 91 HZ3 LYS 91 19.319 -1.384 -9.608 794 H MET 92 H MET 92 23.245 2.368 -3.097 795 HA MET 92 HA MET 92 23.506 5.250 -3.885 796 HB2 MET 92 HB2 MET 92 22.641 5.831 -1.724 797 HB3 MET 92 HB3 MET 92 21.548 4.679 -2.482 798 HG2 MET 92 HG2 MET 92 22.790 2.852 -1.115 799 HG3 MET 92 HG3 MET 92 23.537 4.183 -0.240 800 HE1 MET 92 HE1 MET 92 20.498 1.872 -0.680 801 HE2 MET 92 HE2 MET 92 19.129 2.809 -0.047 802 HE3 MET 92 HE3 MET 92 19.886 3.276 -1.583 803 H PHE 93 H PHE 93 25.479 2.819 -3.429 804 HA PHE 93 HA PHE 93 27.580 4.277 -1.883 805 HB2 PHE 93 HB2 PHE 93 26.038 2.803 -0.451 806 HB3 PHE 93 HB3 PHE 93 26.684 1.426 -1.334 807 HD1 PHE 93 HD1 PHE 93 28.923 0.589 -0.886 808 HD2 PHE 93 HD2 PHE 93 27.401 4.085 1.110 809 HE1 PHE 93 HE1 PHE 93 30.774 0.438 0.779 810 HE2 PHE 93 HE2 PHE 93 29.246 3.937 2.786 811 HZ PHE 93 HZ PHE 93 30.930 2.112 2.617 812 H GLU 94 H GLU 94 26.715 1.686 -4.140 813 HA GLU 94 HA GLU 94 29.551 1.418 -5.009 814 HB2 GLU 94 HB2 GLU 94 29.155 -0.928 -5.459 815 HB3 GLU 94 HB3 GLU 94 28.915 -0.545 -3.754 816 HG2 GLU 94 HG2 GLU 94 26.468 -0.630 -4.053 817 HG3 GLU 94 HG3 GLU 94 26.672 -0.934 -5.780 818 H ASP 95 H ASP 95 29.819 0.655 -7.233 819 HA ASP 95 HA ASP 95 27.723 1.569 -9.134 820 HB2 ASP 95 HB2 ASP 95 29.155 3.505 -8.513 821 HB3 ASP 95 HB3 ASP 95 30.587 2.595 -8.995 822 H ASP 96 H ASP 96 27.997 0.831 -11.286 823 HA ASP 96 HA ASP 96 29.971 -1.359 -11.765 824 HB2 ASP 96 HB2 ASP 96 26.964 -1.468 -12.214 825 HB3 ASP 96 HB3 ASP 96 28.108 -2.586 -12.947 826 H VAL 97 H VAL 97 30.751 -1.511 -13.791 827 HA VAL 97 HA VAL 97 29.751 0.367 -15.915 828 HB VAL 97 HB VAL 97 32.669 -0.223 -15.288 829 HG11 VAL 97 HG11 VAL 97 31.377 1.692 -17.284 830 HG12 VAL 97 HG12 VAL 97 33.114 1.595 -16.921 831 HG13 VAL 97 HG13 VAL 97 32.304 0.228 -17.684 832 HG21 VAL 97 HG21 VAL 97 31.757 1.261 -13.560 833 HG22 VAL 97 HG22 VAL 97 32.794 2.180 -14.650 834 HG23 VAL 97 HG23 VAL 97 31.026 2.300 -14.802 835 H SER 98 H SER 98 31.782 -2.535 -15.354 836 HA SER 98 HA SER 98 30.891 -3.651 -17.983 837 HB2 SER 98 HB2 SER 98 33.501 -4.140 -16.515 838 HB3 SER 98 HB3 SER 98 33.043 -4.774 -18.106 839 HG SER 98 HG SER 98 34.367 -2.900 -18.260 840 H SER 99 H SER 99 29.732 -3.972 -15.193 841 HA SER 99 HA SER 99 28.884 -5.453 -13.755 842 HB2 SER 99 HB2 SER 99 28.075 -6.573 -15.849 843 HB3 SER 99 HB3 SER 99 29.435 -7.704 -15.695 844 HG SER 99 HG SER 99 27.510 -8.477 -14.686 845 H ALA 100 H ALA 100 29.348 -6.986 -12.132 846 HA ALA 100 HA ALA 100 32.006 -8.201 -11.955 847 HB1 ALA 100 HB1 ALA 100 31.135 -6.052 -9.970 848 HB2 ALA 100 HB2 ALA 100 32.560 -7.100 -9.806 849 HB3 ALA 100 HB3 ALA 100 32.474 -5.926 -11.133 850 H SER 101 H SER 101 31.827 -10.112 -11.026 851 HA SER 101 HA SER 101 29.823 -10.735 -8.933 852 HB2 SER 101 HB2 SER 101 30.043 -12.247 -11.576 853 HB3 SER 101 HB3 SER 101 29.137 -12.801 -10.157 854 HG SER 101 HG SER 101 27.791 -11.740 -11.676 855 H ALA 102 H ALA 102 30.264 -12.783 -7.873 856 HA ALA 102 HA ALA 102 33.109 -13.340 -7.567 857 HB1 ALA 102 HB1 ALA 102 30.667 -14.486 -6.172 858 HB2 ALA 102 HB2 ALA 102 32.358 -14.637 -5.640 859 HB3 ALA 102 HB3 ALA 102 31.578 -13.043 -5.655 860 H GLN 103 H GLN 103 32.206 -14.055 -10.085 861 HA GLN 103 HA GLN 103 32.007 -15.568 -11.720 862 HB2 GLN 103 HB2 GLN 103 33.858 -16.948 -9.793 863 HB3 GLN 103 HB3 GLN 103 33.427 -17.728 -11.310 864 HG2 GLN 103 HG2 GLN 103 34.238 -15.742 -12.569 865 HG3 GLN 103 HG3 GLN 103 34.633 -14.934 -11.051 866 HE21 GLN 103 HE21 GLN 103 37.796 -16.529 -10.814 867 HE22 GLN 103 HE22 GLN 103 36.718 -15.278 -10.212 868 HA PRO 104 HA PRO 104 28.589 -18.313 -11.281 869 HB2 PRO 104 HB2 PRO 104 29.018 -20.318 -13.121 870 HB3 PRO 104 HB3 PRO 104 28.521 -18.653 -13.537 871 HG2 PRO 104 HG2 PRO 104 31.327 -19.807 -13.542 872 HG3 PRO 104 HG3 PRO 104 30.521 -18.843 -14.822 873 HD2 PRO 104 HD2 PRO 104 32.199 -17.675 -13.075 874 HD3 PRO 104 HD3 PRO 104 30.694 -16.847 -13.552 875 H ASN 105 H ASN 105 28.528 -19.208 -9.357 876 HA ASN 105 HA ASN 105 30.084 -21.674 -8.718 877 HB2 ASN 105 HB2 ASN 105 30.916 -19.418 -7.756 878 HB3 ASN 105 HB3 ASN 105 29.484 -19.447 -6.734 879 HD21 ASN 105 HD21 ASN 105 30.756 -22.233 -4.767 880 HD22 ASN 105 HD22 ASN 105 29.247 -21.612 -5.449 881 H LEU 106 H LEU 106 27.694 -21.978 -9.842 882 HA LEU 106 HA LEU 106 25.719 -22.549 -7.676 883 HB2 LEU 106 HB2 LEU 106 25.304 -21.663 -10.556 884 HB3 LEU 106 HB3 LEU 106 24.000 -22.199 -9.508 885 HG LEU 106 HG LEU 106 25.770 -19.775 -8.941 886 HD11 LEU 106 HD11 LEU 106 22.922 -19.940 -10.010 887 HD12 LEU 106 HD12 LEU 106 23.801 -18.454 -9.582 888 HD13 LEU 106 HD13 LEU 106 24.362 -19.451 -10.932 889 HD21 LEU 106 HD21 LEU 106 24.820 -20.702 -6.868 890 HD22 LEU 106 HD22 LEU 106 23.994 -19.202 -7.295 891 HD23 LEU 106 HD23 LEU 106 23.204 -20.762 -7.612 892 HA PRO 107 HA PRO 107 25.845 -26.792 -8.919 893 HB2 PRO 107 HB2 PRO 107 23.369 -27.718 -8.211 894 HB3 PRO 107 HB3 PRO 107 24.620 -27.240 -7.024 895 HG2 PRO 107 HG2 PRO 107 22.300 -25.572 -8.055 896 HG3 PRO 107 HG3 PRO 107 22.804 -25.835 -6.355 897 HD2 PRO 107 HD2 PRO 107 23.559 -23.624 -7.738 898 HD3 PRO 107 HD3 PRO 107 24.676 -24.417 -6.592 Start of MODEL 22 1 H1 GLY -5 H1 GLY -5 20.316 -63.430 -31.805 2 H2 GLY -5 H2 GLY -5 21.795 -63.444 -32.503 3 H3 GLY -5 H3 GLY -5 20.528 -64.160 -33.256 4 HA2 GLY -5 HA2 GLY -5 21.033 -62.060 -34.316 5 HA3 GLY -5 HA3 GLY -5 19.425 -62.054 -33.569 6 H SER -4 H SER -4 19.922 -59.659 -33.808 7 HA SER -4 HA SER -4 21.736 -58.480 -31.809 8 HB2 SER -4 HB2 SER -4 19.818 -57.167 -33.763 9 HB3 SER -4 HB3 SER -4 21.028 -56.341 -32.764 10 HG SER -4 HG SER -4 21.774 -56.767 -34.912 11 H HIS -3 H HIS -3 21.176 -57.477 -29.930 12 HA HIS -3 HA HIS -3 18.350 -56.909 -29.259 13 HB2 HIS -3 HB2 HIS -3 19.006 -59.336 -28.626 14 HB3 HIS -3 HB3 HIS -3 20.015 -58.628 -27.382 15 HD2 HIS -3 HD2 HIS -3 17.966 -56.388 -26.233 16 HE1 HIS -3 HE1 HIS -3 15.327 -59.667 -25.578 17 HE2 HIS -3 HE2 HIS -3 15.842 -57.261 -24.955 18 H MET -2 H MET -2 18.427 -54.841 -28.638 19 HA MET -2 HA MET -2 20.542 -53.868 -26.754 20 HB2 MET -2 HB2 MET -2 19.605 -52.518 -29.317 21 HB3 MET -2 HB3 MET -2 20.573 -51.731 -28.069 22 HG2 MET -2 HG2 MET -2 21.432 -54.216 -29.591 23 HG3 MET -2 HG3 MET -2 21.860 -52.581 -30.055 24 HE1 MET -2 HE1 MET -2 22.876 -50.913 -27.840 25 HE2 MET -2 HE2 MET -2 24.555 -51.450 -27.618 26 HE3 MET -2 HE3 MET -2 23.881 -51.309 -29.254 27 H ALA -1 H ALA -1 19.165 -53.917 -25.022 28 HA ALA -1 HA ALA -1 17.066 -51.824 -24.900 29 HB1 ALA -1 HB1 ALA -1 16.497 -54.758 -24.288 30 HB2 ALA -1 HB2 ALA -1 15.409 -53.389 -23.951 31 HB3 ALA -1 HB3 ALA -1 15.830 -53.799 -25.621 32 H SER 0 H SER 0 17.979 -54.537 -22.749 33 HA SER 0 HA SER 0 18.539 -54.646 -20.583 34 HB2 SER 0 HB2 SER 0 20.586 -53.647 -21.852 35 HB3 SER 0 HB3 SER 0 20.276 -52.211 -20.861 36 HG SER 0 HG SER 0 21.736 -53.697 -19.862 37 H MET 1 H MET 1 16.226 -52.755 -21.161 38 HA MET 1 HA MET 1 15.926 -51.931 -18.342 39 HB2 MET 1 HB2 MET 1 15.232 -49.684 -18.823 40 HB3 MET 1 HB3 MET 1 16.811 -49.943 -19.559 41 HG2 MET 1 HG2 MET 1 15.689 -50.312 -21.765 42 HG3 MET 1 HG3 MET 1 14.129 -49.992 -20.997 43 HE1 MET 1 HE1 MET 1 13.426 -48.144 -22.661 44 HE2 MET 1 HE2 MET 1 14.492 -46.822 -23.186 45 HE3 MET 1 HE3 MET 1 14.903 -48.505 -23.583 46 H ASP 2 H ASP 2 14.465 -53.228 -21.066 47 HA ASP 2 HA ASP 2 11.717 -53.008 -19.878 48 HB2 ASP 2 HB2 ASP 2 12.657 -53.491 -22.721 49 HB3 ASP 2 HB3 ASP 2 10.984 -53.672 -22.209 50 H GLN 3 H GLN 3 14.211 -55.271 -20.112 51 HA GLN 3 HA GLN 3 12.357 -57.608 -20.225 52 HB2 GLN 3 HB2 GLN 3 14.217 -58.900 -20.973 53 HB3 GLN 3 HB3 GLN 3 14.090 -57.451 -21.971 54 HG2 GLN 3 HG2 GLN 3 15.981 -56.413 -20.799 55 HG3 GLN 3 HG3 GLN 3 16.010 -57.719 -19.611 56 HE21 GLN 3 HE21 GLN 3 18.676 -58.974 -21.541 57 HE22 GLN 3 HE22 GLN 3 18.216 -58.139 -20.060 58 H LEU 4 H LEU 4 14.044 -55.882 -17.833 59 HA LEU 4 HA LEU 4 15.152 -58.138 -16.390 60 HB2 LEU 4 HB2 LEU 4 14.810 -55.202 -15.656 61 HB3 LEU 4 HB3 LEU 4 15.441 -56.412 -14.552 62 HG LEU 4 HG LEU 4 17.237 -56.954 -16.291 63 HD11 LEU 4 HD11 LEU 4 16.333 -54.255 -17.397 64 HD12 LEU 4 HD12 LEU 4 17.860 -55.071 -17.793 65 HD13 LEU 4 HD13 LEU 4 16.333 -55.803 -18.273 66 HD21 LEU 4 HD21 LEU 4 17.663 -55.704 -14.214 67 HD22 LEU 4 HD22 LEU 4 18.635 -55.065 -15.545 68 HD23 LEU 4 HD23 LEU 4 17.181 -54.189 -15.010 69 H ASP 5 H ASP 5 14.355 -59.268 -14.706 70 HA ASP 5 HA ASP 5 11.777 -58.490 -13.418 71 HB2 ASP 5 HB2 ASP 5 11.438 -60.042 -15.388 72 HB3 ASP 5 HB3 ASP 5 12.407 -61.247 -14.545 73 H GLU 6 H GLU 6 14.965 -59.377 -12.864 74 HA GLU 6 HA GLU 6 14.429 -60.760 -10.296 75 HB2 GLU 6 HB2 GLU 6 15.986 -61.774 -11.921 76 HB3 GLU 6 HB3 GLU 6 17.015 -60.338 -11.842 77 HG2 GLU 6 HG2 GLU 6 17.358 -60.720 -9.422 78 HG3 GLU 6 HG3 GLU 6 16.261 -62.101 -9.477 79 H ILE 7 H ILE 7 13.610 -59.005 -9.133 80 HA ILE 7 HA ILE 7 15.661 -57.071 -8.166 81 HB ILE 7 HB ILE 7 12.741 -56.300 -8.556 82 HG12 ILE 7 HG12 ILE 7 13.967 -54.586 -10.232 83 HG13 ILE 7 HG13 ILE 7 15.081 -55.929 -10.436 84 HG21 ILE 7 HG21 ILE 7 15.230 -54.689 -7.827 85 HG22 ILE 7 HG22 ILE 7 13.592 -54.036 -8.043 86 HG23 ILE 7 HG23 ILE 7 13.914 -55.144 -6.717 87 HD11 ILE 7 HD11 ILE 7 12.066 -55.925 -10.924 88 HD12 ILE 7 HD12 ILE 7 13.347 -55.978 -12.153 89 HD13 ILE 7 HD13 ILE 7 13.088 -57.362 -11.080 90 H ILE 8 H ILE 8 15.944 -57.254 -6.048 91 HA ILE 8 HA ILE 8 13.767 -58.229 -4.278 92 HB ILE 8 HB ILE 8 16.554 -59.370 -3.979 93 HG12 ILE 8 HG12 ILE 8 14.289 -60.644 -5.576 94 HG13 ILE 8 HG13 ILE 8 15.838 -60.086 -6.220 95 HG21 ILE 8 HG21 ILE 8 13.810 -60.402 -3.097 96 HG22 ILE 8 HG22 ILE 8 15.399 -61.002 -2.574 97 HG23 ILE 8 HG23 ILE 8 14.856 -59.411 -2.069 98 HD11 ILE 8 HD11 ILE 8 15.419 -62.439 -4.354 99 HD12 ILE 8 HD12 ILE 8 15.958 -62.451 -6.038 100 HD13 ILE 8 HD13 ILE 8 17.014 -61.768 -4.785 101 H GLU 9 H GLU 9 14.178 -55.667 -4.432 102 HA GLU 9 HA GLU 9 15.510 -54.913 -1.883 103 HB2 GLU 9 HB2 GLU 9 15.891 -53.455 -4.533 104 HB3 GLU 9 HB3 GLU 9 16.349 -52.821 -2.948 105 HG2 GLU 9 HG2 GLU 9 17.868 -54.785 -2.624 106 HG3 GLU 9 HG3 GLU 9 17.500 -55.312 -4.270 107 H GLN 10 H GLN 10 14.691 -52.997 -0.912 108 HA GLN 10 HA GLN 10 12.081 -51.977 -1.898 109 HB2 GLN 10 HB2 GLN 10 10.980 -52.444 0.167 110 HB3 GLN 10 HB3 GLN 10 11.609 -53.937 -0.505 111 HG2 GLN 10 HG2 GLN 10 12.911 -54.357 1.303 112 HG3 GLN 10 HG3 GLN 10 13.561 -52.722 1.344 113 HE21 GLN 10 HE21 GLN 10 10.978 -51.474 3.580 114 HE22 GLN 10 HE22 GLN 10 11.857 -50.991 2.123 115 H ILE 11 H ILE 11 14.615 -50.666 -1.811 116 HA ILE 11 HA ILE 11 13.977 -48.360 -0.086 117 HB ILE 11 HB ILE 11 16.414 -48.053 0.354 118 HG12 ILE 11 HG12 ILE 11 16.778 -51.049 0.036 119 HG13 ILE 11 HG13 ILE 11 17.120 -49.983 -1.320 120 HG21 ILE 11 HG21 ILE 11 15.045 -50.450 1.649 121 HG22 ILE 11 HG22 ILE 11 16.335 -49.469 2.375 122 HG23 ILE 11 HG23 ILE 11 14.754 -48.748 2.047 123 HD11 ILE 11 HD11 ILE 11 18.440 -49.753 1.413 124 HD12 ILE 11 HD12 ILE 11 19.158 -50.440 -0.060 125 HD13 ILE 11 HD13 ILE 11 18.750 -48.713 -0.001 126 H GLN 12 H GLN 12 13.813 -46.668 -1.178 127 HA GLN 12 HA GLN 12 15.367 -46.205 -3.694 128 HB2 GLN 12 HB2 GLN 12 12.454 -45.449 -3.261 129 HB3 GLN 12 HB3 GLN 12 13.450 -45.076 -4.659 130 HG2 GLN 12 HG2 GLN 12 12.086 -46.872 -5.310 131 HG3 GLN 12 HG3 GLN 12 13.699 -47.548 -5.091 132 HE21 GLN 12 HE21 GLN 12 10.881 -48.551 -2.212 133 HE22 GLN 12 HE22 GLN 12 10.880 -46.907 -2.831 134 H LYS 13 H LYS 13 13.129 -43.836 -2.448 135 HA LYS 13 HA LYS 13 15.145 -42.288 -0.956 136 HB2 LYS 13 HB2 LYS 13 15.517 -41.796 -3.393 137 HB3 LYS 13 HB3 LYS 13 13.882 -41.146 -3.493 138 HG2 LYS 13 HG2 LYS 13 14.452 -39.387 -1.865 139 HG3 LYS 13 HG3 LYS 13 16.040 -40.098 -1.591 140 HD2 LYS 13 HD2 LYS 13 15.053 -39.013 -4.268 141 HD3 LYS 13 HD3 LYS 13 15.994 -38.070 -3.119 142 HE2 LYS 13 HE2 LYS 13 16.958 -40.653 -4.436 143 HE3 LYS 13 HE3 LYS 13 17.320 -39.031 -5.020 144 HZ1 LYS 13 HZ1 LYS 13 18.135 -40.087 -2.366 145 HZ2 LYS 13 HZ2 LYS 13 19.119 -39.855 -3.643 146 HZ3 LYS 13 HZ3 LYS 13 18.437 -38.573 -2.904 147 H GLU 14 H GLU 14 13.383 -43.215 0.476 148 HA GLU 14 HA GLU 14 10.733 -42.041 0.272 149 HB2 GLU 14 HB2 GLU 14 11.329 -44.442 0.908 150 HB3 GLU 14 HB3 GLU 14 11.752 -43.817 2.506 151 HG2 GLU 14 HG2 GLU 14 9.397 -42.928 2.712 152 HG3 GLU 14 HG3 GLU 14 9.041 -43.590 1.120 153 H ALA 15 H ALA 15 12.118 -39.881 0.497 154 HA ALA 15 HA ALA 15 12.195 -39.001 3.328 155 HB1 ALA 15 HB1 ALA 15 13.421 -37.810 0.819 156 HB2 ALA 15 HB2 ALA 15 13.719 -37.274 2.494 157 HB3 ALA 15 HB3 ALA 15 14.249 -38.890 1.966 158 H ILE 16 H ILE 16 9.893 -38.952 1.153 159 HA ILE 16 HA ILE 16 9.002 -36.153 1.535 160 HB ILE 16 HB ILE 16 8.494 -38.301 -0.510 161 HG12 ILE 16 HG12 ILE 16 9.335 -36.107 -1.946 162 HG13 ILE 16 HG13 ILE 16 10.165 -35.805 -0.434 163 HG21 ILE 16 HG21 ILE 16 7.163 -35.561 -0.361 164 HG22 ILE 16 HG22 ILE 16 7.166 -36.581 -1.826 165 HG23 ILE 16 HG23 ILE 16 6.366 -37.153 -0.374 166 HD11 ILE 16 HD11 ILE 16 10.350 -38.357 -2.109 167 HD12 ILE 16 HD12 ILE 16 11.538 -37.042 -2.085 168 HD13 ILE 16 HD13 ILE 16 11.292 -38.025 -0.639 169 H ASN 17 H ASN 17 8.535 -38.856 3.092 170 HA ASN 17 HA ASN 17 5.593 -38.608 3.405 171 HB2 ASN 17 HB2 ASN 17 7.523 -40.850 4.106 172 HB3 ASN 17 HB3 ASN 17 5.834 -40.855 4.596 173 HD21 ASN 17 HD21 ASN 17 6.704 -41.784 0.761 174 HD22 ASN 17 HD22 ASN 17 7.980 -41.387 1.903 175 H SER 18 H SER 18 7.953 -37.028 4.847 176 HA SER 18 HA SER 18 6.599 -37.035 7.550 177 HB2 SER 18 HB2 SER 18 8.685 -38.466 7.426 178 HB3 SER 18 HB3 SER 18 9.608 -36.980 7.151 179 HG SER 18 HG SER 18 9.496 -37.637 9.382 180 H ASN 19 H ASN 19 8.157 -35.132 5.090 181 HA ASN 19 HA ASN 19 8.539 -32.759 6.759 182 HB2 ASN 19 HB2 ASN 19 9.651 -31.913 4.714 183 HB3 ASN 19 HB3 ASN 19 10.283 -33.487 5.177 184 HD21 ASN 19 HD21 ASN 19 9.472 -33.344 1.456 185 HD22 ASN 19 HD22 ASN 19 10.290 -32.157 2.472 186 H VAL 20 H VAL 20 5.992 -33.900 4.865 187 HA VAL 20 HA VAL 20 5.029 -31.239 3.983 188 HB VAL 20 HB VAL 20 3.987 -34.051 3.507 189 HG11 VAL 20 HG11 VAL 20 3.029 -31.414 2.304 190 HG12 VAL 20 HG12 VAL 20 2.581 -33.030 1.714 191 HG13 VAL 20 HG13 VAL 20 2.076 -32.520 3.323 192 HG21 VAL 20 HG21 VAL 20 6.102 -33.598 2.350 193 HG22 VAL 20 HG22 VAL 20 4.780 -33.658 1.191 194 HG23 VAL 20 HG23 VAL 20 5.445 -32.085 1.689 195 H VAL 21 H VAL 21 4.330 -33.519 6.545 196 HA VAL 21 HA VAL 21 1.689 -32.302 7.070 197 HB VAL 21 HB VAL 21 2.753 -34.819 8.373 198 HG11 VAL 21 HG11 VAL 21 -0.078 -33.840 7.721 199 HG12 VAL 21 HG12 VAL 21 0.340 -35.365 8.530 200 HG13 VAL 21 HG13 VAL 21 0.653 -33.830 9.336 201 HG21 VAL 21 HG21 VAL 21 2.905 -35.247 5.969 202 HG22 VAL 21 HG22 VAL 21 1.496 -36.077 6.615 203 HG23 VAL 21 HG23 VAL 21 1.283 -34.562 5.712 204 H LEU 22 H LEU 22 3.543 -30.535 7.665 205 HA LEU 22 HA LEU 22 3.315 -30.247 10.622 206 HB2 LEU 22 HB2 LEU 22 5.822 -29.909 8.935 207 HB3 LEU 22 HB3 LEU 22 5.645 -29.150 10.517 208 HG LEU 22 HG LEU 22 5.543 -32.160 10.023 209 HD11 LEU 22 HD11 LEU 22 7.737 -30.406 11.204 210 HD12 LEU 22 HD12 LEU 22 7.757 -32.181 11.082 211 HD13 LEU 22 HD13 LEU 22 7.773 -31.197 9.611 212 HD21 LEU 22 HD21 LEU 22 4.283 -31.566 12.057 213 HD22 LEU 22 HD22 LEU 22 5.822 -32.297 12.502 214 HD23 LEU 22 HD23 LEU 22 5.622 -30.534 12.613 215 H LYS 23 H LYS 23 2.478 -28.424 11.227 216 HA LYS 23 HA LYS 23 2.475 -25.990 9.486 217 HB2 LYS 23 HB2 LYS 23 0.121 -27.508 10.677 218 HB3 LYS 23 HB3 LYS 23 -0.046 -25.827 10.223 219 HG2 LYS 23 HG2 LYS 23 0.831 -28.004 8.295 220 HG3 LYS 23 HG3 LYS 23 -0.832 -27.480 8.507 221 HD2 LYS 23 HD2 LYS 23 1.437 -25.666 7.562 222 HD3 LYS 23 HD3 LYS 23 0.260 -26.470 6.522 223 HE2 LYS 23 HE2 LYS 23 -1.594 -25.275 7.658 224 HE3 LYS 23 HE3 LYS 23 -0.430 -24.444 8.698 225 HZ1 LYS 23 HZ1 LYS 23 -0.534 -24.193 5.739 226 HZ2 LYS 23 HZ2 LYS 23 -1.067 -23.074 6.798 227 HZ3 LYS 23 HZ3 LYS 23 0.525 -23.415 6.713 228 H ASN 24 H ASN 24 3.796 -26.748 12.104 229 HA ASN 24 HA ASN 24 4.246 -25.939 14.192 230 HB2 ASN 24 HB2 ASN 24 5.169 -24.259 12.617 231 HB3 ASN 24 HB3 ASN 24 3.723 -23.276 12.835 232 HD21 ASN 24 HD21 ASN 24 4.676 -22.131 16.081 233 HD22 ASN 24 HD22 ASN 24 3.277 -22.529 15.072 234 HA PRO 25 HA PRO 25 -0.240 -25.575 15.262 235 HB2 PRO 25 HB2 PRO 25 -0.656 -27.876 16.639 236 HB3 PRO 25 HB3 PRO 25 -0.447 -27.844 14.867 237 HG2 PRO 25 HG2 PRO 25 1.691 -28.408 16.956 238 HG3 PRO 25 HG3 PRO 25 1.259 -29.400 15.525 239 HD2 PRO 25 HD2 PRO 25 3.301 -27.597 15.467 240 HD3 PRO 25 HD3 PRO 25 2.251 -27.872 14.045 241 H ARG 26 H ARG 26 0.745 -23.723 16.430 242 HA ARG 26 HA ARG 26 0.085 -23.975 19.342 243 HB2 ARG 26 HB2 ARG 26 2.629 -22.848 18.171 244 HB3 ARG 26 HB3 ARG 26 1.916 -22.053 19.581 245 HG2 ARG 26 HG2 ARG 26 1.895 -24.164 20.830 246 HG3 ARG 26 HG3 ARG 26 2.642 -25.012 19.467 247 HD2 ARG 26 HD2 ARG 26 3.924 -22.569 20.751 248 HD3 ARG 26 HD3 ARG 26 4.143 -24.171 21.435 249 HE ARG 26 HE ARG 26 5.292 -23.132 18.932 250 HH11 ARG 26 HH11 ARG 26 6.869 -24.327 17.904 251 HH12 ARG 26 HH12 ARG 26 7.190 -25.957 18.414 252 HH21 ARG 26 HH21 ARG 26 4.766 -26.031 20.833 253 HH22 ARG 26 HH22 ARG 26 6.035 -26.905 20.020 254 H VAL 27 H VAL 27 0.763 -21.458 16.875 255 HA VAL 27 HA VAL 27 -1.779 -20.105 17.592 256 HB VAL 27 HB VAL 27 0.877 -18.635 17.543 257 HG11 VAL 27 HG11 VAL 27 -1.990 -17.660 17.977 258 HG12 VAL 27 HG12 VAL 27 -0.527 -16.680 18.216 259 HG13 VAL 27 HG13 VAL 27 -0.942 -17.252 16.604 260 HG21 VAL 27 HG21 VAL 27 0.613 -19.804 19.678 261 HG22 VAL 27 HG22 VAL 27 0.334 -18.079 19.903 262 HG23 VAL 27 HG23 VAL 27 -1.051 -19.192 19.837 263 HA PRO 28 HA PRO 28 -1.388 -19.828 13.015 264 HB2 PRO 28 HB2 PRO 28 -4.047 -19.725 12.436 265 HB3 PRO 28 HB3 PRO 28 -3.207 -21.255 12.833 266 HG2 PRO 28 HG2 PRO 28 -4.842 -19.499 14.687 267 HG3 PRO 28 HG3 PRO 28 -4.929 -21.281 14.477 268 HD2 PRO 28 HD2 PRO 28 -3.539 -20.064 16.483 269 HD3 PRO 28 HD3 PRO 28 -3.008 -21.613 15.758 270 H THR 29 H THR 29 -2.103 -18.120 11.505 271 HA THR 29 HA THR 29 -2.632 -15.524 12.777 272 HB THR 29 HB THR 29 -0.288 -15.608 12.924 273 HG1 THR 29 HG1 THR 29 0.167 -13.788 11.699 274 HG21 THR 29 HG21 THR 29 -0.053 -16.059 9.922 275 HG22 THR 29 HG22 THR 29 1.259 -15.827 11.091 276 HG23 THR 29 HG23 THR 29 0.266 -17.287 11.167 277 H GLN 30 H GLN 30 -4.413 -15.177 11.891 278 HA GLN 30 HA GLN 30 -4.780 -15.268 8.934 279 HB2 GLN 30 HB2 GLN 30 -6.895 -16.402 9.248 280 HB3 GLN 30 HB3 GLN 30 -5.656 -17.255 10.162 281 HG2 GLN 30 HG2 GLN 30 -6.509 -15.696 12.173 282 HG3 GLN 30 HG3 GLN 30 -7.951 -15.560 11.174 283 HE21 GLN 30 HE21 GLN 30 -7.113 -19.058 13.143 284 HE22 GLN 30 HE22 GLN 30 -5.941 -17.747 13.117 285 H LYS 31 H LYS 31 -4.327 -12.966 10.716 286 HA LYS 31 HA LYS 31 -6.885 -11.483 10.704 287 HB2 LYS 31 HB2 LYS 31 -5.357 -11.791 12.691 288 HB3 LYS 31 HB3 LYS 31 -4.194 -10.751 11.891 289 HG2 LYS 31 HG2 LYS 31 -6.582 -9.245 11.757 290 HG3 LYS 31 HG3 LYS 31 -6.762 -10.118 13.274 291 HD2 LYS 31 HD2 LYS 31 -5.742 -8.007 13.768 292 HD3 LYS 31 HD3 LYS 31 -4.478 -9.237 13.962 293 HE2 LYS 31 HE2 LYS 31 -3.665 -8.728 11.646 294 HE3 LYS 31 HE3 LYS 31 -4.939 -7.533 11.462 295 HZ1 LYS 31 HZ1 LYS 31 -2.750 -7.389 13.476 296 HZ2 LYS 31 HZ2 LYS 31 -2.845 -6.486 12.119 297 HZ3 LYS 31 HZ3 LYS 31 -3.938 -6.278 13.316 298 H THR 32 H THR 32 -6.776 -11.472 8.325 299 HA THR 32 HA THR 32 -5.385 -9.075 7.223 300 HB THR 32 HB THR 32 -3.924 -11.050 7.053 301 HG1 THR 32 HG1 THR 32 -3.370 -10.697 4.926 302 HG21 THR 32 HG21 THR 32 -5.944 -12.141 5.056 303 HG22 THR 32 HG22 THR 32 -4.333 -12.797 5.412 304 HG23 THR 32 HG23 THR 32 -5.585 -12.823 6.659 305 H GLY 33 H GLY 33 -8.236 -9.679 7.779 306 HA2 GLY 33 HA2 GLY 33 -9.610 -10.094 5.249 307 HA3 GLY 33 HA3 GLY 33 -10.331 -9.698 6.806 308 H GLU 34 H GLU 34 -7.903 -7.462 5.881 309 HA GLU 34 HA GLU 34 -9.924 -5.349 5.786 310 HB2 GLU 34 HB2 GLU 34 -6.888 -5.297 5.902 311 HB3 GLU 34 HB3 GLU 34 -7.902 -3.861 5.987 312 HG2 GLU 34 HG2 GLU 34 -7.990 -6.151 7.996 313 HG3 GLU 34 HG3 GLU 34 -7.102 -4.650 8.200 314 H LEU 35 H LEU 35 -8.765 -7.121 3.215 315 HA LEU 35 HA LEU 35 -8.955 -4.819 1.372 316 HB2 LEU 35 HB2 LEU 35 -7.028 -7.172 1.223 317 HB3 LEU 35 HB3 LEU 35 -7.469 -6.160 -0.145 318 HG LEU 35 HG LEU 35 -6.782 -4.173 1.528 319 HD11 LEU 35 HD11 LEU 35 -4.975 -6.460 2.403 320 HD12 LEU 35 HD12 LEU 35 -4.778 -4.742 2.814 321 HD13 LEU 35 HD13 LEU 35 -6.171 -5.639 3.427 322 HD21 LEU 35 HD21 LEU 35 -5.865 -4.619 -0.713 323 HD22 LEU 35 HD22 LEU 35 -4.591 -4.169 0.435 324 HD23 LEU 35 HD23 LEU 35 -4.808 -5.873 -0.036 325 H SER 36 H SER 36 -10.478 -4.924 0.121 326 HA SER 36 HA SER 36 -12.004 -7.437 -0.482 327 HB2 SER 36 HB2 SER 36 -12.951 -4.570 -0.555 328 HB3 SER 36 HB3 SER 36 -13.904 -6.005 -0.984 329 HG SER 36 HG SER 36 -14.255 -5.331 1.191 330 H GLU 37 H GLU 37 -11.644 -4.428 -2.275 331 HA GLU 37 HA GLU 37 -10.592 -5.868 -4.594 332 HB2 GLU 37 HB2 GLU 37 -13.334 -6.014 -4.202 333 HB3 GLU 37 HB3 GLU 37 -13.210 -4.536 -5.176 334 HG2 GLU 37 HG2 GLU 37 -11.605 -5.936 -6.679 335 HG3 GLU 37 HG3 GLU 37 -12.202 -7.332 -5.774 336 H GLU 38 H GLU 38 -12.081 -2.883 -3.362 337 HA GLU 38 HA GLU 38 -10.787 -1.144 -5.310 338 HB2 GLU 38 HB2 GLU 38 -11.914 -0.584 -2.536 339 HB3 GLU 38 HB3 GLU 38 -11.327 0.651 -3.658 340 HG2 GLU 38 HG2 GLU 38 -13.007 -0.088 -5.345 341 HG3 GLU 38 HG3 GLU 38 -13.642 -1.263 -4.192 342 H GLN 39 H GLN 39 -9.794 -2.599 -2.242 343 HA GLN 39 HA GLN 39 -7.675 -0.758 -1.688 344 HB2 GLN 39 HB2 GLN 39 -8.209 -3.587 -0.685 345 HB3 GLN 39 HB3 GLN 39 -6.959 -2.520 -0.056 346 HG2 GLN 39 HG2 GLN 39 -8.779 -2.318 1.444 347 HG3 GLN 39 HG3 GLN 39 -8.700 -0.822 0.520 348 HE21 GLN 39 HE21 GLN 39 -12.202 -1.219 0.151 349 HE22 GLN 39 HE22 GLN 39 -10.903 -0.306 0.923 350 H LYS 40 H LYS 40 -7.601 -3.998 -3.219 351 HA LYS 40 HA LYS 40 -4.729 -3.850 -3.695 352 HB2 LYS 40 HB2 LYS 40 -5.023 -5.934 -4.941 353 HB3 LYS 40 HB3 LYS 40 -5.788 -5.961 -3.357 354 HG2 LYS 40 HG2 LYS 40 -7.956 -5.210 -4.748 355 HG3 LYS 40 HG3 LYS 40 -7.037 -5.839 -6.104 356 HD2 LYS 40 HD2 LYS 40 -8.617 -7.491 -5.192 357 HD3 LYS 40 HD3 LYS 40 -6.956 -8.065 -4.999 358 HE2 LYS 40 HE2 LYS 40 -6.971 -7.565 -2.618 359 HE3 LYS 40 HE3 LYS 40 -8.484 -6.668 -2.740 360 HZ1 LYS 40 HZ1 LYS 40 -8.295 -9.569 -3.340 361 HZ2 LYS 40 HZ2 LYS 40 -8.724 -8.975 -1.879 362 HZ3 LYS 40 HZ3 LYS 40 -9.664 -8.666 -3.169 363 H LYS 41 H LYS 41 -7.492 -2.682 -5.474 364 HA LYS 41 HA LYS 41 -5.981 -1.861 -7.837 365 HB2 LYS 41 HB2 LYS 41 -8.617 -0.834 -6.733 366 HB3 LYS 41 HB3 LYS 41 -7.944 -0.414 -8.306 367 HG2 LYS 41 HG2 LYS 41 -8.117 -2.689 -9.099 368 HG3 LYS 41 HG3 LYS 41 -8.556 -3.269 -7.494 369 HD2 LYS 41 HD2 LYS 41 -10.595 -1.678 -7.645 370 HD3 LYS 41 HD3 LYS 41 -10.223 -1.562 -9.377 371 HE2 LYS 41 HE2 LYS 41 -10.414 -4.043 -9.561 372 HE3 LYS 41 HE3 LYS 41 -10.685 -4.145 -7.817 373 HZ1 LYS 41 HZ1 LYS 41 -12.518 -2.948 -9.815 374 HZ2 LYS 41 HZ2 LYS 41 -12.810 -4.227 -8.820 375 HZ3 LYS 41 HZ3 LYS 41 -12.707 -2.728 -8.205 376 H ILE 42 H ILE 42 -5.581 -0.883 -4.717 377 HA ILE 42 HA ILE 42 -4.274 1.664 -5.605 378 HB ILE 42 HB ILE 42 -5.378 0.836 -2.925 379 HG12 ILE 42 HG12 ILE 42 -6.126 3.427 -4.262 380 HG13 ILE 42 HG13 ILE 42 -6.776 1.964 -4.980 381 HG21 ILE 42 HG21 ILE 42 -3.790 3.361 -3.528 382 HG22 ILE 42 HG22 ILE 42 -4.668 3.016 -2.019 383 HG23 ILE 42 HG23 ILE 42 -3.292 2.023 -2.472 384 HD11 ILE 42 HD11 ILE 42 -7.129 2.771 -2.086 385 HD12 ILE 42 HD12 ILE 42 -8.363 2.765 -3.377 386 HD13 ILE 42 HD13 ILE 42 -7.669 1.241 -2.803 387 H VAL 43 H VAL 43 -3.835 -1.269 -3.493 388 HA VAL 43 HA VAL 43 -1.038 -0.704 -3.063 389 HB VAL 43 HB VAL 43 -2.454 -3.375 -2.762 390 HG11 VAL 43 HG11 VAL 43 0.154 -2.330 -1.554 391 HG12 VAL 43 HG12 VAL 43 -0.604 -3.903 -1.209 392 HG13 VAL 43 HG13 VAL 43 0.038 -3.574 -2.810 393 HG21 VAL 43 HG21 VAL 43 -3.483 -1.571 -1.351 394 HG22 VAL 43 HG22 VAL 43 -2.719 -2.854 -0.422 395 HG23 VAL 43 HG23 VAL 43 -1.897 -1.296 -0.612 396 H ALA 44 H ALA 44 -2.509 -3.330 -5.096 397 HA ALA 44 HA ALA 44 0.066 -4.063 -6.185 398 HB1 ALA 44 HB1 ALA 44 -2.732 -4.738 -7.190 399 HB2 ALA 44 HB2 ALA 44 -1.222 -5.564 -7.610 400 HB3 ALA 44 HB3 ALA 44 -1.833 -5.642 -5.947 401 H ASP 45 H ASP 45 -2.584 -1.984 -7.270 402 HA ASP 45 HA ASP 45 -1.544 -1.155 -9.786 403 HB2 ASP 45 HB2 ASP 45 -3.821 -0.728 -8.834 404 HB3 ASP 45 HB3 ASP 45 -3.103 0.472 -7.752 405 H TYR 46 H TYR 46 -0.372 -0.248 -6.549 406 HA TYR 46 HA TYR 46 1.261 1.958 -7.617 407 HB2 TYR 46 HB2 TYR 46 0.168 1.690 -5.242 408 HB3 TYR 46 HB3 TYR 46 1.603 0.764 -4.863 409 HD1 TYR 46 HD1 TYR 46 0.661 3.206 -3.441 410 HD2 TYR 46 HD2 TYR 46 3.321 2.800 -6.790 411 HE1 TYR 46 HE1 TYR 46 1.674 5.429 -2.915 412 HE2 TYR 46 HE2 TYR 46 4.338 4.961 -6.301 413 HH TYR 46 HH TYR 46 3.219 7.018 -3.549 414 H ILE 47 H ILE 47 1.716 -1.396 -6.458 415 HA ILE 47 HA ILE 47 4.537 -1.561 -6.747 416 HB ILE 47 HB ILE 47 2.250 -3.469 -6.585 417 HG12 ILE 47 HG12 ILE 47 3.404 -4.345 -4.702 418 HG13 ILE 47 HG13 ILE 47 4.940 -3.646 -5.198 419 HG21 ILE 47 HG21 ILE 47 4.994 -4.373 -7.494 420 HG22 ILE 47 HG22 ILE 47 3.727 -5.437 -6.865 421 HG23 ILE 47 HG23 ILE 47 3.460 -4.567 -8.382 422 HD11 ILE 47 HD11 ILE 47 2.561 -2.050 -4.160 423 HD12 ILE 47 HD12 ILE 47 4.043 -2.473 -3.267 424 HD13 ILE 47 HD13 ILE 47 4.127 -1.390 -4.661 425 H SER 48 H SER 48 2.028 -1.854 -9.274 426 HA SER 48 HA SER 48 3.992 -2.467 -11.328 427 HB2 SER 48 HB2 SER 48 2.147 -2.234 -12.900 428 HB3 SER 48 HB3 SER 48 1.753 -3.296 -11.542 429 HG SER 48 HG SER 48 0.065 -1.804 -12.059 430 H GLU 49 H GLU 49 3.487 0.534 -9.768 431 HA GLU 49 HA GLU 49 4.193 2.110 -12.209 432 HB2 GLU 49 HB2 GLU 49 3.392 2.919 -9.390 433 HB3 GLU 49 HB3 GLU 49 3.887 4.055 -10.640 434 HG2 GLU 49 HG2 GLU 49 1.591 2.129 -11.038 435 HG3 GLU 49 HG3 GLU 49 1.390 3.678 -10.225 436 H VAL 50 H VAL 50 5.268 1.700 -8.842 437 HA VAL 50 HA VAL 50 7.905 2.899 -9.596 438 HB VAL 50 HB VAL 50 8.027 3.856 -7.419 439 HG11 VAL 50 HG11 VAL 50 5.217 4.327 -8.417 440 HG12 VAL 50 HG12 VAL 50 6.267 5.426 -7.495 441 HG13 VAL 50 HG13 VAL 50 6.682 5.004 -9.161 442 HG21 VAL 50 HG21 VAL 50 7.100 2.110 -6.014 443 HG22 VAL 50 HG22 VAL 50 6.228 3.625 -5.764 444 HG23 VAL 50 HG23 VAL 50 5.498 2.328 -6.736 445 H GLY 51 H GLY 51 6.653 -0.047 -8.282 446 HA2 GLY 51 HA2 GLY 51 8.331 -1.825 -8.906 447 HA3 GLY 51 HA3 GLY 51 9.450 -1.022 -7.804 448 H LEU 52 H LEU 52 8.760 -0.807 -5.566 449 HA LEU 52 HA LEU 52 6.557 -2.267 -4.440 450 HB2 LEU 52 HB2 LEU 52 8.060 -4.190 -5.050 451 HB3 LEU 52 HB3 LEU 52 9.331 -3.533 -4.041 452 HG LEU 52 HG LEU 52 6.725 -3.784 -2.668 453 HD11 LEU 52 HD11 LEU 52 8.175 -6.293 -3.632 454 HD12 LEU 52 HD12 LEU 52 6.849 -6.265 -2.456 455 HD13 LEU 52 HD13 LEU 52 6.547 -5.766 -4.126 456 HD21 LEU 52 HD21 LEU 52 8.799 -3.315 -1.443 457 HD22 LEU 52 HD22 LEU 52 8.050 -4.803 -0.891 458 HD23 LEU 52 HD23 LEU 52 9.465 -4.885 -1.959 459 H ASN 53 H ASN 53 9.799 -1.208 -3.834 460 HA ASN 53 HA ASN 53 9.256 -0.311 -1.076 461 HB2 ASN 53 HB2 ASN 53 11.802 -0.673 -2.705 462 HB3 ASN 53 HB3 ASN 53 11.795 0.001 -1.082 463 HD21 ASN 53 HD21 ASN 53 11.780 -3.961 -1.404 464 HD22 ASN 53 HD22 ASN 53 12.110 -2.903 -2.768 465 H ASN 54 H ASN 54 9.432 1.247 -4.127 466 HA ASN 54 HA ASN 54 10.564 3.729 -3.087 467 HB2 ASN 54 HB2 ASN 54 9.487 3.085 -5.847 468 HB3 ASN 54 HB3 ASN 54 10.490 4.469 -5.412 469 HD21 ASN 54 HD21 ASN 54 12.263 0.988 -6.314 470 HD22 ASN 54 HD22 ASN 54 10.611 1.419 -6.756 471 H LEU 55 H LEU 55 7.379 2.508 -3.380 472 HA LEU 55 HA LEU 55 5.929 5.025 -3.222 473 HB2 LEU 55 HB2 LEU 55 4.053 3.612 -2.593 474 HB3 LEU 55 HB3 LEU 55 4.893 2.981 -3.992 475 HG LEU 55 HG LEU 55 6.124 1.491 -2.084 476 HD11 LEU 55 HD11 LEU 55 3.304 1.975 -1.019 477 HD12 LEU 55 HD12 LEU 55 4.423 0.706 -0.483 478 HD13 LEU 55 HD13 LEU 55 4.817 2.403 -0.191 479 HD21 LEU 55 HD21 LEU 55 4.967 0.642 -4.086 480 HD22 LEU 55 HD22 LEU 55 4.527 -0.274 -2.641 481 HD23 LEU 55 HD23 LEU 55 3.393 0.920 -3.305 482 H ASN 56 H ASN 56 4.628 5.587 -1.211 483 HA ASN 56 HA ASN 56 6.124 4.992 1.287 484 HB2 ASN 56 HB2 ASN 56 5.985 7.206 2.051 485 HB3 ASN 56 HB3 ASN 56 6.622 7.284 0.421 486 HD21 ASN 56 HD21 ASN 56 4.303 9.965 0.159 487 HD22 ASN 56 HD22 ASN 56 5.996 9.546 0.400 488 H ALA 57 H ALA 57 4.820 5.535 3.218 489 HA ALA 57 HA ALA 57 2.410 3.885 3.161 490 HB1 ALA 57 HB1 ALA 57 3.981 5.337 5.331 491 HB2 ALA 57 HB2 ALA 57 2.643 4.212 5.634 492 HB3 ALA 57 HB3 ALA 57 4.134 3.625 4.866 493 H THR 58 H THR 58 3.145 7.333 3.347 494 HA THR 58 HA THR 58 0.742 8.299 4.491 495 HB THR 58 HB THR 58 2.499 9.716 2.450 496 HG1 THR 58 HG1 THR 58 3.670 10.396 4.259 497 HG21 THR 58 HG21 THR 58 0.773 10.750 4.746 498 HG22 THR 58 HG22 THR 58 1.860 11.742 3.742 499 HG23 THR 58 HG23 THR 58 0.455 10.959 3.009 500 H GLU 59 H GLU 59 1.646 7.994 1.010 501 HA GLU 59 HA GLU 59 -0.901 8.862 -0.026 502 HB2 GLU 59 HB2 GLU 59 1.249 7.065 -1.217 503 HB3 GLU 59 HB3 GLU 59 -0.122 7.707 -2.122 504 HG2 GLU 59 HG2 GLU 59 2.022 9.413 -0.779 505 HG3 GLU 59 HG3 GLU 59 1.999 8.959 -2.472 506 H LEU 60 H LEU 60 0.342 5.615 0.785 507 HA LEU 60 HA LEU 60 -1.970 4.172 -0.027 508 HB2 LEU 60 HB2 LEU 60 0.498 3.444 0.832 509 HB3 LEU 60 HB3 LEU 60 -0.363 3.273 2.356 510 HG LEU 60 HG LEU 60 -2.065 1.820 1.018 511 HD11 LEU 60 HD11 LEU 60 0.300 1.750 -0.922 512 HD12 LEU 60 HD12 LEU 60 -1.186 0.786 -1.034 513 HD13 LEU 60 HD13 LEU 60 -1.254 2.532 -1.260 514 HD21 LEU 60 HD21 LEU 60 -0.461 0.846 2.599 515 HD22 LEU 60 HD22 LEU 60 -0.613 -0.183 1.170 516 HD23 LEU 60 HD23 LEU 60 0.812 0.864 1.356 517 H SER 61 H SER 61 -1.190 5.583 3.202 518 HA SER 61 HA SER 61 -3.568 4.775 4.506 519 HB2 SER 61 HB2 SER 61 -2.962 6.249 6.230 520 HB3 SER 61 HB3 SER 61 -1.442 5.690 5.539 521 HG SER 61 HG SER 61 -1.579 7.750 4.249 522 H LYS 62 H LYS 62 -3.093 7.302 2.222 523 HA LYS 62 HA LYS 62 -5.512 8.852 2.945 524 HB2 LYS 62 HB2 LYS 62 -3.383 9.121 0.790 525 HB3 LYS 62 HB3 LYS 62 -4.804 10.167 0.862 526 HG2 LYS 62 HG2 LYS 62 -4.168 11.135 2.930 527 HG3 LYS 62 HG3 LYS 62 -3.004 9.866 3.287 528 HD2 LYS 62 HD2 LYS 62 -1.829 11.890 2.659 529 HD3 LYS 62 HD3 LYS 62 -1.540 10.625 1.459 530 HE2 LYS 62 HE2 LYS 62 -3.306 11.661 0.000 531 HE3 LYS 62 HE3 LYS 62 -3.496 12.956 1.191 532 HZ1 LYS 62 HZ1 LYS 62 -0.985 12.311 -0.276 533 HZ2 LYS 62 HZ2 LYS 62 -1.966 13.581 -0.605 534 HZ3 LYS 62 HZ3 LYS 62 -1.149 13.531 0.810 535 H ARG 63 H ARG 63 -4.495 6.657 0.338 536 HA ARG 63 HA ARG 63 -7.169 6.819 -0.944 537 HB2 ARG 63 HB2 ARG 63 -4.631 5.341 -1.729 538 HB3 ARG 63 HB3 ARG 63 -6.142 5.354 -2.655 539 HG2 ARG 63 HG2 ARG 63 -5.971 7.886 -2.754 540 HG3 ARG 63 HG3 ARG 63 -4.379 7.755 -2.001 541 HD2 ARG 63 HD2 ARG 63 -4.012 7.958 -4.356 542 HD3 ARG 63 HD3 ARG 63 -3.633 6.302 -3.904 543 HE ARG 63 HE ARG 63 -5.371 5.536 -5.235 544 HH11 ARG 63 HH11 ARG 63 -7.034 5.643 -6.702 545 HH12 ARG 63 HH12 ARG 63 -7.774 7.174 -7.063 546 HH21 ARG 63 HH21 ARG 63 -5.830 9.000 -4.917 547 HH22 ARG 63 HH22 ARG 63 -7.121 9.020 -6.086 548 H LEU 64 H LEU 64 -5.305 4.370 0.865 549 HA LEU 64 HA LEU 64 -7.400 2.350 0.560 550 HB2 LEU 64 HB2 LEU 64 -4.681 2.250 1.093 551 HB3 LEU 64 HB3 LEU 64 -5.367 2.029 2.695 552 HG LEU 64 HG LEU 64 -6.831 0.178 1.529 553 HD11 LEU 64 HD11 LEU 64 -4.499 0.567 -0.413 554 HD12 LEU 64 HD12 LEU 64 -5.568 -0.829 -0.390 555 HD13 LEU 64 HD13 LEU 64 -6.228 0.776 -0.770 556 HD21 LEU 64 HD21 LEU 64 -5.147 -0.390 3.164 557 HD22 LEU 64 HD22 LEU 64 -4.982 -1.482 1.790 558 HD23 LEU 64 HD23 LEU 64 -3.835 -0.136 1.982 559 H ASN 65 H ASN 65 -6.746 4.915 2.805 560 HA ASN 65 HA ASN 65 -7.756 5.700 4.653 561 HB2 ASN 65 HB2 ASN 65 -9.785 5.454 3.217 562 HB3 ASN 65 HB3 ASN 65 -10.126 3.920 4.015 563 HD21 ASN 65 HD21 ASN 65 -11.101 5.496 7.114 564 HD22 ASN 65 HD22 ASN 65 -10.282 4.060 6.487 565 H ILE 66 H ILE 66 -5.934 4.629 5.589 566 HA ILE 66 HA ILE 66 -6.677 2.828 7.822 567 HB ILE 66 HB ILE 66 -4.400 1.670 7.526 568 HG12 ILE 66 HG12 ILE 66 -4.661 2.729 4.694 569 HG13 ILE 66 HG13 ILE 66 -3.433 3.170 5.890 570 HG21 ILE 66 HG21 ILE 66 -6.531 0.974 5.507 571 HG22 ILE 66 HG22 ILE 66 -5.315 -0.102 6.254 572 HG23 ILE 66 HG23 ILE 66 -6.575 0.606 7.255 573 HD11 ILE 66 HD11 ILE 66 -3.753 0.401 4.687 574 HD12 ILE 66 HD12 ILE 66 -2.588 1.633 4.192 575 HD13 ILE 66 HD13 ILE 66 -2.506 0.926 5.831 576 H THR 67 H THR 67 -4.979 2.733 9.459 577 HA THR 67 HA THR 67 -3.722 5.191 10.272 578 HB THR 67 HB THR 67 -3.328 2.259 11.007 579 HG1 THR 67 HG1 THR 67 -4.551 2.940 12.841 580 HG21 THR 67 HG21 THR 67 -2.295 4.751 12.400 581 HG22 THR 67 HG22 THR 67 -2.379 3.129 13.141 582 HG23 THR 67 HG23 THR 67 -1.356 3.387 11.735 583 H VAL 68 H VAL 68 -1.624 5.925 9.840 584 HA VAL 68 HA VAL 68 -0.251 5.015 7.522 585 HB VAL 68 HB VAL 68 1.003 6.590 9.805 586 HG11 VAL 68 HG11 VAL 68 1.587 6.512 6.806 587 HG12 VAL 68 HG12 VAL 68 2.369 7.590 7.982 588 HG13 VAL 68 HG13 VAL 68 2.625 5.849 8.088 589 HG21 VAL 68 HG21 VAL 68 -1.081 7.737 9.151 590 HG22 VAL 68 HG22 VAL 68 0.321 8.629 8.567 591 HG23 VAL 68 HG23 VAL 68 -0.615 7.628 7.440 592 H ASP 69 H ASP 69 0.220 4.132 10.917 593 HA ASP 69 HA ASP 69 2.615 2.595 10.438 594 HB2 ASP 69 HB2 ASP 69 1.976 3.572 12.644 595 HB3 ASP 69 HB3 ASP 69 0.641 2.422 12.747 596 H LYS 70 H LYS 70 -0.804 1.772 10.179 597 HA LYS 70 HA LYS 70 -0.328 -1.095 9.831 598 HB2 LYS 70 HB2 LYS 70 -2.664 0.724 9.104 599 HB3 LYS 70 HB3 LYS 70 -2.564 -0.944 8.550 600 HG2 LYS 70 HG2 LYS 70 -2.403 -1.750 10.874 601 HG3 LYS 70 HG3 LYS 70 -2.549 -0.083 11.470 602 HD2 LYS 70 HD2 LYS 70 -4.802 0.111 10.516 603 HD3 LYS 70 HD3 LYS 70 -4.615 -1.422 9.663 604 HE2 LYS 70 HE2 LYS 70 -6.026 -1.832 11.537 605 HE3 LYS 70 HE3 LYS 70 -4.482 -2.638 11.817 606 HZ1 LYS 70 HZ1 LYS 70 -5.300 -0.040 13.018 607 HZ2 LYS 70 HZ2 LYS 70 -5.268 -1.469 13.798 608 HZ3 LYS 70 HZ3 LYS 70 -3.871 -0.795 13.303 609 H ALA 71 H ALA 71 -0.309 1.732 7.682 610 HA ALA 71 HA ALA 71 0.019 0.160 5.249 611 HB1 ALA 71 HB1 ALA 71 0.773 3.058 5.853 612 HB2 ALA 71 HB2 ALA 71 0.726 2.311 4.250 613 HB3 ALA 71 HB3 ALA 71 -0.760 2.516 5.198 614 H LYS 72 H LYS 72 2.330 1.829 7.391 615 HA LYS 72 HA LYS 72 4.758 1.150 6.076 616 HB2 LYS 72 HB2 LYS 72 4.110 1.617 9.016 617 HB3 LYS 72 HB3 LYS 72 5.759 1.388 8.421 618 HG2 LYS 72 HG2 LYS 72 5.667 3.390 7.092 619 HG3 LYS 72 HG3 LYS 72 3.940 3.564 7.379 620 HD2 LYS 72 HD2 LYS 72 5.188 5.171 8.722 621 HD3 LYS 72 HD3 LYS 72 4.240 4.065 9.700 622 HE2 LYS 72 HE2 LYS 72 6.320 4.370 10.806 623 HE3 LYS 72 HE3 LYS 72 6.294 2.725 10.180 624 HZ1 LYS 72 HZ1 LYS 72 7.698 5.025 8.908 625 HZ2 LYS 72 HZ2 LYS 72 8.423 3.830 9.744 626 HZ3 LYS 72 HZ3 LYS 72 7.701 3.497 8.320 627 H THR 73 H THR 73 2.968 -0.794 8.520 628 HA THR 73 HA THR 73 5.042 -2.886 8.303 629 HB THR 73 HB THR 73 3.930 -2.173 10.463 630 HG1 THR 73 HG1 THR 73 4.192 -4.266 11.212 631 HG21 THR 73 HG21 THR 73 1.816 -4.213 9.637 632 HG22 THR 73 HG22 THR 73 1.954 -3.346 11.179 633 HG23 THR 73 HG23 THR 73 1.535 -2.458 9.708 634 H TYR 74 H TYR 74 1.698 -2.482 7.126 635 HA TYR 74 HA TYR 74 1.296 -5.146 6.219 636 HB2 TYR 74 HB2 TYR 74 -0.551 -3.625 6.401 637 HB3 TYR 74 HB3 TYR 74 0.224 -2.461 5.318 638 HD1 TYR 74 HD1 TYR 74 -0.051 -2.496 3.015 639 HD2 TYR 74 HD2 TYR 74 -1.322 -5.877 5.381 640 HE1 TYR 74 HE1 TYR 74 -1.022 -3.521 1.006 641 HE2 TYR 74 HE2 TYR 74 -2.317 -6.917 3.340 642 HH TYR 74 HH TYR 74 -2.053 -5.405 0.109 643 H ILE 75 H ILE 75 2.858 -2.359 4.579 644 HA ILE 75 HA ILE 75 3.267 -3.404 2.017 645 HB ILE 75 HB ILE 75 4.898 -1.593 3.810 646 HG12 ILE 75 HG12 ILE 75 3.527 -1.023 1.143 647 HG13 ILE 75 HG13 ILE 75 2.665 -0.946 2.667 648 HG21 ILE 75 HG21 ILE 75 5.664 -2.328 0.949 649 HG22 ILE 75 HG22 ILE 75 6.358 -0.994 1.898 650 HG23 ILE 75 HG23 ILE 75 6.620 -2.643 2.419 651 HD11 ILE 75 HD11 ILE 75 5.036 0.802 1.884 652 HD12 ILE 75 HD12 ILE 75 3.345 1.288 2.063 653 HD13 ILE 75 HD13 ILE 75 4.276 0.793 3.489 654 H LYS 76 H LYS 76 5.464 -3.935 4.831 655 HA LYS 76 HA LYS 76 6.900 -5.998 3.341 656 HB2 LYS 76 HB2 LYS 76 8.301 -6.204 5.346 657 HB3 LYS 76 HB3 LYS 76 8.166 -4.534 4.796 658 HG2 LYS 76 HG2 LYS 76 6.563 -4.027 6.589 659 HG3 LYS 76 HG3 LYS 76 6.561 -5.726 7.100 660 HD2 LYS 76 HD2 LYS 76 8.948 -5.582 7.679 661 HD3 LYS 76 HD3 LYS 76 8.984 -3.881 7.156 662 HE2 LYS 76 HE2 LYS 76 7.317 -3.289 8.868 663 HE3 LYS 76 HE3 LYS 76 7.160 -4.984 9.348 664 HZ1 LYS 76 HZ1 LYS 76 9.644 -3.369 9.611 665 HZ2 LYS 76 HZ2 LYS 76 8.649 -3.777 10.838 666 HZ3 LYS 76 HZ3 LYS 76 9.491 -4.934 10.057 667 H ASN 77 H ASN 77 4.350 -6.143 5.801 668 HA ASN 77 HA ASN 77 4.799 -8.995 6.221 669 HB2 ASN 77 HB2 ASN 77 2.642 -7.056 7.103 670 HB3 ASN 77 HB3 ASN 77 2.436 -8.791 7.309 671 HD21 ASN 77 HD21 ASN 77 5.205 -6.890 9.631 672 HD22 ASN 77 HD22 ASN 77 4.508 -6.054 8.249 673 H SER 78 H SER 78 2.837 -7.205 3.916 674 HA SER 78 HA SER 78 1.522 -9.649 2.924 675 HB2 SER 78 HB2 SER 78 0.417 -7.401 3.045 676 HB3 SER 78 HB3 SER 78 1.496 -6.857 1.744 677 HG SER 78 HG SER 78 -0.565 -7.661 1.007 678 H ASN 79 H ASN 79 4.075 -7.407 1.845 679 HA ASN 79 HA ASN 79 5.160 -9.470 0.032 680 HB2 ASN 79 HB2 ASN 79 5.169 -7.822 -1.878 681 HB3 ASN 79 HB3 ASN 79 3.618 -8.524 -1.446 682 HD21 ASN 79 HD21 ASN 79 4.134 -4.501 -0.836 683 HD22 ASN 79 HD22 ASN 79 5.534 -5.567 -0.737 684 H ARG 80 H ARG 80 6.764 -9.358 1.806 685 HA ARG 80 HA ARG 80 8.428 -7.107 2.235 686 HB2 ARG 80 HB2 ARG 80 8.225 -9.298 3.598 687 HB3 ARG 80 HB3 ARG 80 9.358 -10.003 2.464 688 HG2 ARG 80 HG2 ARG 80 11.064 -8.375 3.070 689 HG3 ARG 80 HG3 ARG 80 9.907 -7.443 4.033 690 HD2 ARG 80 HD2 ARG 80 10.142 -8.739 5.842 691 HD3 ARG 80 HD3 ARG 80 9.961 -10.228 4.938 692 HE ARG 80 HE ARG 80 12.490 -8.832 5.593 693 HH11 ARG 80 HH11 ARG 80 14.421 -9.870 5.228 694 HH12 ARG 80 HH12 ARG 80 14.449 -11.373 4.354 695 HH21 ARG 80 HH21 ARG 80 11.064 -11.537 3.870 696 HH22 ARG 80 HH22 ARG 80 12.612 -12.288 3.597 697 H MET 81 H MET 81 9.104 -9.869 0.156 698 HA MET 81 HA MET 81 10.574 -8.291 -1.829 699 HB2 MET 81 HB2 MET 81 12.730 -9.490 -1.513 700 HB3 MET 81 HB3 MET 81 12.312 -8.477 -0.145 701 HG2 MET 81 HG2 MET 81 11.510 -10.434 1.114 702 HG3 MET 81 HG3 MET 81 11.900 -11.494 -0.240 703 HE1 MET 81 HE1 MET 81 14.659 -10.872 -1.320 704 HE2 MET 81 HE2 MET 81 15.743 -11.728 -0.204 705 HE3 MET 81 HE3 MET 81 14.221 -12.486 -0.715 706 H GLY 82 H GLY 82 8.315 -10.466 -1.558 707 HA2 GLY 82 HA2 GLY 82 9.542 -12.811 -2.884 708 HA3 GLY 82 HA3 GLY 82 7.990 -12.750 -2.043 709 H ARG 83 H ARG 83 9.020 -10.453 -4.523 710 HA ARG 83 HA ARG 83 7.883 -9.674 -6.370 711 HB2 ARG 83 HB2 ARG 83 7.917 -12.635 -6.996 712 HB3 ARG 83 HB3 ARG 83 7.655 -11.365 -8.188 713 HG2 ARG 83 HG2 ARG 83 10.197 -11.551 -6.501 714 HG3 ARG 83 HG3 ARG 83 10.013 -12.417 -8.012 715 HD2 ARG 83 HD2 ARG 83 9.493 -9.435 -7.972 716 HD3 ARG 83 HD3 ARG 83 11.149 -10.013 -7.925 717 HE ARG 83 HE ARG 83 9.288 -10.164 -10.189 718 HH11 ARG 83 HH11 ARG 83 10.066 -10.840 -12.167 719 HH12 ARG 83 HH12 ARG 83 11.631 -11.598 -12.272 720 HH21 ARG 83 HH21 ARG 83 12.310 -11.420 -8.925 721 HH22 ARG 83 HH22 ARG 83 12.863 -11.929 -10.495 722 H THR 84 H THR 84 6.200 -9.510 -4.459 723 HA THR 84 HA THR 84 4.099 -9.563 -3.659 724 HB THR 84 HB THR 84 2.389 -9.416 -5.823 725 HG1 THR 84 HG1 THR 84 3.397 -8.188 -7.352 726 HG21 THR 84 HG21 THR 84 4.159 -7.233 -4.659 727 HG22 THR 84 HG22 THR 84 2.600 -6.992 -5.499 728 HG23 THR 84 HG23 THR 84 2.643 -7.825 -3.939 729 H ASN 85 H ASN 85 5.213 -12.254 -4.207 730 HA ASN 85 HA ASN 85 4.695 -14.403 -4.501 731 HB2 ASN 85 HB2 ASN 85 2.321 -13.540 -2.812 732 HB3 ASN 85 HB3 ASN 85 2.717 -15.227 -3.142 733 HD21 ASN 85 HD21 ASN 85 5.570 -15.294 -1.014 734 HD22 ASN 85 HD22 ASN 85 4.813 -16.072 -2.394 735 H ASN 86 H ASN 86 3.930 -12.695 -6.696 736 HA ASN 86 HA ASN 86 1.698 -14.229 -7.906 737 HB2 ASN 86 HB2 ASN 86 1.072 -12.363 -8.962 738 HB3 ASN 86 HB3 ASN 86 1.996 -11.549 -7.704 739 HD21 ASN 86 HD21 ASN 86 4.749 -10.885 -10.048 740 HD22 ASN 86 HD22 ASN 86 4.536 -11.484 -8.405 741 H PHE 87 H PHE 87 4.997 -14.481 -7.924 742 HA PHE 87 HA PHE 87 5.622 -14.609 -10.712 743 HB2 PHE 87 HB2 PHE 87 7.852 -15.134 -9.944 744 HB3 PHE 87 HB3 PHE 87 7.160 -13.874 -8.949 745 HD1 PHE 87 HD1 PHE 87 6.469 -14.343 -6.569 746 HD2 PHE 87 HD2 PHE 87 8.391 -17.343 -9.004 747 HE1 PHE 87 HE1 PHE 87 6.921 -15.696 -4.546 748 HE2 PHE 87 HE2 PHE 87 8.827 -18.701 -6.974 749 HZ PHE 87 HZ PHE 87 8.088 -17.884 -4.743 750 H LYS 88 H LYS 88 3.642 -16.698 -9.603 751 HA LYS 88 HA LYS 88 5.049 -19.277 -9.779 752 HB2 LYS 88 HB2 LYS 88 2.165 -18.613 -9.085 753 HB3 LYS 88 HB3 LYS 88 2.983 -20.157 -8.787 754 HG2 LYS 88 HG2 LYS 88 4.566 -19.100 -7.265 755 HG3 LYS 88 HG3 LYS 88 3.887 -17.500 -7.584 756 HD2 LYS 88 HD2 LYS 88 2.296 -19.760 -6.310 757 HD3 LYS 88 HD3 LYS 88 3.143 -18.473 -5.426 758 HE2 LYS 88 HE2 LYS 88 1.853 -16.780 -6.827 759 HE3 LYS 88 HE3 LYS 88 0.876 -18.113 -7.441 760 HZ1 LYS 88 HZ1 LYS 88 1.111 -17.361 -4.577 761 HZ2 LYS 88 HZ2 LYS 88 -0.174 -17.050 -5.523 762 HZ3 LYS 88 HZ3 LYS 88 0.196 -18.598 -5.143 763 H THR 89 H THR 89 4.218 -17.567 -12.110 764 HA THR 89 HA THR 89 3.126 -19.555 -14.023 765 HB THR 89 HB THR 89 1.801 -16.976 -13.107 766 HG1 THR 89 HG1 THR 89 0.012 -18.326 -12.991 767 HG21 THR 89 HG21 THR 89 1.281 -18.482 -15.718 768 HG22 THR 89 HG22 THR 89 0.178 -17.274 -15.013 769 HG23 THR 89 HG23 THR 89 1.786 -16.783 -15.545 770 H ILE 90 H ILE 90 4.186 -16.185 -13.382 771 HA ILE 90 HA ILE 90 5.084 -15.747 -16.124 772 HB ILE 90 HB ILE 90 5.748 -14.036 -13.707 773 HG12 ILE 90 HG12 ILE 90 3.184 -14.019 -15.370 774 HG13 ILE 90 HG13 ILE 90 3.316 -14.375 -13.647 775 HG21 ILE 90 HG21 ILE 90 5.357 -13.352 -16.659 776 HG22 ILE 90 HG22 ILE 90 5.816 -12.206 -15.378 777 HG23 ILE 90 HG23 ILE 90 6.922 -13.471 -15.835 778 HD11 ILE 90 HD11 ILE 90 3.681 -11.674 -14.956 779 HD12 ILE 90 HD12 ILE 90 2.442 -12.194 -13.810 780 HD13 ILE 90 HD13 ILE 90 4.124 -12.025 -13.264 781 H LYS 91 H LYS 91 7.318 -15.315 -16.716 782 HA LYS 91 HA LYS 91 9.500 -15.827 -16.971 783 HB2 LYS 91 HB2 LYS 91 9.636 -16.332 -13.984 784 HB3 LYS 91 HB3 LYS 91 10.990 -16.031 -15.037 785 HG2 LYS 91 HG2 LYS 91 8.823 -13.934 -14.522 786 HG3 LYS 91 HG3 LYS 91 10.231 -14.170 -13.508 787 HD2 LYS 91 HD2 LYS 91 10.875 -12.426 -14.886 788 HD3 LYS 91 HD3 LYS 91 11.696 -13.833 -15.537 789 HE2 LYS 91 HE2 LYS 91 10.940 -13.094 -17.536 790 HE3 LYS 91 HE3 LYS 91 9.432 -13.885 -17.078 791 HZ1 LYS 91 HZ1 LYS 91 10.070 -11.009 -16.708 792 HZ2 LYS 91 HZ2 LYS 91 9.016 -11.630 -17.786 793 HZ3 LYS 91 HZ3 LYS 91 8.685 -11.708 -16.188 794 H MET 92 H MET 92 7.437 -18.309 -16.025 795 HA MET 92 HA MET 92 9.553 -20.382 -16.108 796 HB2 MET 92 HB2 MET 92 6.582 -20.659 -15.581 797 HB3 MET 92 HB3 MET 92 7.807 -21.932 -15.451 798 HG2 MET 92 HG2 MET 92 9.001 -20.399 -13.763 799 HG3 MET 92 HG3 MET 92 7.510 -19.458 -13.729 800 HE1 MET 92 HE1 MET 92 5.481 -22.283 -14.110 801 HE2 MET 92 HE2 MET 92 4.949 -22.232 -12.418 802 HE3 MET 92 HE3 MET 92 5.121 -20.721 -13.345 803 H PHE 93 H PHE 93 6.502 -19.739 -17.932 804 HA PHE 93 HA PHE 93 7.238 -21.823 -19.879 805 HB2 PHE 93 HB2 PHE 93 5.031 -21.724 -20.639 806 HB3 PHE 93 HB3 PHE 93 4.937 -21.596 -18.895 807 HD1 PHE 93 HD1 PHE 93 4.290 -19.422 -17.831 808 HD2 PHE 93 HD2 PHE 93 4.348 -19.902 -22.110 809 HE1 PHE 93 HE1 PHE 93 2.972 -17.335 -18.078 810 HE2 PHE 93 HE2 PHE 93 3.018 -17.820 -22.360 811 HZ PHE 93 HZ PHE 93 2.332 -16.529 -20.346 812 H GLU 94 H GLU 94 7.911 -18.562 -19.646 813 HA GLU 94 HA GLU 94 7.345 -17.751 -22.370 814 HB2 GLU 94 HB2 GLU 94 8.785 -16.318 -20.108 815 HB3 GLU 94 HB3 GLU 94 8.242 -15.569 -21.616 816 HG2 GLU 94 HG2 GLU 94 5.893 -16.101 -21.064 817 HG3 GLU 94 HG3 GLU 94 6.401 -16.843 -19.543 818 H ASP 95 H ASP 95 9.673 -19.721 -21.546 819 HA ASP 95 HA ASP 95 11.707 -18.640 -23.459 820 HB2 ASP 95 HB2 ASP 95 12.566 -18.539 -21.166 821 HB3 ASP 95 HB3 ASP 95 12.179 -20.244 -20.922 822 H ASP 96 H ASP 96 12.140 -19.893 -25.156 823 HA ASP 96 HA ASP 96 12.051 -22.791 -25.016 824 HB2 ASP 96 HB2 ASP 96 9.666 -21.817 -25.698 825 HB3 ASP 96 HB3 ASP 96 10.426 -21.616 -27.269 826 H VAL 97 H VAL 97 12.963 -23.777 -26.932 827 HA VAL 97 HA VAL 97 14.685 -22.052 -28.655 828 HB VAL 97 HB VAL 97 15.843 -24.306 -26.955 829 HG11 VAL 97 HG11 VAL 97 17.192 -22.321 -28.843 830 HG12 VAL 97 HG12 VAL 97 18.034 -23.475 -27.784 831 HG13 VAL 97 HG13 VAL 97 17.028 -24.075 -29.100 832 HG21 VAL 97 HG21 VAL 97 15.450 -22.374 -25.500 833 HG22 VAL 97 HG22 VAL 97 17.172 -22.531 -25.823 834 HG23 VAL 97 HG23 VAL 97 16.227 -21.292 -26.680 835 H SER 98 H SER 98 13.513 -25.316 -27.888 836 HA SER 98 HA SER 98 13.801 -26.106 -30.760 837 HB2 SER 98 HB2 SER 98 14.271 -27.860 -28.328 838 HB3 SER 98 HB3 SER 98 14.407 -28.345 -30.029 839 HG SER 98 HG SER 98 16.447 -27.815 -29.136 840 H SER 99 H SER 99 11.450 -25.074 -29.154 841 HA SER 99 HA SER 99 9.242 -25.382 -28.919 842 HB2 SER 99 HB2 SER 99 9.468 -25.786 -31.395 843 HB3 SER 99 HB3 SER 99 9.307 -27.517 -31.053 844 HG SER 99 HG SER 99 7.288 -26.479 -31.525 845 H ALA 100 H ALA 100 10.248 -26.241 -26.851 846 HA ALA 100 HA ALA 100 9.982 -29.062 -26.215 847 HB1 ALA 100 HB1 ALA 100 10.338 -26.619 -24.431 848 HB2 ALA 100 HB2 ALA 100 10.578 -28.312 -23.947 849 HB3 ALA 100 HB3 ALA 100 11.646 -27.581 -25.160 850 H SER 101 H SER 101 8.675 -29.856 -24.359 851 HA SER 101 HA SER 101 5.878 -28.800 -24.369 852 HB2 SER 101 HB2 SER 101 5.129 -31.047 -23.996 853 HB3 SER 101 HB3 SER 101 6.205 -31.036 -25.401 854 HG SER 101 HG SER 101 6.759 -32.753 -24.050 855 H ALA 102 H ALA 102 4.627 -29.430 -22.375 856 HA ALA 102 HA ALA 102 5.978 -28.431 -19.999 857 HB1 ALA 102 HB1 ALA 102 3.104 -29.317 -20.446 858 HB2 ALA 102 HB2 ALA 102 3.720 -28.369 -19.073 859 HB3 ALA 102 HB3 ALA 102 3.735 -27.670 -20.700 860 H GLN 103 H GLN 103 6.680 -31.190 -21.030 861 HA GLN 103 HA GLN 103 7.100 -33.314 -20.354 862 HB2 GLN 103 HB2 GLN 103 7.511 -31.681 -17.872 863 HB3 GLN 103 HB3 GLN 103 7.908 -33.408 -17.918 864 HG2 GLN 103 HG2 GLN 103 9.571 -33.139 -19.568 865 HG3 GLN 103 HG3 GLN 103 8.974 -31.556 -20.071 866 HE21 GLN 103 HE21 GLN 103 10.602 -29.732 -17.482 867 HE22 GLN 103 HE22 GLN 103 9.268 -29.717 -18.634 868 HA PRO 104 HA PRO 104 2.774 -34.134 -18.895 869 HB2 PRO 104 HB2 PRO 104 1.916 -35.685 -20.974 870 HB3 PRO 104 HB3 PRO 104 1.989 -33.902 -21.042 871 HG2 PRO 104 HG2 PRO 104 4.057 -35.871 -22.075 872 HG3 PRO 104 HG3 PRO 104 3.321 -34.483 -22.940 873 HD2 PRO 104 HD2 PRO 104 5.734 -34.282 -21.701 874 HD3 PRO 104 HD3 PRO 104 4.581 -32.918 -21.687 875 H ASN 105 H ASN 105 3.802 -35.208 -17.166 876 HA ASN 105 HA ASN 105 3.695 -38.180 -17.316 877 HB2 ASN 105 HB2 ASN 105 6.065 -37.260 -17.467 878 HB3 ASN 105 HB3 ASN 105 5.838 -36.575 -15.857 879 HD21 ASN 105 HD21 ASN 105 7.432 -39.620 -14.884 880 HD22 ASN 105 HD22 ASN 105 7.665 -37.899 -15.164 881 H LEU 106 H LEU 106 1.640 -36.438 -16.481 882 HA LEU 106 HA LEU 106 1.543 -36.644 -13.518 883 HB2 LEU 106 HB2 LEU 106 -0.099 -35.066 -15.525 884 HB3 LEU 106 HB3 LEU 106 -0.498 -35.153 -13.814 885 HG LEU 106 HG LEU 106 2.160 -34.081 -14.866 886 HD11 LEU 106 HD11 LEU 106 -0.326 -32.580 -13.944 887 HD12 LEU 106 HD12 LEU 106 1.242 -31.853 -14.365 888 HD13 LEU 106 HD13 LEU 106 0.287 -32.671 -15.611 889 HD21 LEU 106 HD21 LEU 106 2.296 -34.845 -12.521 890 HD22 LEU 106 HD22 LEU 106 2.327 -33.082 -12.595 891 HD23 LEU 106 HD23 LEU 106 0.832 -33.917 -12.119 892 HA PRO 107 HA PRO 107 -1.283 -40.066 -13.779 893 HB2 PRO 107 HB2 PRO 107 -2.486 -40.002 -11.330 894 HB3 PRO 107 HB3 PRO 107 -0.764 -40.432 -11.564 895 HG2 PRO 107 HG2 PRO 107 -1.919 -37.736 -10.778 896 HG3 PRO 107 HG3 PRO 107 -0.563 -38.625 -10.015 897 HD2 PRO 107 HD2 PRO 107 -0.153 -36.650 -11.852 898 HD3 PRO 107 HD3 PRO 107 0.905 -38.090 -11.773 Start of MODEL 23 1 H1 GLY -5 H1 GLY -5 40.035 -13.909 -3.370 2 H2 GLY -5 H2 GLY -5 39.297 -14.038 -4.828 3 H3 GLY -5 H3 GLY -5 38.418 -14.166 -3.451 4 HA2 GLY -5 HA2 GLY -5 39.805 -11.737 -4.388 5 HA3 GLY -5 HA3 GLY -5 38.056 -12.012 -4.454 6 H SER -4 H SER -4 37.454 -10.343 -3.123 7 HA SER -4 HA SER -4 38.168 -10.498 -0.219 8 HB2 SER -4 HB2 SER -4 37.986 -7.972 -1.907 9 HB3 SER -4 HB3 SER -4 38.216 -8.035 -0.152 10 HG SER -4 HG SER -4 40.204 -7.779 -1.290 11 H HIS -3 H HIS -3 36.626 -9.363 1.184 12 HA HIS -3 HA HIS -3 33.831 -9.381 0.130 13 HB2 HIS -3 HB2 HIS -3 34.459 -11.190 1.783 14 HB3 HIS -3 HB3 HIS -3 34.696 -9.923 2.987 15 HD2 HIS -3 HD2 HIS -3 32.530 -9.219 4.302 16 HE1 HIS -3 HE1 HIS -3 29.572 -10.959 1.759 17 HE2 HIS -3 HE2 HIS -3 29.967 -9.767 3.975 18 H MET -2 H MET -2 32.527 -7.725 0.542 19 HA MET -2 HA MET -2 33.628 -5.263 1.805 20 HB2 MET -2 HB2 MET -2 34.079 -5.514 -0.672 21 HB3 MET -2 HB3 MET -2 32.334 -5.455 -0.948 22 HG2 MET -2 HG2 MET -2 32.281 -3.224 0.148 23 HG3 MET -2 HG3 MET -2 34.024 -3.334 0.424 24 HE1 MET -2 HE1 MET -2 34.244 -0.896 -0.677 25 HE2 MET -2 HE2 MET -2 33.617 -0.491 -2.291 26 HE3 MET -2 HE3 MET -2 32.489 -0.872 -0.973 27 H ALA -1 H ALA -1 32.052 -6.286 3.467 28 HA ALA -1 HA ALA -1 29.665 -4.584 3.407 29 HB1 ALA -1 HB1 ALA -1 29.401 -7.581 3.847 30 HB2 ALA -1 HB2 ALA -1 28.128 -6.365 4.069 31 HB3 ALA -1 HB3 ALA -1 28.789 -6.667 2.449 32 H SER 0 H SER 0 30.653 -3.408 4.931 33 HA SER 0 HA SER 0 31.208 -4.613 7.620 34 HB2 SER 0 HB2 SER 0 32.984 -2.653 6.129 35 HB3 SER 0 HB3 SER 0 33.315 -3.413 7.696 36 HG SER 0 HG SER 0 34.398 -4.485 5.997 37 H MET 1 H MET 1 29.162 -2.460 6.379 38 HA MET 1 HA MET 1 29.477 -0.467 8.595 39 HB2 MET 1 HB2 MET 1 29.095 0.214 5.648 40 HB3 MET 1 HB3 MET 1 29.140 1.378 6.982 41 HG2 MET 1 HG2 MET 1 31.443 0.567 7.540 42 HG3 MET 1 HG3 MET 1 31.420 -0.396 6.063 43 HE1 MET 1 HE1 MET 1 29.968 1.554 3.918 44 HE2 MET 1 HE2 MET 1 31.413 2.313 3.226 45 HE3 MET 1 HE3 MET 1 31.428 0.580 3.615 46 H ASP 2 H ASP 2 27.319 -2.407 7.001 47 HA ASP 2 HA ASP 2 24.974 -0.937 8.146 48 HB2 ASP 2 HB2 ASP 2 25.278 -0.605 5.655 49 HB3 ASP 2 HB3 ASP 2 25.047 -2.338 5.447 50 H GLN 3 H GLN 3 26.724 -3.408 8.798 51 HA GLN 3 HA GLN 3 24.591 -5.496 9.061 52 HB2 GLN 3 HB2 GLN 3 25.971 -5.436 6.861 53 HB3 GLN 3 HB3 GLN 3 27.335 -5.916 7.847 54 HG2 GLN 3 HG2 GLN 3 25.591 -7.918 8.519 55 HG3 GLN 3 HG3 GLN 3 24.888 -7.452 6.980 56 HE21 GLN 3 HE21 GLN 3 28.780 -8.896 7.017 57 HE22 GLN 3 HE22 GLN 3 28.152 -8.047 8.423 58 H LEU 4 H LEU 4 26.465 -3.817 11.019 59 HA LEU 4 HA LEU 4 27.355 -6.136 12.682 60 HB2 LEU 4 HB2 LEU 4 29.053 -3.704 11.991 61 HB3 LEU 4 HB3 LEU 4 29.360 -4.803 13.326 62 HG LEU 4 HG LEU 4 29.293 -6.687 11.453 63 HD11 LEU 4 HD11 LEU 4 30.275 -4.244 9.916 64 HD12 LEU 4 HD12 LEU 4 30.331 -5.934 9.359 65 HD13 LEU 4 HD13 LEU 4 28.781 -5.115 9.550 66 HD21 LEU 4 HD21 LEU 4 31.212 -6.179 12.903 67 HD22 LEU 4 HD22 LEU 4 31.740 -6.453 11.238 68 HD23 LEU 4 HD23 LEU 4 31.644 -4.795 11.874 69 H ASP 5 H ASP 5 25.114 -5.467 13.408 70 HA ASP 5 HA ASP 5 25.249 -3.412 15.590 71 HB2 ASP 5 HB2 ASP 5 23.055 -3.846 13.530 72 HB3 ASP 5 HB3 ASP 5 22.914 -2.788 14.929 73 H GLU 6 H GLU 6 25.157 -6.563 15.386 74 HA GLU 6 HA GLU 6 22.974 -7.025 17.382 75 HB2 GLU 6 HB2 GLU 6 22.357 -9.049 16.184 76 HB3 GLU 6 HB3 GLU 6 22.210 -7.625 15.161 77 HG2 GLU 6 HG2 GLU 6 24.371 -8.178 14.053 78 HG3 GLU 6 HG3 GLU 6 24.538 -9.599 15.081 79 H ILE 7 H ILE 7 25.969 -6.788 17.682 80 HA ILE 7 HA ILE 7 26.925 -9.503 18.194 81 HB ILE 7 HB ILE 7 28.398 -6.883 18.409 82 HG12 ILE 7 HG12 ILE 7 28.253 -8.933 16.133 83 HG13 ILE 7 HG13 ILE 7 27.445 -7.369 16.109 84 HG21 ILE 7 HG21 ILE 7 29.419 -9.768 18.180 85 HG22 ILE 7 HG22 ILE 7 30.420 -8.302 18.285 86 HG23 ILE 7 HG23 ILE 7 29.469 -8.802 19.665 87 HD11 ILE 7 HD11 ILE 7 30.425 -7.815 16.103 88 HD12 ILE 7 HD12 ILE 7 29.394 -7.164 14.815 89 HD13 ILE 7 HD13 ILE 7 29.633 -6.226 16.307 90 H ILE 8 H ILE 8 25.192 -9.745 19.894 91 HA ILE 8 HA ILE 8 26.269 -9.260 22.596 92 HB ILE 8 HB ILE 8 25.103 -7.206 22.071 93 HG12 ILE 8 HG12 ILE 8 23.578 -8.773 24.170 94 HG13 ILE 8 HG13 ILE 8 25.219 -8.156 24.380 95 HG21 ILE 8 HG21 ILE 8 22.469 -8.714 21.897 96 HG22 ILE 8 HG22 ILE 8 22.759 -6.982 21.659 97 HG23 ILE 8 HG23 ILE 8 23.374 -8.150 20.484 98 HD11 ILE 8 HD11 ILE 8 22.707 -6.489 23.947 99 HD12 ILE 8 HD12 ILE 8 23.676 -6.625 25.424 100 HD13 ILE 8 HD13 ILE 8 24.363 -5.832 23.994 101 H GLU 9 H GLU 9 26.507 -11.590 22.260 102 HA GLU 9 HA GLU 9 24.007 -13.080 22.946 103 HB2 GLU 9 HB2 GLU 9 26.108 -13.692 20.855 104 HB3 GLU 9 HB3 GLU 9 25.098 -14.976 21.501 105 HG2 GLU 9 HG2 GLU 9 23.907 -12.486 20.236 106 HG3 GLU 9 HG3 GLU 9 24.329 -13.933 19.337 107 H GLN 10 H GLN 10 25.908 -12.129 24.881 108 HA GLN 10 HA GLN 10 26.645 -14.705 26.141 109 HB2 GLN 10 HB2 GLN 10 28.639 -13.950 24.812 110 HB3 GLN 10 HB3 GLN 10 28.707 -12.496 25.811 111 HG2 GLN 10 HG2 GLN 10 28.944 -14.023 27.844 112 HG3 GLN 10 HG3 GLN 10 29.041 -15.389 26.729 113 HE21 GLN 10 HE21 GLN 10 32.373 -14.480 25.595 114 HE22 GLN 10 HE22 GLN 10 30.899 -15.278 25.062 115 H ILE 11 H ILE 11 27.144 -11.183 26.717 116 HA ILE 11 HA ILE 11 25.909 -11.451 29.406 117 HB ILE 11 HB ILE 11 27.589 -9.690 30.144 118 HG12 ILE 11 HG12 ILE 11 29.306 -10.837 27.891 119 HG13 ILE 11 HG13 ILE 11 28.568 -9.238 27.842 120 HG21 ILE 11 HG21 ILE 11 28.595 -12.519 29.631 121 HG22 ILE 11 HG22 ILE 11 29.121 -11.423 30.923 122 HG23 ILE 11 HG23 ILE 11 27.474 -12.047 30.924 123 HD11 ILE 11 HD11 ILE 11 30.674 -10.176 29.825 124 HD12 ILE 11 HD12 ILE 11 30.861 -9.002 28.516 125 HD13 ILE 11 HD13 ILE 11 29.831 -8.608 29.907 126 H GLN 12 H GLN 12 24.166 -10.427 29.409 127 HA GLN 12 HA GLN 12 23.832 -7.687 28.400 128 HB2 GLN 12 HB2 GLN 12 21.983 -8.255 26.921 129 HB3 GLN 12 HB3 GLN 12 23.470 -9.022 26.402 130 HG2 GLN 12 HG2 GLN 12 21.277 -10.474 27.937 131 HG3 GLN 12 HG3 GLN 12 21.397 -10.426 26.181 132 HE21 GLN 12 HE21 GLN 12 23.622 -13.138 28.153 133 HE22 GLN 12 HE22 GLN 12 22.247 -12.290 28.872 134 H LYS 13 H LYS 13 21.584 -6.907 28.767 135 HA LYS 13 HA LYS 13 21.002 -7.238 31.594 136 HB2 LYS 13 HB2 LYS 13 19.878 -5.349 29.493 137 HB3 LYS 13 HB3 LYS 13 19.593 -5.219 31.234 138 HG2 LYS 13 HG2 LYS 13 21.948 -4.830 31.680 139 HG3 LYS 13 HG3 LYS 13 22.379 -5.127 29.990 140 HD2 LYS 13 HD2 LYS 13 21.021 -3.172 29.290 141 HD3 LYS 13 HD3 LYS 13 20.677 -2.816 31.000 142 HE2 LYS 13 HE2 LYS 13 23.081 -2.552 31.457 143 HE3 LYS 13 HE3 LYS 13 23.481 -3.041 29.807 144 HZ1 LYS 13 HZ1 LYS 13 21.957 -0.591 30.519 145 HZ2 LYS 13 HZ2 LYS 13 23.518 -0.627 30.043 146 HZ3 LYS 13 HZ3 LYS 13 22.340 -1.051 28.998 147 H GLU 14 H GLU 14 20.293 -9.587 30.421 148 HA GLU 14 HA GLU 14 17.336 -9.678 30.234 149 HB2 GLU 14 HB2 GLU 14 19.468 -11.732 29.629 150 HB3 GLU 14 HB3 GLU 14 17.752 -12.139 29.837 151 HG2 GLU 14 HG2 GLU 14 17.130 -10.516 28.098 152 HG3 GLU 14 HG3 GLU 14 18.836 -10.160 27.803 153 H ALA 15 H ALA 15 16.286 -9.813 31.995 154 HA ALA 15 HA ALA 15 16.875 -11.982 33.881 155 HB1 ALA 15 HB1 ALA 15 16.449 -9.113 34.833 156 HB2 ALA 15 HB2 ALA 15 16.449 -10.553 35.878 157 HB3 ALA 15 HB3 ALA 15 17.921 -10.087 35.006 158 H ILE 16 H ILE 16 14.543 -9.304 33.965 159 HA ILE 16 HA ILE 16 12.304 -11.246 33.668 160 HB ILE 16 HB ILE 16 12.853 -9.030 35.634 161 HG12 ILE 16 HG12 ILE 16 11.935 -11.911 36.047 162 HG13 ILE 16 HG13 ILE 16 13.602 -11.352 36.142 163 HG21 ILE 16 HG21 ILE 16 10.095 -10.260 35.201 164 HG22 ILE 16 HG22 ILE 16 10.545 -9.194 36.552 165 HG23 ILE 16 HG23 ILE 16 10.554 -8.564 34.919 166 HD11 ILE 16 HD11 ILE 16 11.364 -10.629 38.055 167 HD12 ILE 16 HD12 ILE 16 12.820 -11.577 38.369 168 HD13 ILE 16 HD13 ILE 16 12.962 -9.839 38.042 169 H ASN 17 H ASN 17 13.655 -8.769 32.153 170 HA ASN 17 HA ASN 17 11.333 -7.237 31.491 171 HB2 ASN 17 HB2 ASN 17 13.993 -7.449 29.991 172 HB3 ASN 17 HB3 ASN 17 12.805 -6.167 29.775 173 HD21 ASN 17 HD21 ASN 17 15.516 -5.723 32.670 174 HD22 ASN 17 HD22 ASN 17 15.689 -6.866 31.354 175 H SER 18 H SER 18 12.545 -10.179 30.229 176 HA SER 18 HA SER 18 11.321 -10.022 27.601 177 HB2 SER 18 HB2 SER 18 12.516 -12.433 29.011 178 HB3 SER 18 HB3 SER 18 12.219 -12.245 27.271 179 HG SER 18 HG SER 18 14.396 -11.799 27.779 180 H ASN 19 H ASN 19 10.092 -11.088 30.675 181 HA ASN 19 HA ASN 19 7.840 -12.498 29.306 182 HB2 ASN 19 HB2 ASN 19 7.517 -13.808 31.270 183 HB3 ASN 19 HB3 ASN 19 9.213 -13.903 30.828 184 HD21 ASN 19 HD21 ASN 19 10.276 -12.575 33.936 185 HD22 ASN 19 HD22 ASN 19 10.751 -13.259 32.386 186 H VAL 20 H VAL 20 8.525 -9.657 30.994 187 HA VAL 20 HA VAL 20 5.762 -9.202 31.940 188 HB VAL 20 HB VAL 20 8.243 -7.449 31.956 189 HG11 VAL 20 HG11 VAL 20 5.483 -6.876 33.126 190 HG12 VAL 20 HG12 VAL 20 6.961 -5.955 33.486 191 HG13 VAL 20 HG13 VAL 20 6.305 -5.947 31.850 192 HG21 VAL 20 HG21 VAL 20 8.252 -9.370 33.549 193 HG22 VAL 20 HG22 VAL 20 8.141 -7.822 34.394 194 HG23 VAL 20 HG23 VAL 20 6.693 -8.834 34.198 195 H VAL 21 H VAL 21 7.840 -8.147 29.248 196 HA VAL 21 HA VAL 21 5.598 -6.558 28.095 197 HB VAL 21 HB VAL 21 8.516 -6.518 27.263 198 HG11 VAL 21 HG11 VAL 21 6.171 -4.626 26.714 199 HG12 VAL 21 HG12 VAL 21 7.852 -4.381 26.191 200 HG13 VAL 21 HG13 VAL 21 6.914 -5.719 25.527 201 HG21 VAL 21 HG21 VAL 21 8.367 -5.681 29.563 202 HG22 VAL 21 HG22 VAL 21 8.586 -4.326 28.457 203 HG23 VAL 21 HG23 VAL 21 6.976 -4.660 29.132 204 H LEU 22 H LEU 22 4.456 -8.482 27.608 205 HA LEU 22 HA LEU 22 5.187 -9.651 24.964 206 HB2 LEU 22 HB2 LEU 22 4.221 -11.075 27.471 207 HB3 LEU 22 HB3 LEU 22 4.009 -11.775 25.868 208 HG LEU 22 HG LEU 22 6.702 -11.079 27.116 209 HD11 LEU 22 HD11 LEU 22 5.307 -13.760 26.691 210 HD12 LEU 22 HD12 LEU 22 6.951 -13.526 27.323 211 HD13 LEU 22 HD13 LEU 22 5.556 -12.948 28.252 212 HD21 LEU 22 HD21 LEU 22 6.842 -11.026 24.653 213 HD22 LEU 22 HD22 LEU 22 7.612 -12.487 25.264 214 HD23 LEU 22 HD23 LEU 22 5.987 -12.584 24.549 215 H LYS 23 H LYS 23 3.574 -9.987 23.555 216 HA LYS 23 HA LYS 23 0.785 -9.141 24.243 217 HB2 LYS 23 HB2 LYS 23 2.391 -8.273 21.809 218 HB3 LYS 23 HB3 LYS 23 0.671 -7.954 22.075 219 HG2 LYS 23 HG2 LYS 23 1.273 -6.754 24.209 220 HG3 LYS 23 HG3 LYS 23 2.976 -6.882 23.748 221 HD2 LYS 23 HD2 LYS 23 0.791 -5.493 22.133 222 HD3 LYS 23 HD3 LYS 23 1.970 -4.689 23.178 223 HE2 LYS 23 HE2 LYS 23 3.824 -5.555 21.769 224 HE3 LYS 23 HE3 LYS 23 2.653 -6.350 20.709 225 HZ1 LYS 23 HZ1 LYS 23 2.814 -3.417 21.159 226 HZ2 LYS 23 HZ2 LYS 23 3.331 -4.194 19.821 227 HZ3 LYS 23 HZ3 LYS 23 1.739 -4.157 20.175 228 H ASN 24 H ASN 24 1.614 -11.759 24.231 229 HA ASN 24 HA ASN 24 1.263 -13.846 23.419 230 HB2 ASN 24 HB2 ASN 24 -0.940 -12.942 24.186 231 HB3 ASN 24 HB3 ASN 24 -1.354 -12.606 22.508 232 HD21 ASN 24 HD21 ASN 24 -1.978 -16.032 21.726 233 HD22 ASN 24 HD22 ASN 24 -1.475 -14.472 21.047 234 HA PRO 25 HA PRO 25 2.437 -12.988 18.991 235 HB2 PRO 25 HB2 PRO 25 5.071 -13.614 18.991 236 HB3 PRO 25 HB3 PRO 25 4.462 -12.083 19.678 237 HG2 PRO 25 HG2 PRO 25 5.092 -14.649 21.185 238 HG3 PRO 25 HG3 PRO 25 5.679 -12.992 21.538 239 HD2 PRO 25 HD2 PRO 25 3.496 -14.060 22.787 240 HD3 PRO 25 HD3 PRO 25 3.597 -12.323 22.371 241 H ARG 26 H ARG 26 0.829 -14.812 19.162 242 HA ARG 26 HA ARG 26 1.977 -17.367 18.065 243 HB2 ARG 26 HB2 ARG 26 -0.071 -17.005 20.284 244 HB3 ARG 26 HB3 ARG 26 -0.019 -18.476 19.325 245 HG2 ARG 26 HG2 ARG 26 2.331 -17.441 20.971 246 HG3 ARG 26 HG3 ARG 26 1.150 -18.641 21.498 247 HD2 ARG 26 HD2 ARG 26 1.808 -19.964 19.340 248 HD3 ARG 26 HD3 ARG 26 3.199 -18.886 19.271 249 HE ARG 26 HE ARG 26 4.153 -19.981 21.086 250 HH11 ARG 26 HH11 ARG 26 4.399 -21.647 22.544 251 HH12 ARG 26 HH12 ARG 26 3.047 -22.666 22.939 252 HH21 ARG 26 HH21 ARG 26 0.823 -21.083 20.870 253 HH22 ARG 26 HH22 ARG 26 1.078 -22.361 22.024 254 H VAL 27 H VAL 27 -1.175 -15.742 18.558 255 HA VAL 27 HA VAL 27 -1.899 -16.297 15.711 256 HB VAL 27 HB VAL 27 -3.706 -16.883 18.080 257 HG11 VAL 27 HG11 VAL 27 -4.092 -17.289 15.074 258 HG12 VAL 27 HG12 VAL 27 -5.208 -17.830 16.348 259 HG13 VAL 27 HG13 VAL 27 -4.957 -16.105 16.081 260 HG21 VAL 27 HG21 VAL 27 -2.027 -18.650 17.902 261 HG22 VAL 27 HG22 VAL 27 -3.571 -19.241 17.299 262 HG23 VAL 27 HG23 VAL 27 -2.300 -18.775 16.148 263 HA PRO 28 HA PRO 28 -3.121 -11.951 16.580 264 HB2 PRO 28 HB2 PRO 28 -2.567 -10.876 14.167 265 HB3 PRO 28 HB3 PRO 28 -1.295 -11.203 15.385 266 HG2 PRO 28 HG2 PRO 28 -2.087 -12.943 13.019 267 HG3 PRO 28 HG3 PRO 28 -0.438 -12.448 13.518 268 HD2 PRO 28 HD2 PRO 28 -1.544 -14.859 14.183 269 HD3 PRO 28 HD3 PRO 28 -0.421 -14.004 15.284 270 H THR 29 H THR 29 -4.665 -10.536 15.458 271 HA THR 29 HA THR 29 -6.968 -12.098 14.412 272 HB THR 29 HB THR 29 -8.200 -10.482 15.956 273 HG1 THR 29 HG1 THR 29 -7.004 -9.684 17.677 274 HG21 THR 29 HG21 THR 29 -6.303 -12.513 17.206 275 HG22 THR 29 HG22 THR 29 -7.824 -11.923 17.919 276 HG23 THR 29 HG23 THR 29 -7.855 -12.897 16.437 277 H GLN 30 H GLN 30 -6.205 -11.392 12.311 278 HA GLN 30 HA GLN 30 -6.784 -8.553 11.690 279 HB2 GLN 30 HB2 GLN 30 -5.057 -10.617 10.290 280 HB3 GLN 30 HB3 GLN 30 -5.295 -8.976 9.685 281 HG2 GLN 30 HG2 GLN 30 -4.140 -7.967 11.472 282 HG3 GLN 30 HG3 GLN 30 -4.240 -9.394 12.502 283 HE21 GLN 30 HE21 GLN 30 -1.572 -11.160 10.868 284 HE22 GLN 30 HE22 GLN 30 -3.128 -11.422 11.652 285 H LYS 31 H LYS 31 -8.787 -10.669 11.836 286 HA LYS 31 HA LYS 31 -9.871 -11.226 9.240 287 HB2 LYS 31 HB2 LYS 31 -10.522 -11.645 12.119 288 HB3 LYS 31 HB3 LYS 31 -11.925 -11.700 11.084 289 HG2 LYS 31 HG2 LYS 31 -9.498 -13.340 10.318 290 HG3 LYS 31 HG3 LYS 31 -10.546 -13.875 11.628 291 HD2 LYS 31 HD2 LYS 31 -11.215 -14.941 9.547 292 HD3 LYS 31 HD3 LYS 31 -12.504 -13.898 10.166 293 HE2 LYS 31 HE2 LYS 31 -11.821 -12.119 8.560 294 HE3 LYS 31 HE3 LYS 31 -10.538 -13.170 7.950 295 HZ1 LYS 31 HZ1 LYS 31 -13.448 -13.745 7.780 296 HZ2 LYS 31 HZ2 LYS 31 -12.491 -13.256 6.550 297 HZ3 LYS 31 HZ3 LYS 31 -12.264 -14.728 7.219 298 H THR 32 H THR 32 -9.466 -8.388 9.596 299 HA THR 32 HA THR 32 -12.199 -7.281 9.175 300 HB THR 32 HB THR 32 -11.690 -7.384 11.594 301 HG1 THR 32 HG1 THR 32 -12.308 -5.312 12.054 302 HG21 THR 32 HG21 THR 32 -9.496 -5.359 11.004 303 HG22 THR 32 HG22 THR 32 -10.064 -5.869 12.609 304 HG23 THR 32 HG23 THR 32 -9.263 -7.037 11.550 305 H GLY 33 H GLY 33 -9.448 -7.508 7.669 306 HA2 GLY 33 HA2 GLY 33 -9.687 -5.160 6.068 307 HA3 GLY 33 HA3 GLY 33 -8.396 -4.896 7.245 308 H GLU 34 H GLU 34 -9.546 -7.156 4.769 309 HA GLU 34 HA GLU 34 -6.791 -8.270 4.406 310 HB2 GLU 34 HB2 GLU 34 -9.510 -9.601 4.208 311 HB3 GLU 34 HB3 GLU 34 -7.964 -10.401 3.890 312 HG2 GLU 34 HG2 GLU 34 -7.230 -10.088 6.179 313 HG3 GLU 34 HG3 GLU 34 -8.664 -9.136 6.570 314 H LEU 35 H LEU 35 -8.115 -6.054 2.866 315 HA LEU 35 HA LEU 35 -8.325 -5.190 0.834 316 HB2 LEU 35 HB2 LEU 35 -6.156 -7.206 0.398 317 HB3 LEU 35 HB3 LEU 35 -6.876 -6.451 -1.013 318 HG LEU 35 HG LEU 35 -6.356 -4.249 -0.235 319 HD11 LEU 35 HD11 LEU 35 -5.060 -5.546 2.188 320 HD12 LEU 35 HD12 LEU 35 -4.832 -3.850 1.704 321 HD13 LEU 35 HD13 LEU 35 -6.426 -4.408 2.195 322 HD21 LEU 35 HD21 LEU 35 -4.734 -5.299 -1.620 323 HD22 LEU 35 HD22 LEU 35 -3.848 -4.437 -0.362 324 HD23 LEU 35 HD23 LEU 35 -4.060 -6.208 -0.272 325 H SER 36 H SER 36 -10.305 -5.187 0.178 326 HA SER 36 HA SER 36 -11.675 -7.619 -0.722 327 HB2 SER 36 HB2 SER 36 -12.784 -4.823 -0.536 328 HB3 SER 36 HB3 SER 36 -13.680 -6.326 -0.789 329 HG SER 36 HG SER 36 -13.684 -5.669 1.416 330 H GLU 37 H GLU 37 -11.523 -4.473 -2.337 331 HA GLU 37 HA GLU 37 -10.733 -5.706 -4.849 332 HB2 GLU 37 HB2 GLU 37 -13.428 -6.026 -4.190 333 HB3 GLU 37 HB3 GLU 37 -13.470 -4.516 -5.120 334 HG2 GLU 37 HG2 GLU 37 -12.067 -5.702 -6.877 335 HG3 GLU 37 HG3 GLU 37 -12.252 -7.178 -5.922 336 H GLU 38 H GLU 38 -12.079 -2.869 -3.217 337 HA GLU 38 HA GLU 38 -11.016 -1.012 -5.261 338 HB2 GLU 38 HB2 GLU 38 -12.119 -0.559 -2.457 339 HB3 GLU 38 HB3 GLU 38 -11.624 0.721 -3.574 340 HG2 GLU 38 HG2 GLU 38 -13.314 -0.053 -5.221 341 HG3 GLU 38 HG3 GLU 38 -13.840 -1.310 -4.101 342 H GLN 39 H GLN 39 -9.950 -2.532 -2.301 343 HA GLN 39 HA GLN 39 -7.914 -0.629 -1.585 344 HB2 GLN 39 HB2 GLN 39 -8.497 -3.476 -0.670 345 HB3 GLN 39 HB3 GLN 39 -7.382 -2.364 0.107 346 HG2 GLN 39 HG2 GLN 39 -9.287 -2.201 1.421 347 HG3 GLN 39 HG3 GLN 39 -9.335 -0.753 0.424 348 HE21 GLN 39 HE21 GLN 39 -12.785 -1.837 0.261 349 HE22 GLN 39 HE22 GLN 39 -11.674 -0.880 1.233 350 H LYS 40 H LYS 40 -7.750 -3.845 -3.142 351 HA LYS 40 HA LYS 40 -4.861 -3.796 -3.472 352 HB2 LYS 40 HB2 LYS 40 -5.180 -5.769 -4.879 353 HB3 LYS 40 HB3 LYS 40 -6.053 -5.874 -3.361 354 HG2 LYS 40 HG2 LYS 40 -8.121 -5.005 -4.756 355 HG3 LYS 40 HG3 LYS 40 -7.139 -5.425 -6.156 356 HD2 LYS 40 HD2 LYS 40 -8.733 -7.213 -5.540 357 HD3 LYS 40 HD3 LYS 40 -7.062 -7.785 -5.396 358 HE2 LYS 40 HE2 LYS 40 -7.114 -7.597 -2.977 359 HE3 LYS 40 HE3 LYS 40 -8.632 -6.703 -3.007 360 HZ1 LYS 40 HZ1 LYS 40 -8.374 -9.541 -3.848 361 HZ2 LYS 40 HZ2 LYS 40 -8.918 -9.013 -2.385 362 HZ3 LYS 40 HZ3 LYS 40 -9.772 -8.667 -3.719 363 H LYS 41 H LYS 41 -7.498 -2.513 -5.400 364 HA LYS 41 HA LYS 41 -5.834 -1.719 -7.640 365 HB2 LYS 41 HB2 LYS 41 -8.485 -0.593 -6.655 366 HB3 LYS 41 HB3 LYS 41 -7.726 -0.176 -8.189 367 HG2 LYS 41 HG2 LYS 41 -7.911 -2.463 -8.995 368 HG3 LYS 41 HG3 LYS 41 -8.536 -3.003 -7.432 369 HD2 LYS 41 HD2 LYS 41 -10.484 -1.419 -7.722 370 HD3 LYS 41 HD3 LYS 41 -9.894 -1.067 -9.360 371 HE2 LYS 41 HE2 LYS 41 -10.102 -3.467 -9.951 372 HE3 LYS 41 HE3 LYS 41 -10.614 -3.838 -8.298 373 HZ1 LYS 41 HZ1 LYS 41 -12.116 -2.105 -10.190 374 HZ2 LYS 41 HZ2 LYS 41 -12.524 -3.631 -9.779 375 HZ3 LYS 41 HZ3 LYS 41 -12.581 -2.449 -8.659 376 H ILE 42 H ILE 42 -5.581 -0.695 -4.510 377 HA ILE 42 HA ILE 42 -4.234 1.848 -5.351 378 HB ILE 42 HB ILE 42 -5.364 1.034 -2.666 379 HG12 ILE 42 HG12 ILE 42 -6.312 3.493 -4.148 380 HG13 ILE 42 HG13 ILE 42 -6.876 1.950 -4.758 381 HG21 ILE 42 HG21 ILE 42 -4.057 3.677 -3.446 382 HG22 ILE 42 HG22 ILE 42 -4.809 3.275 -1.884 383 HG23 ILE 42 HG23 ILE 42 -3.344 2.449 -2.389 384 HD11 ILE 42 HD11 ILE 42 -7.229 2.891 -1.903 385 HD12 ILE 42 HD12 ILE 42 -8.477 2.766 -3.176 386 HD13 ILE 42 HD13 ILE 42 -7.700 1.306 -2.551 387 H VAL 43 H VAL 43 -3.868 -1.067 -3.204 388 HA VAL 43 HA VAL 43 -1.064 -0.499 -2.740 389 HB VAL 43 HB VAL 43 -2.472 -3.156 -2.329 390 HG11 VAL 43 HG11 VAL 43 0.112 -2.008 -1.164 391 HG12 VAL 43 HG12 VAL 43 -0.636 -3.552 -0.703 392 HG13 VAL 43 HG13 VAL 43 0.010 -3.344 -2.326 393 HG21 VAL 43 HG21 VAL 43 -3.591 -1.432 -1.028 394 HG22 VAL 43 HG22 VAL 43 -2.632 -2.442 0.046 395 HG23 VAL 43 HG23 VAL 43 -2.033 -0.836 -0.406 396 H ALA 44 H ALA 44 -2.528 -3.198 -4.669 397 HA ALA 44 HA ALA 44 0.053 -3.978 -5.685 398 HB1 ALA 44 HB1 ALA 44 -2.725 -4.740 -6.652 399 HB2 ALA 44 HB2 ALA 44 -1.191 -5.587 -6.988 400 HB3 ALA 44 HB3 ALA 44 -1.819 -5.538 -5.331 401 H ASP 45 H ASP 45 -2.490 -1.845 -6.918 402 HA ASP 45 HA ASP 45 -1.404 -1.282 -9.494 403 HB2 ASP 45 HB2 ASP 45 -3.565 -0.454 -8.636 404 HB3 ASP 45 HB3 ASP 45 -2.716 0.607 -7.505 405 H TYR 46 H TYR 46 -0.411 0.067 -6.283 406 HA TYR 46 HA TYR 46 1.616 1.800 -7.352 407 HB2 TYR 46 HB2 TYR 46 0.394 1.605 -4.984 408 HB3 TYR 46 HB3 TYR 46 1.797 0.641 -4.574 409 HD1 TYR 46 HD1 TYR 46 3.762 2.447 -6.336 410 HD2 TYR 46 HD2 TYR 46 0.791 3.247 -3.349 411 HE1 TYR 46 HE1 TYR 46 4.910 4.552 -5.814 412 HE2 TYR 46 HE2 TYR 46 2.002 5.330 -2.703 413 HH TYR 46 HH TYR 46 4.955 6.422 -4.422 414 H ILE 47 H ILE 47 1.659 -1.592 -6.221 415 HA ILE 47 HA ILE 47 4.487 -2.008 -6.462 416 HB ILE 47 HB ILE 47 2.236 -4.027 -6.750 417 HG12 ILE 47 HG12 ILE 47 1.855 -3.163 -4.623 418 HG13 ILE 47 HG13 ILE 47 2.872 -4.530 -4.286 419 HG21 ILE 47 HG21 ILE 47 5.128 -4.520 -5.975 420 HG22 ILE 47 HG22 ILE 47 3.816 -5.718 -6.013 421 HG23 ILE 47 HG23 ILE 47 4.363 -4.982 -7.514 422 HD11 ILE 47 HD11 ILE 47 3.704 -1.592 -4.325 423 HD12 ILE 47 HD12 ILE 47 3.522 -2.640 -2.918 424 HD13 ILE 47 HD13 ILE 47 4.838 -2.945 -4.074 425 H SER 48 H SER 48 2.037 -1.717 -8.913 426 HA SER 48 HA SER 48 3.761 -2.699 -11.076 427 HB2 SER 48 HB2 SER 48 1.169 -2.802 -10.882 428 HB3 SER 48 HB3 SER 48 1.216 -1.125 -11.454 429 HG SER 48 HG SER 48 1.034 -2.678 -13.162 430 H GLU 49 H GLU 49 3.671 0.311 -9.350 431 HA GLU 49 HA GLU 49 4.389 1.938 -11.738 432 HB2 GLU 49 HB2 GLU 49 3.777 2.675 -8.854 433 HB3 GLU 49 HB3 GLU 49 4.265 3.828 -10.091 434 HG2 GLU 49 HG2 GLU 49 1.825 2.064 -10.378 435 HG3 GLU 49 HG3 GLU 49 1.789 3.614 -9.552 436 H VAL 50 H VAL 50 5.601 1.492 -8.412 437 HA VAL 50 HA VAL 50 8.225 2.555 -9.341 438 HB VAL 50 HB VAL 50 8.534 3.528 -7.181 439 HG11 VAL 50 HG11 VAL 50 5.687 4.101 -8.028 440 HG12 VAL 50 HG12 VAL 50 6.813 5.162 -7.158 441 HG13 VAL 50 HG13 VAL 50 7.136 4.728 -8.842 442 HG21 VAL 50 HG21 VAL 50 7.608 1.820 -5.717 443 HG22 VAL 50 HG22 VAL 50 6.862 3.388 -5.412 444 HG23 VAL 50 HG23 VAL 50 5.977 2.142 -6.325 445 H GLY 51 H GLY 51 6.972 -0.300 -7.843 446 HA2 GLY 51 HA2 GLY 51 8.606 -2.129 -8.590 447 HA3 GLY 51 HA3 GLY 51 9.745 -1.371 -7.474 448 H LEU 52 H LEU 52 9.171 -1.252 -5.249 449 HA LEU 52 HA LEU 52 6.981 -2.780 -4.113 450 HB2 LEU 52 HB2 LEU 52 8.502 -4.592 -4.887 451 HB3 LEU 52 HB3 LEU 52 9.812 -3.949 -3.920 452 HG LEU 52 HG LEU 52 7.308 -4.415 -2.403 453 HD11 LEU 52 HD11 LEU 52 8.842 -6.739 -3.653 454 HD12 LEU 52 HD12 LEU 52 7.632 -6.913 -2.367 455 HD13 LEU 52 HD13 LEU 52 7.141 -6.315 -3.958 456 HD21 LEU 52 HD21 LEU 52 9.408 -3.901 -1.266 457 HD22 LEU 52 HD22 LEU 52 8.821 -5.484 -0.794 458 HD23 LEU 52 HD23 LEU 52 10.160 -5.365 -1.954 459 H ASN 53 H ASN 53 10.207 -1.663 -3.521 460 HA ASN 53 HA ASN 53 9.669 -0.810 -0.745 461 HB2 ASN 53 HB2 ASN 53 12.211 -1.015 -2.409 462 HB3 ASN 53 HB3 ASN 53 12.181 -0.413 -0.758 463 HD21 ASN 53 HD21 ASN 53 12.406 -4.341 -1.255 464 HD22 ASN 53 HD22 ASN 53 12.668 -3.201 -2.565 465 H ASN 54 H ASN 54 9.924 0.781 -3.810 466 HA ASN 54 HA ASN 54 11.072 3.227 -2.740 467 HB2 ASN 54 HB2 ASN 54 9.964 2.691 -5.515 468 HB3 ASN 54 HB3 ASN 54 11.075 3.978 -5.051 469 HD21 ASN 54 HD21 ASN 54 12.562 0.388 -6.034 470 HD22 ASN 54 HD22 ASN 54 10.958 0.966 -6.480 471 H LEU 55 H LEU 55 7.902 2.118 -2.905 472 HA LEU 55 HA LEU 55 6.456 4.569 -3.226 473 HB2 LEU 55 HB2 LEU 55 4.541 3.193 -2.357 474 HB3 LEU 55 HB3 LEU 55 5.385 2.597 -3.771 475 HG LEU 55 HG LEU 55 6.600 0.940 -2.318 476 HD11 LEU 55 HD11 LEU 55 4.468 1.735 -0.300 477 HD12 LEU 55 HD12 LEU 55 5.530 0.318 -0.208 478 HD13 LEU 55 HD13 LEU 55 6.223 1.934 -0.080 479 HD21 LEU 55 HD21 LEU 55 4.692 0.378 -3.741 480 HD22 LEU 55 HD22 LEU 55 4.669 -0.558 -2.235 481 HD23 LEU 55 HD23 LEU 55 3.563 0.823 -2.442 482 H ASN 56 H ASN 56 4.959 5.450 -1.659 483 HA ASN 56 HA ASN 56 6.278 6.159 0.896 484 HB2 ASN 56 HB2 ASN 56 5.347 7.769 -0.913 485 HB3 ASN 56 HB3 ASN 56 3.744 7.311 -0.354 486 HD21 ASN 56 HD21 ASN 56 4.919 10.456 1.335 487 HD22 ASN 56 HD22 ASN 56 4.730 9.968 -0.342 488 H ALA 57 H ALA 57 4.298 6.566 2.636 489 HA ALA 57 HA ALA 57 2.442 4.209 2.633 490 HB1 ALA 57 HB1 ALA 57 3.808 5.549 5.006 491 HB2 ALA 57 HB2 ALA 57 2.611 4.244 5.106 492 HB3 ALA 57 HB3 ALA 57 4.180 3.947 4.344 493 H THR 58 H THR 58 2.733 7.682 2.843 494 HA THR 58 HA THR 58 0.323 8.253 4.237 495 HB THR 58 HB THR 58 1.848 10.038 2.311 496 HG1 THR 58 HG1 THR 58 2.947 10.669 4.179 497 HG21 THR 58 HG21 THR 58 0.018 10.678 4.670 498 HG22 THR 58 HG22 THR 58 1.004 11.863 3.781 499 HG23 THR 58 HG23 THR 58 -0.309 11.015 2.955 500 H GLU 59 H GLU 59 0.946 8.538 0.667 501 HA GLU 59 HA GLU 59 -1.804 9.091 0.103 502 HB2 GLU 59 HB2 GLU 59 -1.254 8.897 -2.211 503 HB3 GLU 59 HB3 GLU 59 -0.019 9.809 -1.350 504 HG2 GLU 59 HG2 GLU 59 1.449 7.769 -1.351 505 HG3 GLU 59 HG3 GLU 59 0.210 6.914 -2.273 506 H LEU 60 H LEU 60 -0.187 6.004 0.493 507 HA LEU 60 HA LEU 60 -2.394 4.356 -0.449 508 HB2 LEU 60 HB2 LEU 60 -0.064 3.913 1.448 509 HB3 LEU 60 HB3 LEU 60 -1.282 2.679 1.196 510 HG LEU 60 HG LEU 60 -0.256 3.764 -1.364 511 HD11 LEU 60 HD11 LEU 60 1.642 2.317 0.520 512 HD12 LEU 60 HD12 LEU 60 1.920 2.560 -1.215 513 HD13 LEU 60 HD13 LEU 60 1.811 3.961 -0.143 514 HD21 LEU 60 HD21 LEU 60 -1.641 1.700 -1.140 515 HD22 LEU 60 HD22 LEU 60 -0.087 1.407 -1.936 516 HD23 LEU 60 HD23 LEU 60 -0.317 0.934 -0.238 517 H SER 61 H SER 61 -1.438 5.312 2.917 518 HA SER 61 HA SER 61 -3.744 4.236 4.127 519 HB2 SER 61 HB2 SER 61 -3.097 5.614 6.095 520 HB3 SER 61 HB3 SER 61 -1.812 4.597 5.458 521 HG SER 61 HG SER 61 -0.824 6.326 4.560 522 H LYS 62 H LYS 62 -3.347 7.307 2.598 523 HA LYS 62 HA LYS 62 -5.808 8.573 3.520 524 HB2 LYS 62 HB2 LYS 62 -3.946 8.976 1.150 525 HB3 LYS 62 HB3 LYS 62 -5.450 9.886 1.296 526 HG2 LYS 62 HG2 LYS 62 -4.794 10.891 3.365 527 HG3 LYS 62 HG3 LYS 62 -3.346 9.881 3.499 528 HD2 LYS 62 HD2 LYS 62 -2.327 10.933 1.559 529 HD3 LYS 62 HD3 LYS 62 -3.837 11.797 1.177 530 HE2 LYS 62 HE2 LYS 62 -3.688 12.988 3.373 531 HE3 LYS 62 HE3 LYS 62 -2.136 12.203 3.679 532 HZ1 LYS 62 HZ1 LYS 62 -2.721 14.043 1.411 533 HZ2 LYS 62 HZ2 LYS 62 -1.839 14.421 2.727 534 HZ3 LYS 62 HZ3 LYS 62 -1.277 13.320 1.662 535 H ARG 63 H ARG 63 -5.058 6.496 0.735 536 HA ARG 63 HA ARG 63 -7.803 6.734 -0.364 537 HB2 ARG 63 HB2 ARG 63 -5.265 5.359 -1.297 538 HB3 ARG 63 HB3 ARG 63 -6.798 5.296 -2.188 539 HG2 ARG 63 HG2 ARG 63 -6.784 7.719 -2.492 540 HG3 ARG 63 HG3 ARG 63 -5.334 7.880 -1.489 541 HD2 ARG 63 HD2 ARG 63 -4.088 6.426 -3.098 542 HD3 ARG 63 HD3 ARG 63 -5.504 6.390 -4.147 543 HE ARG 63 HE ARG 63 -3.641 8.633 -3.662 544 HH11 ARG 63 HH11 ARG 63 -3.696 10.402 -4.992 545 HH12 ARG 63 HH12 ARG 63 -5.028 10.630 -6.085 546 HH21 ARG 63 HH21 ARG 63 -6.691 7.775 -5.171 547 HH22 ARG 63 HH22 ARG 63 -6.677 9.185 -6.194 548 H LEU 64 H LEU 64 -5.800 4.210 1.127 549 HA LEU 64 HA LEU 64 -7.925 2.187 1.100 550 HB2 LEU 64 HB2 LEU 64 -5.190 2.417 2.419 551 HB3 LEU 64 HB3 LEU 64 -6.301 1.128 2.819 552 HG LEU 64 HG LEU 64 -6.208 1.227 -0.054 553 HD11 LEU 64 HD11 LEU 64 -3.436 1.060 1.203 554 HD12 LEU 64 HD12 LEU 64 -3.868 0.775 -0.502 555 HD13 LEU 64 HD13 LEU 64 -4.031 2.386 0.178 556 HD21 LEU 64 HD21 LEU 64 -6.645 -0.722 1.452 557 HD22 LEU 64 HD22 LEU 64 -5.441 -1.050 0.191 558 HD23 LEU 64 HD23 LEU 64 -4.921 -0.755 1.865 559 H ASN 65 H ASN 65 -7.064 4.833 3.218 560 HA ASN 65 HA ASN 65 -7.989 5.663 5.089 561 HB2 ASN 65 HB2 ASN 65 -10.110 5.377 3.756 562 HB3 ASN 65 HB3 ASN 65 -10.415 3.893 4.656 563 HD21 ASN 65 HD21 ASN 65 -11.166 5.657 7.723 564 HD22 ASN 65 HD22 ASN 65 -10.380 4.187 7.134 565 H ILE 66 H ILE 66 -6.077 4.358 5.663 566 HA ILE 66 HA ILE 66 -6.642 2.711 8.082 567 HB ILE 66 HB ILE 66 -4.335 1.623 7.648 568 HG12 ILE 66 HG12 ILE 66 -4.939 2.478 4.797 569 HG13 ILE 66 HG13 ILE 66 -3.633 3.054 5.844 570 HG21 ILE 66 HG21 ILE 66 -6.646 0.732 5.934 571 HG22 ILE 66 HG22 ILE 66 -5.282 -0.255 6.528 572 HG23 ILE 66 HG23 ILE 66 -6.422 0.424 7.686 573 HD11 ILE 66 HD11 ILE 66 -3.916 0.246 4.727 574 HD12 ILE 66 HD12 ILE 66 -2.790 1.517 4.222 575 HD13 ILE 66 HD13 ILE 66 -2.639 0.794 5.847 576 H THR 67 H THR 67 -4.617 2.667 9.429 577 HA THR 67 HA THR 67 -3.634 5.332 10.118 578 HB THR 67 HB THR 67 -3.048 2.501 11.069 579 HG1 THR 67 HG1 THR 67 -4.246 3.212 12.862 580 HG21 THR 67 HG21 THR 67 -2.059 5.136 12.198 581 HG22 THR 67 HG22 THR 67 -2.045 3.580 13.075 582 HG23 THR 67 HG23 THR 67 -1.098 3.754 11.602 583 H VAL 68 H VAL 68 -1.575 6.157 9.587 584 HA VAL 68 HA VAL 68 -0.241 5.245 7.261 585 HB VAL 68 HB VAL 68 1.074 6.858 9.476 586 HG11 VAL 68 HG11 VAL 68 1.517 6.787 6.456 587 HG12 VAL 68 HG12 VAL 68 2.340 7.871 7.597 588 HG13 VAL 68 HG13 VAL 68 2.619 6.132 7.687 589 HG21 VAL 68 HG21 VAL 68 -1.054 7.974 8.932 590 HG22 VAL 68 HG22 VAL 68 0.306 8.888 8.286 591 HG23 VAL 68 HG23 VAL 68 -0.671 7.885 7.199 592 H ASP 69 H ASP 69 0.459 4.550 10.667 593 HA ASP 69 HA ASP 69 2.823 3.010 10.129 594 HB2 ASP 69 HB2 ASP 69 2.316 4.138 12.295 595 HB3 ASP 69 HB3 ASP 69 1.015 2.979 12.573 596 H LYS 70 H LYS 70 -0.585 2.108 10.095 597 HA LYS 70 HA LYS 70 -0.036 -0.770 9.988 598 HB2 LYS 70 HB2 LYS 70 -2.475 0.910 9.254 599 HB3 LYS 70 HB3 LYS 70 -2.358 -0.806 8.873 600 HG2 LYS 70 HG2 LYS 70 -2.017 -1.352 11.256 601 HG3 LYS 70 HG3 LYS 70 -2.181 0.362 11.682 602 HD2 LYS 70 HD2 LYS 70 -4.485 0.389 10.802 603 HD3 LYS 70 HD3 LYS 70 -4.313 -1.285 10.232 604 HE2 LYS 70 HE2 LYS 70 -3.960 -2.048 12.567 605 HE3 LYS 70 HE3 LYS 70 -4.149 -0.388 13.145 606 HZ1 LYS 70 HZ1 LYS 70 -6.251 -1.942 11.721 607 HZ2 LYS 70 HZ2 LYS 70 -6.225 -1.650 13.325 608 HZ3 LYS 70 HZ3 LYS 70 -6.429 -0.416 12.279 609 H ALA 71 H ALA 71 -0.232 1.865 7.619 610 HA ALA 71 HA ALA 71 0.010 0.082 5.312 611 HB1 ALA 71 HB1 ALA 71 0.723 3.044 5.578 612 HB2 ALA 71 HB2 ALA 71 0.528 2.135 4.069 613 HB3 ALA 71 HB3 ALA 71 -0.862 2.410 5.136 614 H LYS 72 H LYS 72 2.363 2.015 7.185 615 HA LYS 72 HA LYS 72 4.739 1.358 5.802 616 HB2 LYS 72 HB2 LYS 72 4.219 2.018 8.714 617 HB3 LYS 72 HB3 LYS 72 5.847 1.783 8.067 618 HG2 LYS 72 HG2 LYS 72 5.628 3.655 6.570 619 HG3 LYS 72 HG3 LYS 72 3.918 3.825 6.956 620 HD2 LYS 72 HD2 LYS 72 5.230 5.550 8.094 621 HD3 LYS 72 HD3 LYS 72 4.378 4.506 9.218 622 HE2 LYS 72 HE2 LYS 72 6.527 4.924 10.142 623 HE3 LYS 72 HE3 LYS 72 6.492 3.237 9.640 624 HZ1 LYS 72 HZ1 LYS 72 7.752 5.460 8.107 625 HZ2 LYS 72 HZ2 LYS 72 8.559 4.339 8.972 626 HZ3 LYS 72 HZ3 LYS 72 7.744 3.894 7.632 627 H THR 73 H THR 73 3.154 -0.571 8.382 628 HA THR 73 HA THR 73 5.283 -2.640 8.103 629 HB THR 73 HB THR 73 4.329 -2.042 10.323 630 HG1 THR 73 HG1 THR 73 4.418 -4.192 10.957 631 HG21 THR 73 HG21 THR 73 1.990 -3.820 9.506 632 HG22 THR 73 HG22 THR 73 2.297 -3.089 11.093 633 HG23 THR 73 HG23 THR 73 1.889 -2.058 9.718 634 H TYR 74 H TYR 74 1.812 -2.332 7.217 635 HA TYR 74 HA TYR 74 1.471 -4.978 6.324 636 HB2 TYR 74 HB2 TYR 74 -0.395 -3.513 6.744 637 HB3 TYR 74 HB3 TYR 74 0.145 -2.388 5.484 638 HD1 TYR 74 HD1 TYR 74 -0.482 -2.626 3.255 639 HD2 TYR 74 HD2 TYR 74 -1.086 -5.889 6.020 640 HE1 TYR 74 HE1 TYR 74 -1.578 -3.917 1.475 641 HE2 TYR 74 HE2 TYR 74 -2.195 -7.204 4.212 642 HH TYR 74 HH TYR 74 -2.450 -5.970 0.871 643 H ILE 75 H ILE 75 2.783 -2.182 4.535 644 HA ILE 75 HA ILE 75 3.037 -3.178 1.932 645 HB ILE 75 HB ILE 75 4.816 -1.451 3.673 646 HG12 ILE 75 HG12 ILE 75 3.351 -0.656 1.125 647 HG13 ILE 75 HG13 ILE 75 2.496 -0.733 2.651 648 HG21 ILE 75 HG21 ILE 75 5.327 -2.037 0.721 649 HG22 ILE 75 HG22 ILE 75 6.151 -0.811 1.705 650 HG23 ILE 75 HG23 ILE 75 6.386 -2.501 2.070 651 HD11 ILE 75 HD11 ILE 75 4.915 1.052 2.107 652 HD12 ILE 75 HD12 ILE 75 3.227 1.568 2.227 653 HD13 ILE 75 HD13 ILE 75 4.065 0.928 3.646 654 H LYS 76 H LYS 76 5.585 -3.611 4.466 655 HA LYS 76 HA LYS 76 6.843 -5.724 2.910 656 HB2 LYS 76 HB2 LYS 76 8.445 -5.844 4.755 657 HB3 LYS 76 HB3 LYS 76 8.183 -4.170 4.259 658 HG2 LYS 76 HG2 LYS 76 6.775 -3.741 6.201 659 HG3 LYS 76 HG3 LYS 76 6.810 -5.455 6.664 660 HD2 LYS 76 HD2 LYS 76 9.249 -5.316 7.030 661 HD3 LYS 76 HD3 LYS 76 9.219 -3.592 6.593 662 HE2 LYS 76 HE2 LYS 76 7.691 -3.115 8.463 663 HE3 LYS 76 HE3 LYS 76 7.589 -4.834 8.860 664 HZ1 LYS 76 HZ1 LYS 76 10.072 -3.206 9.016 665 HZ2 LYS 76 HZ2 LYS 76 9.181 -3.694 10.294 666 HZ3 LYS 76 HZ3 LYS 76 9.968 -4.795 9.386 667 H ASN 77 H ASN 77 4.350 -5.812 5.339 668 HA ASN 77 HA ASN 77 4.811 -8.590 6.043 669 HB2 ASN 77 HB2 ASN 77 3.555 -6.696 7.356 670 HB3 ASN 77 HB3 ASN 77 2.161 -7.158 6.371 671 HD21 ASN 77 HD21 ASN 77 3.653 -9.658 9.276 672 HD22 ASN 77 HD22 ASN 77 4.608 -8.304 8.679 673 H SER 78 H SER 78 2.928 -6.980 3.542 674 HA SER 78 HA SER 78 1.712 -9.531 2.634 675 HB2 SER 78 HB2 SER 78 0.390 -7.427 3.034 676 HB3 SER 78 HB3 SER 78 1.220 -6.723 1.627 677 HG SER 78 HG SER 78 -0.873 -7.794 1.236 678 H ASN 79 H ASN 79 3.689 -6.866 1.303 679 HA ASN 79 HA ASN 79 4.463 -8.639 -0.976 680 HB2 ASN 79 HB2 ASN 79 4.636 -6.608 -2.369 681 HB3 ASN 79 HB3 ASN 79 3.010 -7.106 -1.925 682 HD21 ASN 79 HD21 ASN 79 4.401 -3.498 -0.595 683 HD22 ASN 79 HD22 ASN 79 5.553 -4.800 -0.864 684 H ARG 80 H ARG 80 6.191 -9.431 0.024 685 HA ARG 80 HA ARG 80 8.629 -7.677 -0.017 686 HB2 ARG 80 HB2 ARG 80 9.507 -8.701 1.919 687 HB3 ARG 80 HB3 ARG 80 7.965 -7.957 2.278 688 HG2 ARG 80 HG2 ARG 80 6.864 -10.014 2.612 689 HG3 ARG 80 HG3 ARG 80 7.927 -10.874 1.504 690 HD2 ARG 80 HD2 ARG 80 9.813 -10.354 3.241 691 HD3 ARG 80 HD3 ARG 80 8.479 -10.034 4.354 692 HE ARG 80 HE ARG 80 8.095 -12.330 4.491 693 HH11 ARG 80 HH11 ARG 80 8.449 -14.491 4.110 694 HH12 ARG 80 HH12 ARG 80 9.405 -14.994 2.747 695 HH21 ARG 80 HH21 ARG 80 10.050 -11.827 1.599 696 HH22 ARG 80 HH22 ARG 80 10.300 -13.536 1.380 697 H MET 81 H MET 81 7.543 -9.586 -2.039 698 HA MET 81 HA MET 81 9.299 -11.919 -2.036 699 HB2 MET 81 HB2 MET 81 7.430 -10.725 -4.123 700 HB3 MET 81 HB3 MET 81 8.332 -12.224 -4.353 701 HG2 MET 81 HG2 MET 81 7.259 -13.205 -2.358 702 HG3 MET 81 HG3 MET 81 6.334 -11.720 -2.118 703 HE1 MET 81 HE1 MET 81 4.096 -13.074 -1.986 704 HE2 MET 81 HE2 MET 81 3.587 -14.270 -3.199 705 HE3 MET 81 HE3 MET 81 5.022 -14.579 -2.196 706 H GLY 82 H GLY 82 9.316 -8.813 -3.742 707 HA2 GLY 82 HA2 GLY 82 11.189 -7.613 -4.554 708 HA3 GLY 82 HA3 GLY 82 12.197 -9.051 -4.402 709 H ARG 83 H ARG 83 10.146 -7.210 -6.473 710 HA ARG 83 HA ARG 83 9.281 -7.445 -8.592 711 HB2 ARG 83 HB2 ARG 83 11.998 -8.735 -8.978 712 HB3 ARG 83 HB3 ARG 83 10.911 -8.342 -10.302 713 HG2 ARG 83 HG2 ARG 83 12.497 -6.651 -10.245 714 HG3 ARG 83 HG3 ARG 83 11.000 -5.934 -9.656 715 HD2 ARG 83 HD2 ARG 83 11.815 -5.855 -7.406 716 HD3 ARG 83 HD3 ARG 83 13.139 -6.968 -7.749 717 HE ARG 83 HE ARG 83 12.988 -4.082 -8.399 718 HH11 ARG 83 HH11 ARG 83 14.839 -3.031 -9.034 719 HH12 ARG 83 HH12 ARG 83 16.271 -3.940 -9.411 720 HH21 ARG 83 HH21 ARG 83 14.884 -7.010 -8.785 721 HH22 ARG 83 HH22 ARG 83 16.304 -6.129 -9.276 722 H THR 84 H THR 84 8.342 -9.378 -6.817 723 HA THR 84 HA THR 84 7.369 -11.392 -6.550 724 HB THR 84 HB THR 84 6.564 -11.436 -9.446 725 HG1 THR 84 HG1 THR 84 5.062 -9.831 -8.983 726 HG21 THR 84 HG21 THR 84 5.039 -11.743 -6.807 727 HG22 THR 84 HG22 THR 84 4.370 -11.987 -8.437 728 HG23 THR 84 HG23 THR 84 5.598 -13.095 -7.811 729 H ASN 85 H ASN 85 10.140 -11.604 -7.076 730 HA ASN 85 HA ASN 85 11.808 -12.975 -7.634 731 HB2 ASN 85 HB2 ASN 85 9.698 -15.095 -7.141 732 HB3 ASN 85 HB3 ASN 85 11.435 -15.406 -7.217 733 HD21 ASN 85 HD21 ASN 85 12.081 -13.709 -4.083 734 HD22 ASN 85 HD22 ASN 85 12.822 -14.078 -5.633 735 H ASN 86 H ASN 86 10.238 -11.980 -9.967 736 HA ASN 86 HA ASN 86 10.654 -14.125 -11.938 737 HB2 ASN 86 HB2 ASN 86 9.020 -13.220 -13.121 738 HB3 ASN 86 HB3 ASN 86 8.614 -12.361 -11.645 739 HD21 ASN 86 HD21 ASN 86 9.792 -9.202 -12.951 740 HD22 ASN 86 HD22 ASN 86 9.617 -10.100 -11.443 741 H PHE 87 H PHE 87 12.593 -11.737 -10.699 742 HA PHE 87 HA PHE 87 13.710 -10.495 -12.972 743 HB2 PHE 87 HB2 PHE 87 15.247 -9.502 -11.351 744 HB3 PHE 87 HB3 PHE 87 13.599 -9.496 -10.764 745 HD1 PHE 87 HD1 PHE 87 12.981 -10.693 -8.730 746 HD2 PHE 87 HD2 PHE 87 16.919 -11.173 -10.420 747 HE1 PHE 87 HE1 PHE 87 13.740 -11.784 -6.642 748 HE2 PHE 87 HE2 PHE 87 17.666 -12.307 -8.340 749 HZ PHE 87 HZ PHE 87 16.081 -12.612 -6.447 750 H LYS 88 H LYS 88 14.131 -13.604 -12.707 751 HA LYS 88 HA LYS 88 17.077 -13.849 -12.561 752 HB2 LYS 88 HB2 LYS 88 16.653 -16.250 -12.533 753 HB3 LYS 88 HB3 LYS 88 15.734 -15.411 -11.293 754 HG2 LYS 88 HG2 LYS 88 14.209 -15.702 -13.816 755 HG3 LYS 88 HG3 LYS 88 14.762 -17.254 -13.178 756 HD2 LYS 88 HD2 LYS 88 13.657 -16.823 -11.033 757 HD3 LYS 88 HD3 LYS 88 13.267 -15.179 -11.538 758 HE2 LYS 88 HE2 LYS 88 11.274 -16.489 -11.736 759 HE3 LYS 88 HE3 LYS 88 11.823 -16.062 -13.361 760 HZ1 LYS 88 HZ1 LYS 88 12.271 -18.693 -12.040 761 HZ2 LYS 88 HZ2 LYS 88 11.165 -18.404 -13.201 762 HZ3 LYS 88 HZ3 LYS 88 12.752 -18.315 -13.558 763 H THR 89 H THR 89 15.061 -13.137 -15.018 764 HA THR 89 HA THR 89 16.651 -14.443 -17.179 765 HB THR 89 HB THR 89 13.626 -14.496 -16.791 766 HG1 THR 89 HG1 THR 89 13.981 -16.742 -16.780 767 HG21 THR 89 HG21 THR 89 15.340 -15.511 -19.085 768 HG22 THR 89 HG22 THR 89 13.614 -15.904 -18.836 769 HG23 THR 89 HG23 THR 89 14.099 -14.232 -19.147 770 H ILE 90 H ILE 90 14.076 -12.061 -16.321 771 HA ILE 90 HA ILE 90 14.358 -10.483 -18.720 772 HB ILE 90 HB ILE 90 13.073 -8.823 -17.503 773 HG12 ILE 90 HG12 ILE 90 12.880 -10.705 -15.137 774 HG13 ILE 90 HG13 ILE 90 14.088 -9.417 -15.193 775 HG21 ILE 90 HG21 ILE 90 11.902 -11.621 -17.214 776 HG22 ILE 90 HG22 ILE 90 11.007 -10.105 -17.404 777 HG23 ILE 90 HG23 ILE 90 12.007 -10.706 -18.731 778 HD11 ILE 90 HD11 ILE 90 11.084 -8.993 -15.384 779 HD12 ILE 90 HD12 ILE 90 12.118 -8.659 -13.980 780 HD13 ILE 90 HD13 ILE 90 12.326 -7.725 -15.477 781 H LYS 91 H LYS 91 14.948 -8.143 -18.548 782 HA LYS 91 HA LYS 91 16.501 -6.522 -18.429 783 HB2 LYS 91 HB2 LYS 91 17.605 -7.809 -15.917 784 HB3 LYS 91 HB3 LYS 91 17.893 -6.169 -16.443 785 HG2 LYS 91 HG2 LYS 91 15.083 -7.129 -15.731 786 HG3 LYS 91 HG3 LYS 91 16.244 -6.660 -14.513 787 HD2 LYS 91 HD2 LYS 91 14.798 -4.811 -14.950 788 HD3 LYS 91 HD3 LYS 91 16.435 -4.403 -15.474 789 HE2 LYS 91 HE2 LYS 91 15.815 -4.784 -17.821 790 HE3 LYS 91 HE3 LYS 91 14.208 -5.350 -17.337 791 HZ1 LYS 91 HZ1 LYS 91 15.262 -2.603 -16.902 792 HZ2 LYS 91 HZ2 LYS 91 14.169 -3.023 -18.039 793 HZ3 LYS 91 HZ3 LYS 91 13.772 -3.116 -16.460 794 H MET 92 H MET 92 17.627 -9.786 -18.666 795 HA MET 92 HA MET 92 19.894 -8.741 -20.307 796 HB2 MET 92 HB2 MET 92 21.421 -10.395 -19.327 797 HB3 MET 92 HB3 MET 92 20.848 -9.229 -18.153 798 HG2 MET 92 HG2 MET 92 19.093 -11.571 -18.194 799 HG3 MET 92 HG3 MET 92 20.770 -12.050 -17.971 800 HE1 MET 92 HE1 MET 92 19.727 -13.140 -15.698 801 HE2 MET 92 HE2 MET 92 18.995 -12.164 -14.402 802 HE3 MET 92 HE3 MET 92 18.159 -12.342 -15.959 803 H PHE 93 H PHE 93 17.173 -10.239 -20.794 804 HA PHE 93 HA PHE 93 18.244 -12.092 -22.842 805 HB2 PHE 93 HB2 PHE 93 17.842 -13.190 -20.500 806 HB3 PHE 93 HB3 PHE 93 16.135 -13.065 -20.908 807 HD1 PHE 93 HD1 PHE 93 19.422 -14.362 -22.069 808 HD2 PHE 93 HD2 PHE 93 15.145 -14.731 -22.279 809 HE1 PHE 93 HE1 PHE 93 19.680 -16.520 -23.314 810 HE2 PHE 93 HE2 PHE 93 15.386 -16.892 -23.522 811 HZ PHE 93 HZ PHE 93 17.657 -17.780 -24.035 812 H GLU 94 H GLU 94 17.072 -9.610 -23.300 813 HA GLU 94 HA GLU 94 14.470 -10.236 -24.587 814 HB2 GLU 94 HB2 GLU 94 13.484 -8.189 -23.510 815 HB3 GLU 94 HB3 GLU 94 13.740 -9.566 -22.443 816 HG2 GLU 94 HG2 GLU 94 15.758 -8.550 -21.500 817 HG3 GLU 94 HG3 GLU 94 15.633 -7.186 -22.619 818 H ASP 95 H ASP 95 13.719 -8.713 -26.093 819 HA ASP 95 HA ASP 95 15.896 -7.322 -27.542 820 HB2 ASP 95 HB2 ASP 95 14.120 -9.135 -28.417 821 HB3 ASP 95 HB3 ASP 95 13.144 -7.697 -28.678 822 H ASP 96 H ASP 96 15.064 -5.334 -28.852 823 HA ASP 96 HA ASP 96 14.263 -3.262 -26.943 824 HB2 ASP 96 HB2 ASP 96 15.026 -3.268 -29.877 825 HB3 ASP 96 HB3 ASP 96 14.332 -1.842 -29.115 826 H VAL 97 H VAL 97 12.430 -2.154 -26.788 827 HA VAL 97 HA VAL 97 10.141 -2.692 -28.644 828 HB VAL 97 HB VAL 97 9.923 -2.512 -25.613 829 HG11 VAL 97 HG11 VAL 97 7.804 -3.030 -27.748 830 HG12 VAL 97 HG12 VAL 97 7.551 -3.143 -25.993 831 HG13 VAL 97 HG13 VAL 97 7.929 -1.583 -26.721 832 HG21 VAL 97 HG21 VAL 97 10.826 -4.705 -26.245 833 HG22 VAL 97 HG22 VAL 97 9.146 -4.871 -25.740 834 HG23 VAL 97 HG23 VAL 97 9.555 -4.902 -27.471 835 H SER 98 H SER 98 11.327 -0.512 -26.057 836 HA SER 98 HA SER 98 10.073 1.806 -27.471 837 HB2 SER 98 HB2 SER 98 10.643 1.482 -24.511 838 HB3 SER 98 HB3 SER 98 9.827 2.850 -25.294 839 HG SER 98 HG SER 98 8.331 1.353 -24.412 840 H SER 99 H SER 99 12.912 0.613 -27.656 841 HA SER 99 HA SER 99 15.078 1.225 -27.813 842 HB2 SER 99 HB2 SER 99 13.978 2.695 -29.500 843 HB3 SER 99 HB3 SER 99 14.049 4.026 -28.331 844 HG SER 99 HG SER 99 15.873 3.992 -29.740 845 H ALA 100 H ALA 100 15.621 0.713 -25.681 846 HA ALA 100 HA ALA 100 16.566 3.018 -24.063 847 HB1 ALA 100 HB1 ALA 100 14.852 0.744 -22.977 848 HB2 ALA 100 HB2 ALA 100 15.663 1.990 -22.006 849 HB3 ALA 100 HB3 ALA 100 14.372 2.449 -23.131 850 H SER 101 H SER 101 18.689 2.717 -24.215 851 HA SER 101 HA SER 101 19.921 0.162 -23.252 852 HB2 SER 101 HB2 SER 101 20.642 1.625 -25.823 853 HB3 SER 101 HB3 SER 101 21.618 0.349 -25.073 854 HG SER 101 HG SER 101 20.220 -0.445 -26.729 855 H ALA 102 H ALA 102 21.165 0.700 -21.573 856 HA ALA 102 HA ALA 102 22.440 1.827 -20.103 857 HB1 ALA 102 HB1 ALA 102 23.864 2.820 -22.584 858 HB2 ALA 102 HB2 ALA 102 24.541 2.684 -20.948 859 HB3 ALA 102 HB3 ALA 102 24.081 1.218 -21.837 860 H GLN 103 H GLN 103 20.058 3.197 -20.862 861 HA GLN 103 HA GLN 103 20.711 6.087 -20.471 862 HB2 GLN 103 HB2 GLN 103 18.534 4.654 -22.004 863 HB3 GLN 103 HB3 GLN 103 18.392 6.361 -21.598 864 HG2 GLN 103 HG2 GLN 103 20.086 7.052 -22.994 865 HG3 GLN 103 HG3 GLN 103 20.949 5.530 -22.949 866 HE21 GLN 103 HE21 GLN 103 19.374 5.918 -26.338 867 HE22 GLN 103 HE22 GLN 103 20.444 6.937 -25.381 868 HA PRO 104 HA PRO 104 18.208 5.882 -16.745 869 HB2 PRO 104 HB2 PRO 104 17.662 8.514 -16.303 870 HB3 PRO 104 HB3 PRO 104 19.298 7.817 -16.120 871 HG2 PRO 104 HG2 PRO 104 18.183 9.328 -18.503 872 HG3 PRO 104 HG3 PRO 104 19.753 9.561 -17.676 873 HD2 PRO 104 HD2 PRO 104 19.487 8.064 -19.956 874 HD3 PRO 104 HD3 PRO 104 20.678 7.658 -18.685 875 H ASN 105 H ASN 105 16.382 4.774 -17.267 876 HA ASN 105 HA ASN 105 13.998 6.314 -18.129 877 HB2 ASN 105 HB2 ASN 105 15.288 5.128 -20.068 878 HB3 ASN 105 HB3 ASN 105 14.677 3.623 -19.385 879 HD21 ASN 105 HD21 ASN 105 12.074 6.306 -21.155 880 HD22 ASN 105 HD22 ASN 105 13.575 6.892 -20.455 881 H LEU 106 H LEU 106 14.756 5.404 -15.553 882 HA LEU 106 HA LEU 106 12.597 3.440 -14.867 883 HB2 LEU 106 HB2 LEU 106 15.441 3.600 -13.828 884 HB3 LEU 106 HB3 LEU 106 14.170 2.652 -13.064 885 HG LEU 106 HG LEU 106 15.117 2.217 -15.933 886 HD11 LEU 106 HD11 LEU 106 15.802 0.691 -13.389 887 HD12 LEU 106 HD12 LEU 106 16.282 0.246 -15.044 888 HD13 LEU 106 HD13 LEU 106 16.906 1.734 -14.315 889 HD21 LEU 106 HD21 LEU 106 12.827 1.372 -15.557 890 HD22 LEU 106 HD22 LEU 106 13.964 0.031 -15.688 891 HD23 LEU 106 HD23 LEU 106 13.367 0.525 -14.088 892 HA PRO 107 HA PRO 107 11.863 7.338 -12.501 893 HB2 PRO 107 HB2 PRO 107 9.129 7.282 -12.524 894 HB3 PRO 107 HB3 PRO 107 10.115 7.880 -13.894 895 HG2 PRO 107 HG2 PRO 107 8.887 5.127 -13.542 896 HG3 PRO 107 HG3 PRO 107 8.824 6.193 -14.982 897 HD2 PRO 107 HD2 PRO 107 10.626 4.171 -14.757 898 HD3 PRO 107 HD3 PRO 107 11.063 5.714 -15.549 Start of MODEL 24 1 H1 GLY -5 H1 GLY -5 -51.081 30.493 28.929 2 H2 GLY -5 H2 GLY -5 -52.275 29.434 29.297 3 H3 GLY -5 H3 GLY -5 -52.571 30.680 28.276 4 HA2 GLY -5 HA2 GLY -5 -52.370 28.646 27.022 5 HA3 GLY -5 HA3 GLY -5 -51.060 29.775 26.632 6 H SER -4 H SER -4 -49.204 28.669 26.370 7 HA SER -4 HA SER -4 -48.396 26.612 28.380 8 HB2 SER -4 HB2 SER -4 -47.258 25.399 26.554 9 HB3 SER -4 HB3 SER -4 -49.022 25.428 26.384 10 HG SER -4 HG SER -4 -47.960 25.881 24.399 11 H HIS -3 H HIS -3 -46.223 26.484 28.901 12 HA HIS -3 HA HIS -3 -44.263 28.370 27.759 13 HB2 HIS -3 HB2 HIS -3 -45.642 29.507 29.665 14 HB3 HIS -3 HB3 HIS -3 -44.754 28.451 30.754 15 HD2 HIS -3 HD2 HIS -3 -41.914 28.776 30.596 16 HE1 HIS -3 HE1 HIS -3 -42.182 32.808 29.217 17 HE2 HIS -3 HE2 HIS -3 -40.630 31.050 30.207 18 H MET -2 H MET -2 -42.377 27.355 27.573 19 HA MET -2 HA MET -2 -41.580 25.220 29.500 20 HB2 MET -2 HB2 MET -2 -41.583 24.919 26.467 21 HB3 MET -2 HB3 MET -2 -40.848 23.797 27.623 22 HG2 MET -2 HG2 MET -2 -43.084 23.407 28.642 23 HG3 MET -2 HG3 MET -2 -43.804 24.470 27.427 24 HE1 MET -2 HE1 MET -2 -45.557 22.717 26.688 25 HE2 MET -2 HE2 MET -2 -45.173 21.028 26.293 26 HE3 MET -2 HE3 MET -2 -44.944 21.625 27.952 27 H ALA -1 H ALA -1 -39.892 26.165 30.395 28 HA ALA -1 HA ALA -1 -37.764 27.388 28.699 29 HB1 ALA -1 HB1 ALA -1 -38.623 28.093 31.526 30 HB2 ALA -1 HB2 ALA -1 -37.391 28.935 30.558 31 HB3 ALA -1 HB3 ALA -1 -39.090 28.981 30.053 32 H SER 0 H SER 0 -38.062 24.590 29.750 33 HA SER 0 HA SER 0 -35.538 24.318 31.330 34 HB2 SER 0 HB2 SER 0 -38.069 22.664 31.244 35 HB3 SER 0 HB3 SER 0 -36.640 22.280 32.240 36 HG SER 0 HG SER 0 -38.225 23.437 33.427 37 H MET 1 H MET 1 -35.945 24.192 28.284 38 HA MET 1 HA MET 1 -34.223 21.842 27.836 39 HB2 MET 1 HB2 MET 1 -35.667 20.781 26.180 40 HB3 MET 1 HB3 MET 1 -36.511 20.899 27.721 41 HG2 MET 1 HG2 MET 1 -37.712 22.928 26.885 42 HG3 MET 1 HG3 MET 1 -36.889 22.750 25.330 43 HE1 MET 1 HE1 MET 1 -39.117 22.782 23.969 44 HE2 MET 1 HE2 MET 1 -40.549 21.823 24.406 45 HE3 MET 1 HE3 MET 1 -39.960 23.090 25.503 46 H ASP 2 H ASP 2 -35.184 24.893 26.859 47 HA ASP 2 HA ASP 2 -33.351 24.860 24.494 48 HB2 ASP 2 HB2 ASP 2 -35.799 24.691 23.896 49 HB3 ASP 2 HB3 ASP 2 -36.039 26.273 24.635 50 H GLN 3 H GLN 3 -33.354 25.881 27.416 51 HA GLN 3 HA GLN 3 -32.278 28.621 26.954 52 HB2 GLN 3 HB2 GLN 3 -34.785 28.465 27.665 53 HB3 GLN 3 HB3 GLN 3 -34.156 27.866 29.190 54 HG2 GLN 3 HG2 GLN 3 -32.718 30.179 29.042 55 HG3 GLN 3 HG3 GLN 3 -34.029 30.625 27.963 56 HE21 GLN 3 HE21 GLN 3 -34.983 29.723 31.904 57 HE22 GLN 3 HE22 GLN 3 -33.651 28.893 31.119 58 H LEU 4 H LEU 4 -31.116 25.879 27.588 59 HA LEU 4 HA LEU 4 -29.764 26.444 30.201 60 HB2 LEU 4 HB2 LEU 4 -30.514 23.744 29.022 61 HB3 LEU 4 HB3 LEU 4 -29.714 24.027 30.566 62 HG LEU 4 HG LEU 4 -32.586 24.777 29.860 63 HD11 LEU 4 HD11 LEU 4 -31.413 22.721 31.774 64 HD12 LEU 4 HD12 LEU 4 -33.139 23.077 31.554 65 HD13 LEU 4 HD13 LEU 4 -32.206 22.381 30.218 66 HD21 LEU 4 HD21 LEU 4 -31.706 26.445 31.435 67 HD22 LEU 4 HD22 LEU 4 -32.832 25.363 32.252 68 HD23 LEU 4 HD23 LEU 4 -31.081 25.152 32.487 69 H ASP 5 H ASP 5 -27.672 25.138 30.371 70 HA ASP 5 HA ASP 5 -26.176 25.131 27.785 71 HB2 ASP 5 HB2 ASP 5 -25.933 27.255 29.136 72 HB3 ASP 5 HB3 ASP 5 -25.190 26.297 30.415 73 H GLU 6 H GLU 6 -27.229 23.000 29.826 74 HA GLU 6 HA GLU 6 -24.695 21.589 30.448 75 HB2 GLU 6 HB2 GLU 6 -26.023 20.245 31.956 76 HB3 GLU 6 HB3 GLU 6 -26.264 21.962 32.258 77 HG2 GLU 6 HG2 GLU 6 -28.428 21.891 31.034 78 HG3 GLU 6 HG3 GLU 6 -28.184 20.180 30.687 79 H ILE 7 H ILE 7 -26.467 21.620 27.752 80 HA ILE 7 HA ILE 7 -27.255 18.874 27.456 81 HB ILE 7 HB ILE 7 -26.972 20.866 25.182 82 HG12 ILE 7 HG12 ILE 7 -29.610 21.089 25.836 83 HG13 ILE 7 HG13 ILE 7 -28.951 20.888 27.452 84 HG21 ILE 7 HG21 ILE 7 -28.891 18.544 25.665 85 HG22 ILE 7 HG22 ILE 7 -28.868 19.606 24.240 86 HG23 ILE 7 HG23 ILE 7 -27.509 18.534 24.549 87 HD11 ILE 7 HD11 ILE 7 -28.135 23.002 25.402 88 HD12 ILE 7 HD12 ILE 7 -29.179 23.253 26.812 89 HD13 ILE 7 HD13 ILE 7 -27.464 22.872 27.040 90 H ILE 8 H ILE 8 -24.422 20.673 26.292 91 HA ILE 8 HA ILE 8 -23.154 18.160 25.305 92 HB ILE 8 HB ILE 8 -23.292 20.794 23.784 93 HG12 ILE 8 HG12 ILE 8 -24.462 18.044 23.148 94 HG13 ILE 8 HG13 ILE 8 -25.372 19.483 23.603 95 HG21 ILE 8 HG21 ILE 8 -21.841 18.203 23.055 96 HG22 ILE 8 HG22 ILE 8 -21.981 19.642 22.020 97 HG23 ILE 8 HG23 ILE 8 -21.068 19.745 23.502 98 HD11 ILE 8 HD11 ILE 8 -23.889 19.058 20.999 99 HD12 ILE 8 HD12 ILE 8 -25.626 19.223 21.269 100 HD13 ILE 8 HD13 ILE 8 -24.566 20.624 21.521 101 H GLU 9 H GLU 9 -20.978 18.024 25.584 102 HA GLU 9 HA GLU 9 -19.531 20.219 27.016 103 HB2 GLU 9 HB2 GLU 9 -19.591 17.235 27.584 104 HB3 GLU 9 HB3 GLU 9 -18.280 18.277 28.131 105 HG2 GLU 9 HG2 GLU 9 -19.891 19.725 29.334 106 HG3 GLU 9 HG3 GLU 9 -21.224 18.702 28.795 107 H GLN 10 H GLN 10 -17.177 20.154 26.772 108 HA GLN 10 HA GLN 10 -16.221 19.033 24.187 109 HB2 GLN 10 HB2 GLN 10 -17.323 21.179 23.664 110 HB3 GLN 10 HB3 GLN 10 -16.255 22.015 24.793 111 HG2 GLN 10 HG2 GLN 10 -14.284 21.248 23.413 112 HG3 GLN 10 HG3 GLN 10 -15.405 20.511 22.270 113 HE21 GLN 10 HE21 GLN 10 -14.419 24.207 21.471 114 HE22 GLN 10 HE22 GLN 10 -13.415 22.964 22.207 115 H ILE 11 H ILE 11 -14.966 21.565 26.436 116 HA ILE 11 HA ILE 11 -12.767 19.807 27.256 117 HB ILE 11 HB ILE 11 -11.858 20.846 25.332 118 HG12 ILE 11 HG12 ILE 11 -10.847 22.325 27.784 119 HG13 ILE 11 HG13 ILE 11 -10.533 20.620 27.439 120 HG21 ILE 11 HG21 ILE 11 -12.553 23.605 26.429 121 HG22 ILE 11 HG22 ILE 11 -11.713 23.234 24.912 122 HG23 ILE 11 HG23 ILE 11 -13.407 22.798 25.099 123 HD11 ILE 11 HD11 ILE 11 -9.587 22.993 25.774 124 HD12 ILE 11 HD12 ILE 11 -8.602 21.916 26.774 125 HD13 ILE 11 HD13 ILE 11 -9.385 21.284 25.312 126 H GLN 12 H GLN 12 -12.725 19.808 29.307 127 HA GLN 12 HA GLN 12 -13.257 22.157 31.012 128 HB2 GLN 12 HB2 GLN 12 -15.081 20.964 32.232 129 HB3 GLN 12 HB3 GLN 12 -15.492 21.499 30.625 130 HG2 GLN 12 HG2 GLN 12 -14.671 18.625 31.217 131 HG3 GLN 12 HG3 GLN 12 -16.331 19.193 31.333 132 HE21 GLN 12 HE21 GLN 12 -15.090 18.054 27.730 133 HE22 GLN 12 HE22 GLN 12 -14.381 17.521 29.240 134 H LYS 13 H LYS 13 -10.891 20.733 30.631 135 HA LYS 13 HA LYS 13 -9.160 19.674 31.690 136 HB2 LYS 13 HB2 LYS 13 -10.395 21.053 34.099 137 HB3 LYS 13 HB3 LYS 13 -8.726 20.487 33.965 138 HG2 LYS 13 HG2 LYS 13 -8.327 22.039 32.076 139 HG3 LYS 13 HG3 LYS 13 -9.989 22.647 32.222 140 HD2 LYS 13 HD2 LYS 13 -9.526 23.384 34.543 141 HD3 LYS 13 HD3 LYS 13 -7.854 22.795 34.396 142 HE2 LYS 13 HE2 LYS 13 -7.465 24.354 32.508 143 HE3 LYS 13 HE3 LYS 13 -9.135 24.926 32.621 144 HZ1 LYS 13 HZ1 LYS 13 -7.093 25.212 34.764 145 HZ2 LYS 13 HZ2 LYS 13 -7.610 26.412 33.788 146 HZ3 LYS 13 HZ3 LYS 13 -8.636 25.743 34.864 147 H GLU 14 H GLU 14 -11.212 17.892 31.290 148 HA GLU 14 HA GLU 14 -12.179 15.919 31.880 149 HB2 GLU 14 HB2 GLU 14 -9.323 15.588 32.801 150 HB3 GLU 14 HB3 GLU 14 -10.512 14.278 33.015 151 HG2 GLU 14 HG2 GLU 14 -11.159 14.394 30.702 152 HG3 GLU 14 HG3 GLU 14 -9.995 15.690 30.394 153 H ALA 15 H ALA 15 -13.740 17.009 33.137 154 HA ALA 15 HA ALA 15 -13.432 17.021 35.943 155 HB1 ALA 15 HB1 ALA 15 -15.909 17.431 34.215 156 HB2 ALA 15 HB2 ALA 15 -15.807 17.808 35.950 157 HB3 ALA 15 HB3 ALA 15 -14.791 18.688 34.790 158 H ILE 16 H ILE 16 -15.997 15.296 34.202 159 HA ILE 16 HA ILE 16 -15.745 12.937 36.003 160 HB ILE 16 HB ILE 16 -18.124 14.663 35.327 161 HG12 ILE 16 HG12 ILE 16 -17.009 13.624 37.973 162 HG13 ILE 16 HG13 ILE 16 -16.812 15.252 37.325 163 HG21 ILE 16 HG21 ILE 16 -18.325 11.878 36.541 164 HG22 ILE 16 HG22 ILE 16 -19.673 13.026 36.368 165 HG23 ILE 16 HG23 ILE 16 -18.927 12.357 34.935 166 HD11 ILE 16 HD11 ILE 16 -19.389 14.039 38.355 167 HD12 ILE 16 HD12 ILE 16 -18.465 15.394 39.009 168 HD13 ILE 16 HD13 ILE 16 -19.301 15.577 37.455 169 H ASN 17 H ASN 17 -15.797 13.951 32.932 170 HA ASN 17 HA ASN 17 -17.460 11.957 31.775 171 HB2 ASN 17 HB2 ASN 17 -15.353 13.748 30.462 172 HB3 ASN 17 HB3 ASN 17 -16.532 12.794 29.574 173 HD21 ASN 17 HD21 ASN 17 -17.675 16.389 30.926 174 HD22 ASN 17 HD22 ASN 17 -15.996 15.844 30.976 175 H SER 18 H SER 18 -14.183 11.777 32.698 176 HA SER 18 HA SER 18 -13.596 9.444 30.912 177 HB2 SER 18 HB2 SER 18 -11.737 11.000 32.737 178 HB3 SER 18 HB3 SER 18 -11.277 9.707 31.613 179 HG SER 18 HG SER 18 -10.961 11.807 30.744 180 H ASN 19 H ASN 19 -13.733 10.250 34.395 181 HA ASN 19 HA ASN 19 -12.924 7.564 35.165 182 HB2 ASN 19 HB2 ASN 19 -13.117 8.508 37.472 183 HB3 ASN 19 HB3 ASN 19 -12.095 9.463 36.402 184 HD21 ASN 19 HD21 ASN 19 -15.409 11.183 37.968 185 HD22 ASN 19 HD22 ASN 19 -15.012 9.512 38.346 186 H VAL 20 H VAL 20 -15.949 8.899 34.443 187 HA VAL 20 HA VAL 20 -17.375 6.610 35.763 188 HB VAL 20 HB VAL 20 -18.507 9.111 34.464 189 HG11 VAL 20 HG11 VAL 20 -19.907 6.842 35.949 190 HG12 VAL 20 HG12 VAL 20 -20.659 8.387 35.494 191 HG13 VAL 20 HG13 VAL 20 -20.122 7.276 34.238 192 HG21 VAL 20 HG21 VAL 20 -17.434 9.600 36.623 193 HG22 VAL 20 HG22 VAL 20 -19.188 9.649 36.814 194 HG23 VAL 20 HG23 VAL 20 -18.279 8.235 37.384 195 H VAL 21 H VAL 21 -16.459 7.886 32.593 196 HA VAL 21 HA VAL 21 -17.559 5.423 31.302 197 HB VAL 21 HB VAL 21 -17.706 8.196 30.062 198 HG11 VAL 21 HG11 VAL 21 -18.908 5.509 29.240 199 HG12 VAL 21 HG12 VAL 21 -19.148 7.062 28.411 200 HG13 VAL 21 HG13 VAL 21 -17.546 6.322 28.432 201 HG21 VAL 21 HG21 VAL 21 -19.323 8.141 31.885 202 HG22 VAL 21 HG22 VAL 21 -20.164 7.989 30.345 203 HG23 VAL 21 HG23 VAL 21 -19.915 6.548 31.356 204 H LEU 22 H LEU 22 -15.524 4.470 31.402 205 HA LEU 22 HA LEU 22 -13.589 5.526 29.393 206 HB2 LEU 22 HB2 LEU 22 -12.879 5.317 31.938 207 HB3 LEU 22 HB3 LEU 22 -12.779 3.605 31.571 208 HG LEU 22 HG LEU 22 -11.182 4.209 29.665 209 HD11 LEU 22 HD11 LEU 22 -11.180 6.921 31.067 210 HD12 LEU 22 HD12 LEU 22 -10.033 6.403 29.816 211 HD13 LEU 22 HD13 LEU 22 -11.737 6.623 29.411 212 HD21 LEU 22 HD21 LEU 22 -10.381 3.363 31.838 213 HD22 LEU 22 HD22 LEU 22 -9.260 4.560 31.168 214 HD23 LEU 22 HD23 LEU 22 -10.362 5.019 32.485 215 H LYS 23 H LYS 23 -13.023 4.281 27.761 216 HA LYS 23 HA LYS 23 -14.051 1.469 27.544 217 HB2 LYS 23 HB2 LYS 23 -14.185 3.697 25.472 218 HB3 LYS 23 HB3 LYS 23 -14.611 2.005 25.170 219 HG2 LYS 23 HG2 LYS 23 -16.386 2.100 26.868 220 HG3 LYS 23 HG3 LYS 23 -15.995 3.794 27.215 221 HD2 LYS 23 HD2 LYS 23 -16.562 4.435 24.910 222 HD3 LYS 23 HD3 LYS 23 -16.939 2.741 24.516 223 HE2 LYS 23 HE2 LYS 23 -18.717 2.714 26.226 224 HE3 LYS 23 HE3 LYS 23 -18.316 4.368 26.706 225 HZ1 LYS 23 HZ1 LYS 23 -19.326 3.582 24.021 226 HZ2 LYS 23 HZ2 LYS 23 -20.211 4.308 25.181 227 HZ3 LYS 23 HZ3 LYS 23 -18.975 5.111 24.483 228 H ASN 24 H ASN 24 -11.426 2.298 28.321 229 HA ASN 24 HA ASN 24 -9.207 2.235 27.873 230 HB2 ASN 24 HB2 ASN 24 -10.037 -0.131 28.179 231 HB3 ASN 24 HB3 ASN 24 -9.945 -0.335 26.432 232 HD21 ASN 24 HD21 ASN 24 -6.364 -0.499 26.419 233 HD22 ASN 24 HD22 ASN 24 -7.766 -0.021 25.450 234 HA PRO 25 HA PRO 25 -9.585 3.775 23.484 235 HB2 PRO 25 HB2 PRO 25 -9.524 6.463 23.760 236 HB3 PRO 25 HB3 PRO 25 -10.967 5.511 24.206 237 HG2 PRO 25 HG2 PRO 25 -8.755 6.472 26.065 238 HG3 PRO 25 HG3 PRO 25 -10.524 6.701 26.247 239 HD2 PRO 25 HD2 PRO 25 -9.181 4.641 27.456 240 HD3 PRO 25 HD3 PRO 25 -10.854 4.476 26.846 241 H ARG 26 H ARG 26 -7.497 2.538 23.788 242 HA ARG 26 HA ARG 26 -5.080 4.308 23.463 243 HB2 ARG 26 HB2 ARG 26 -5.351 1.549 24.714 244 HB3 ARG 26 HB3 ARG 26 -3.815 2.235 24.195 245 HG2 ARG 26 HG2 ARG 26 -3.889 2.641 26.474 246 HG3 ARG 26 HG3 ARG 26 -4.231 4.203 25.728 247 HD2 ARG 26 HD2 ARG 26 -6.607 3.991 26.299 248 HD3 ARG 26 HD3 ARG 26 -6.368 2.318 26.805 249 HE ARG 26 HE ARG 26 -5.470 3.020 28.824 250 HH11 ARG 26 HH11 ARG 26 -5.101 4.446 30.467 251 HH12 ARG 26 HH12 ARG 26 -5.120 6.158 30.164 252 HH21 ARG 26 HH21 ARG 26 -5.803 5.882 26.811 253 HH22 ARG 26 HH22 ARG 26 -5.512 6.953 28.153 254 H VAL 27 H VAL 27 -5.996 0.965 22.558 255 HA VAL 27 HA VAL 27 -5.171 1.444 19.749 256 HB VAL 27 HB VAL 27 -3.945 -0.762 21.449 257 HG11 VAL 27 HG11 VAL 27 -3.549 -0.007 18.513 258 HG12 VAL 27 HG12 VAL 27 -2.615 -1.229 19.403 259 HG13 VAL 27 HG13 VAL 27 -4.332 -1.486 19.114 260 HG21 VAL 27 HG21 VAL 27 -2.817 1.347 21.949 261 HG22 VAL 27 HG22 VAL 27 -1.782 0.348 20.936 262 HG23 VAL 27 HG23 VAL 27 -2.664 1.711 20.213 263 HA PRO 28 HA PRO 28 -8.754 -1.418 19.741 264 HB2 PRO 28 HB2 PRO 28 -9.873 -0.711 17.392 265 HB3 PRO 28 HB3 PRO 28 -10.024 0.296 18.865 266 HG2 PRO 28 HG2 PRO 28 -8.064 0.648 16.570 267 HG3 PRO 28 HG3 PRO 28 -9.073 1.900 17.366 268 HD2 PRO 28 HD2 PRO 28 -6.438 1.447 17.989 269 HD3 PRO 28 HD3 PRO 28 -7.628 2.025 19.196 270 H THR 29 H THR 29 -9.546 -3.028 18.179 271 HA THR 29 HA THR 29 -7.302 -4.426 16.825 272 HB THR 29 HB THR 29 -8.428 -6.421 17.988 273 HG1 THR 29 HG1 THR 29 -9.458 -5.939 19.917 274 HG21 THR 29 HG21 THR 29 -6.975 -4.345 19.682 275 HG22 THR 29 HG22 THR 29 -7.078 -6.090 20.023 276 HG23 THR 29 HG23 THR 29 -6.197 -5.515 18.596 277 H GLN 30 H GLN 30 -8.192 -3.653 14.858 278 HA GLN 30 HA GLN 30 -10.623 -5.103 13.953 279 HB2 GLN 30 HB2 GLN 30 -11.258 -3.163 12.660 280 HB3 GLN 30 HB3 GLN 30 -10.912 -2.670 14.313 281 HG2 GLN 30 HG2 GLN 30 -8.492 -2.122 13.387 282 HG3 GLN 30 HG3 GLN 30 -9.266 -2.187 11.804 283 HE21 GLN 30 HE21 GLN 30 -10.122 0.889 14.417 284 HE22 GLN 30 HE22 GLN 30 -9.398 -0.599 15.020 285 H LYS 31 H LYS 31 -7.816 -5.920 13.688 286 HA LYS 31 HA LYS 31 -7.307 -5.933 10.778 287 HB2 LYS 31 HB2 LYS 31 -5.591 -5.512 12.574 288 HB3 LYS 31 HB3 LYS 31 -5.762 -7.187 13.066 289 HG2 LYS 31 HG2 LYS 31 -5.328 -7.408 10.288 290 HG3 LYS 31 HG3 LYS 31 -4.402 -5.971 10.698 291 HD2 LYS 31 HD2 LYS 31 -2.919 -7.842 10.827 292 HD3 LYS 31 HD3 LYS 31 -3.231 -7.339 12.499 293 HE2 LYS 31 HE2 LYS 31 -4.958 -9.131 12.700 294 HE3 LYS 31 HE3 LYS 31 -4.694 -9.585 11.022 295 HZ1 LYS 31 HZ1 LYS 31 -2.644 -9.771 13.172 296 HZ2 LYS 31 HZ2 LYS 31 -3.456 -11.032 12.530 297 HZ3 LYS 31 HZ3 LYS 31 -2.401 -10.195 11.612 298 H THR 32 H THR 32 -9.258 -7.086 10.254 299 HA THR 32 HA THR 32 -9.027 -10.049 10.436 300 HB THR 32 HB THR 32 -10.273 -9.327 12.369 301 HG1 THR 32 HG1 THR 32 -11.993 -10.713 12.086 302 HG21 THR 32 HG21 THR 32 -12.407 -8.249 10.492 303 HG22 THR 32 HG22 THR 32 -12.517 -8.411 12.256 304 HG23 THR 32 HG23 THR 32 -11.355 -7.284 11.545 305 H GLY 33 H GLY 33 -8.311 -8.849 8.235 306 HA2 GLY 33 HA2 GLY 33 -8.559 -9.352 5.960 307 HA3 GLY 33 HA3 GLY 33 -10.209 -9.899 6.242 308 H GLU 34 H GLU 34 -8.251 -6.917 6.282 309 HA GLU 34 HA GLU 34 -10.586 -5.209 5.752 310 HB2 GLU 34 HB2 GLU 34 -7.676 -4.628 6.400 311 HB3 GLU 34 HB3 GLU 34 -8.885 -3.370 6.150 312 HG2 GLU 34 HG2 GLU 34 -9.120 -5.524 8.291 313 HG3 GLU 34 HG3 GLU 34 -8.424 -3.930 8.549 314 H LEU 35 H LEU 35 -9.270 -6.988 3.557 315 HA LEU 35 HA LEU 35 -9.205 -4.930 1.451 316 HB2 LEU 35 HB2 LEU 35 -7.255 -7.261 1.760 317 HB3 LEU 35 HB3 LEU 35 -7.545 -6.386 0.267 318 HG LEU 35 HG LEU 35 -6.981 -4.252 1.767 319 HD11 LEU 35 HD11 LEU 35 -5.326 -6.458 3.074 320 HD12 LEU 35 HD12 LEU 35 -5.107 -4.711 3.302 321 HD13 LEU 35 HD13 LEU 35 -6.579 -5.496 3.884 322 HD21 LEU 35 HD21 LEU 35 -5.824 -4.978 -0.299 323 HD22 LEU 35 HD22 LEU 35 -4.688 -4.400 0.925 324 HD23 LEU 35 HD23 LEU 35 -4.887 -6.149 0.648 325 H SER 36 H SER 36 -10.385 -5.345 -0.152 326 HA SER 36 HA SER 36 -11.399 -8.102 -0.778 327 HB2 SER 36 HB2 SER 36 -13.553 -7.230 -1.401 328 HB3 SER 36 HB3 SER 36 -13.197 -6.876 0.295 329 HG SER 36 HG SER 36 -14.072 -5.054 -0.730 330 H GLU 37 H GLU 37 -11.596 -5.004 -2.403 331 HA GLU 37 HA GLU 37 -10.132 -6.053 -4.776 332 HB2 GLU 37 HB2 GLU 37 -12.859 -6.552 -4.371 333 HB3 GLU 37 HB3 GLU 37 -12.902 -5.054 -5.307 334 HG2 GLU 37 HG2 GLU 37 -11.351 -6.151 -6.977 335 HG3 GLU 37 HG3 GLU 37 -11.413 -7.622 -5.996 336 H GLU 38 H GLU 38 -11.863 -3.384 -3.226 337 HA GLU 38 HA GLU 38 -10.864 -1.385 -5.117 338 HB2 GLU 38 HB2 GLU 38 -12.356 -1.216 -2.475 339 HB3 GLU 38 HB3 GLU 38 -11.810 0.202 -3.384 340 HG2 GLU 38 HG2 GLU 38 -13.105 -0.530 -5.354 341 HG3 GLU 38 HG3 GLU 38 -13.686 -1.943 -4.469 342 H GLN 39 H GLN 39 -9.557 -3.095 -2.424 343 HA GLN 39 HA GLN 39 -7.720 -0.953 -1.634 344 HB2 GLN 39 HB2 GLN 39 -8.073 -3.842 -0.750 345 HB3 GLN 39 HB3 GLN 39 -6.799 -2.796 -0.140 346 HG2 GLN 39 HG2 GLN 39 -8.611 -2.696 1.444 347 HG3 GLN 39 HG3 GLN 39 -8.513 -1.147 0.641 348 HE21 GLN 39 HE21 GLN 39 -11.909 -1.340 -0.244 349 HE22 GLN 39 HE22 GLN 39 -10.555 -0.356 0.333 350 H LYS 40 H LYS 40 -7.364 -4.082 -3.321 351 HA LYS 40 HA LYS 40 -4.535 -3.900 -3.719 352 HB2 LYS 40 HB2 LYS 40 -6.742 -5.349 -5.231 353 HB3 LYS 40 HB3 LYS 40 -5.031 -5.587 -5.607 354 HG2 LYS 40 HG2 LYS 40 -4.545 -6.678 -3.640 355 HG3 LYS 40 HG3 LYS 40 -5.770 -5.836 -2.716 356 HD2 LYS 40 HD2 LYS 40 -7.267 -7.364 -4.587 357 HD3 LYS 40 HD3 LYS 40 -5.937 -8.423 -4.065 358 HE2 LYS 40 HE2 LYS 40 -6.495 -7.775 -1.672 359 HE3 LYS 40 HE3 LYS 40 -7.877 -6.862 -2.303 360 HZ1 LYS 40 HZ1 LYS 40 -7.521 -9.786 -2.793 361 HZ2 LYS 40 HZ2 LYS 40 -8.376 -9.210 -1.526 362 HZ3 LYS 40 HZ3 LYS 40 -8.880 -8.886 -3.037 363 H LYS 41 H LYS 41 -7.192 -2.662 -5.645 364 HA LYS 41 HA LYS 41 -5.507 -1.585 -7.737 365 HB2 LYS 41 HB2 LYS 41 -7.338 -0.236 -8.487 366 HB3 LYS 41 HB3 LYS 41 -7.912 -1.859 -8.097 367 HG2 LYS 41 HG2 LYS 41 -8.977 -1.146 -6.131 368 HG3 LYS 41 HG3 LYS 41 -8.094 0.381 -6.058 369 HD2 LYS 41 HD2 LYS 41 -10.386 0.802 -6.679 370 HD3 LYS 41 HD3 LYS 41 -9.294 1.240 -7.999 371 HE2 LYS 41 HE2 LYS 41 -9.826 -0.910 -9.144 372 HE3 LYS 41 HE3 LYS 41 -10.919 -1.343 -7.822 373 HZ1 LYS 41 HZ1 LYS 41 -11.241 1.022 -9.600 374 HZ2 LYS 41 HZ2 LYS 41 -12.124 -0.345 -9.687 375 HZ3 LYS 41 HZ3 LYS 41 -12.258 0.626 -8.384 376 H ILE 42 H ILE 42 -5.408 -0.632 -4.582 377 HA ILE 42 HA ILE 42 -4.200 2.009 -5.287 378 HB ILE 42 HB ILE 42 -5.309 0.899 -2.721 379 HG12 ILE 42 HG12 ILE 42 -6.370 3.398 -4.044 380 HG13 ILE 42 HG13 ILE 42 -6.837 1.852 -4.712 381 HG21 ILE 42 HG21 ILE 42 -3.977 3.594 -3.127 382 HG22 ILE 42 HG22 ILE 42 -5.034 3.219 -1.750 383 HG23 ILE 42 HG23 ILE 42 -3.540 2.324 -1.972 384 HD11 ILE 42 HD11 ILE 42 -7.335 2.758 -1.872 385 HD12 ILE 42 HD12 ILE 42 -8.521 2.369 -3.151 386 HD13 ILE 42 HD13 ILE 42 -7.529 1.089 -2.440 387 H VAL 43 H VAL 43 -3.370 -1.205 -4.292 388 HA VAL 43 HA VAL 43 -0.637 -0.278 -3.472 389 HB VAL 43 HB VAL 43 -2.112 -2.599 -2.187 390 HG11 VAL 43 HG11 VAL 43 0.531 -1.137 -1.624 391 HG12 VAL 43 HG12 VAL 43 -0.178 -2.337 -0.542 392 HG13 VAL 43 HG13 VAL 43 0.352 -2.826 -2.146 393 HG21 VAL 43 HG21 VAL 43 -3.233 -0.578 -1.471 394 HG22 VAL 43 HG22 VAL 43 -2.144 -1.062 -0.171 395 HG23 VAL 43 HG23 VAL 43 -1.685 0.267 -1.258 396 H ALA 44 H ALA 44 -2.357 -3.259 -4.672 397 HA ALA 44 HA ALA 44 0.087 -4.447 -5.669 398 HB1 ALA 44 HB1 ALA 44 -2.808 -4.872 -6.539 399 HB2 ALA 44 HB2 ALA 44 -1.431 -5.941 -6.872 400 HB3 ALA 44 HB3 ALA 44 -1.997 -5.729 -5.203 401 H ASP 45 H ASP 45 -2.404 -2.309 -7.063 402 HA ASP 45 HA ASP 45 -1.228 -1.983 -9.666 403 HB2 ASP 45 HB2 ASP 45 -3.549 -1.370 -8.994 404 HB3 ASP 45 HB3 ASP 45 -2.896 -0.046 -8.024 405 H TYR 46 H TYR 46 -0.393 -0.529 -6.546 406 HA TYR 46 HA TYR 46 1.285 1.571 -7.654 407 HB2 TYR 46 HB2 TYR 46 0.033 1.371 -5.362 408 HB3 TYR 46 HB3 TYR 46 1.466 0.514 -4.821 409 HD1 TYR 46 HD1 TYR 46 3.098 2.646 -6.861 410 HD2 TYR 46 HD2 TYR 46 0.552 2.817 -3.408 411 HE1 TYR 46 HE1 TYR 46 4.048 4.815 -6.331 412 HE2 TYR 46 HE2 TYR 46 1.515 5.064 -2.821 413 HH TYR 46 HH TYR 46 4.016 6.631 -4.857 414 H ILE 47 H ILE 47 1.813 -1.691 -6.304 415 HA ILE 47 HA ILE 47 4.661 -1.812 -6.657 416 HB ILE 47 HB ILE 47 2.396 -3.718 -6.228 417 HG12 ILE 47 HG12 ILE 47 3.690 -4.463 -4.359 418 HG13 ILE 47 HG13 ILE 47 5.154 -3.696 -4.963 419 HG21 ILE 47 HG21 ILE 47 5.102 -4.686 -7.185 420 HG22 ILE 47 HG22 ILE 47 3.851 -5.695 -6.427 421 HG23 ILE 47 HG23 ILE 47 3.530 -4.940 -7.994 422 HD11 ILE 47 HD11 ILE 47 2.715 -2.237 -3.865 423 HD12 ILE 47 HD12 ILE 47 4.292 -2.454 -3.081 424 HD13 ILE 47 HD13 ILE 47 4.156 -1.458 -4.541 425 H SER 48 H SER 48 2.001 -2.342 -8.980 426 HA SER 48 HA SER 48 3.756 -2.905 -11.207 427 HB2 SER 48 HB2 SER 48 0.922 -1.816 -11.173 428 HB3 SER 48 HB3 SER 48 1.782 -2.407 -12.599 429 HG SER 48 HG SER 48 0.458 -4.037 -11.685 430 H GLU 49 H GLU 49 3.358 0.129 -9.542 431 HA GLU 49 HA GLU 49 3.805 1.680 -12.043 432 HB2 GLU 49 HB2 GLU 49 1.809 2.106 -10.557 433 HB3 GLU 49 HB3 GLU 49 2.928 2.610 -9.293 434 HG2 GLU 49 HG2 GLU 49 2.109 4.566 -10.339 435 HG3 GLU 49 HG3 GLU 49 3.784 4.399 -10.843 436 H VAL 50 H VAL 50 5.139 1.298 -8.712 437 HA VAL 50 HA VAL 50 7.600 2.755 -9.624 438 HB VAL 50 HB VAL 50 7.755 3.890 -7.543 439 HG11 VAL 50 HG11 VAL 50 4.887 4.172 -8.452 440 HG12 VAL 50 HG12 VAL 50 5.913 5.374 -7.635 441 HG13 VAL 50 HG13 VAL 50 6.294 4.867 -9.285 442 HG21 VAL 50 HG21 VAL 50 6.963 2.214 -5.974 443 HG22 VAL 50 HG22 VAL 50 6.071 3.723 -5.779 444 HG23 VAL 50 HG23 VAL 50 5.320 2.344 -6.617 445 H GLY 51 H GLY 51 6.514 -0.162 -8.149 446 HA2 GLY 51 HA2 GLY 51 8.356 -1.852 -8.618 447 HA3 GLY 51 HA3 GLY 51 9.350 -0.910 -7.503 448 H LEU 52 H LEU 52 8.654 -0.661 -5.376 449 HA LEU 52 HA LEU 52 6.740 -2.343 -4.031 450 HB2 LEU 52 HB2 LEU 52 8.334 -4.095 -4.755 451 HB3 LEU 52 HB3 LEU 52 9.685 -3.246 -4.032 452 HG LEU 52 HG LEU 52 7.387 -3.883 -2.246 453 HD11 LEU 52 HD11 LEU 52 9.315 -6.005 -3.307 454 HD12 LEU 52 HD12 LEU 52 8.224 -6.242 -1.930 455 HD13 LEU 52 HD13 LEU 52 7.553 -5.965 -3.545 456 HD21 LEU 52 HD21 LEU 52 9.372 -2.865 -1.234 457 HD22 LEU 52 HD22 LEU 52 9.146 -4.498 -0.629 458 HD23 LEU 52 HD23 LEU 52 10.389 -4.187 -1.860 459 H ASN 53 H ASN 53 9.865 -0.899 -3.811 460 HA ASN 53 HA ASN 53 9.458 0.056 -1.055 461 HB2 ASN 53 HB2 ASN 53 11.821 -0.038 -0.850 462 HB3 ASN 53 HB3 ASN 53 11.326 -1.490 -1.716 463 HD21 ASN 53 HD21 ASN 53 13.288 -0.726 -4.551 464 HD22 ASN 53 HD22 ASN 53 12.207 -1.872 -3.783 465 H ASN 54 H ASN 54 9.353 1.497 -4.112 466 HA ASN 54 HA ASN 54 10.496 4.072 -3.248 467 HB2 ASN 54 HB2 ASN 54 9.259 3.243 -5.894 468 HB3 ASN 54 HB3 ASN 54 10.102 4.757 -5.581 469 HD21 ASN 54 HD21 ASN 54 12.249 1.490 -6.499 470 HD22 ASN 54 HD22 ASN 54 10.510 1.632 -6.756 471 H LEU 55 H LEU 55 7.343 2.649 -3.406 472 HA LEU 55 HA LEU 55 5.781 5.091 -3.156 473 HB2 LEU 55 HB2 LEU 55 3.994 3.577 -2.507 474 HB3 LEU 55 HB3 LEU 55 4.811 3.014 -3.950 475 HG LEU 55 HG LEU 55 6.183 1.626 -1.966 476 HD11 LEU 55 HD11 LEU 55 3.239 1.714 -1.178 477 HD12 LEU 55 HD12 LEU 55 4.488 0.635 -0.520 478 HD13 LEU 55 HD13 LEU 55 4.580 2.380 -0.222 479 HD21 LEU 55 HD21 LEU 55 5.322 0.693 -4.084 480 HD22 LEU 55 HD22 LEU 55 4.887 -0.294 -2.685 481 HD23 LEU 55 HD23 LEU 55 3.666 0.756 -3.438 482 H ASN 56 H ASN 56 4.552 5.624 -1.134 483 HA ASN 56 HA ASN 56 6.086 5.002 1.341 484 HB2 ASN 56 HB2 ASN 56 5.891 7.253 2.096 485 HB3 ASN 56 HB3 ASN 56 6.584 7.281 0.487 486 HD21 ASN 56 HD21 ASN 56 4.239 9.849 -0.131 487 HD22 ASN 56 HD22 ASN 56 5.941 9.454 0.114 488 H ALA 57 H ALA 57 4.762 5.689 3.274 489 HA ALA 57 HA ALA 57 2.339 4.045 3.309 490 HB1 ALA 57 HB1 ALA 57 3.941 5.578 5.394 491 HB2 ALA 57 HB2 ALA 57 2.598 4.469 5.754 492 HB3 ALA 57 HB3 ALA 57 4.085 3.847 5.000 493 H THR 58 H THR 58 3.130 7.468 3.236 494 HA THR 58 HA THR 58 0.797 8.577 4.403 495 HB THR 58 HB THR 58 2.507 9.797 2.200 496 HG1 THR 58 HG1 THR 58 3.765 10.572 3.906 497 HG21 THR 58 HG21 THR 58 0.889 11.034 4.471 498 HG22 THR 58 HG22 THR 58 1.973 11.923 3.372 499 HG23 THR 58 HG23 THR 58 0.530 11.131 2.731 500 H GLU 59 H GLU 59 1.560 7.992 0.921 501 HA GLU 59 HA GLU 59 -1.017 8.845 -0.028 502 HB2 GLU 59 HB2 GLU 59 0.972 6.968 -1.371 503 HB3 GLU 59 HB3 GLU 59 -0.434 7.733 -2.124 504 HG2 GLU 59 HG2 GLU 59 0.667 9.982 -1.244 505 HG3 GLU 59 HG3 GLU 59 2.130 8.996 -1.131 506 H LEU 60 H LEU 60 0.151 5.569 0.848 507 HA LEU 60 HA LEU 60 -2.309 4.185 0.387 508 HB2 LEU 60 HB2 LEU 60 0.144 3.730 2.063 509 HB3 LEU 60 HB3 LEU 60 -1.326 2.905 2.568 510 HG LEU 60 HG LEU 60 -1.595 1.927 0.320 511 HD11 LEU 60 HD11 LEU 60 1.180 3.081 -0.197 512 HD12 LEU 60 HD12 LEU 60 0.357 1.879 -1.212 513 HD13 LEU 60 HD13 LEU 60 -0.315 3.509 -1.061 514 HD21 LEU 60 HD21 LEU 60 -0.521 0.670 2.130 515 HD22 LEU 60 HD22 LEU 60 0.236 0.273 0.579 516 HD23 LEU 60 HD23 LEU 60 1.056 1.372 1.708 517 H SER 61 H SER 61 -1.215 5.811 3.449 518 HA SER 61 HA SER 61 -3.543 5.227 4.901 519 HB2 SER 61 HB2 SER 61 -2.842 6.795 6.492 520 HB3 SER 61 HB3 SER 61 -1.380 6.092 5.792 521 HG SER 61 HG SER 61 -1.441 8.061 4.365 522 H LYS 62 H LYS 62 -3.115 7.548 2.455 523 HA LYS 62 HA LYS 62 -5.456 9.252 3.140 524 HB2 LYS 62 HB2 LYS 62 -3.372 9.328 0.923 525 HB3 LYS 62 HB3 LYS 62 -4.744 10.437 0.997 526 HG2 LYS 62 HG2 LYS 62 -3.993 11.439 3.027 527 HG3 LYS 62 HG3 LYS 62 -2.821 10.165 3.336 528 HD2 LYS 62 HD2 LYS 62 -1.660 12.136 2.576 529 HD3 LYS 62 HD3 LYS 62 -1.492 10.863 1.354 530 HE2 LYS 62 HE2 LYS 62 -3.288 11.919 0.002 531 HE3 LYS 62 HE3 LYS 62 -3.551 13.130 1.263 532 HZ1 LYS 62 HZ1 LYS 62 -1.041 12.829 -0.305 533 HZ2 LYS 62 HZ2 LYS 62 -2.155 14.001 -0.514 534 HZ3 LYS 62 HZ3 LYS 62 -1.291 13.947 0.865 535 H ARG 63 H ARG 63 -4.468 7.095 0.466 536 HA ARG 63 HA ARG 63 -7.139 7.295 -0.761 537 HB2 ARG 63 HB2 ARG 63 -4.888 7.421 -1.954 538 HB3 ARG 63 HB3 ARG 63 -4.750 5.677 -1.713 539 HG2 ARG 63 HG2 ARG 63 -6.875 5.363 -2.991 540 HG3 ARG 63 HG3 ARG 63 -7.023 7.118 -3.168 541 HD2 ARG 63 HD2 ARG 63 -4.913 7.192 -4.443 542 HD3 ARG 63 HD3 ARG 63 -4.708 5.453 -4.229 543 HE ARG 63 HE ARG 63 -7.084 6.617 -5.648 544 HH11 ARG 63 HH11 ARG 63 -7.756 5.642 -7.514 545 HH12 ARG 63 HH12 ARG 63 -6.800 4.376 -8.227 546 HH21 ARG 63 HH21 ARG 63 -4.334 4.453 -5.864 547 HH22 ARG 63 HH22 ARG 63 -4.977 3.641 -7.269 548 H LEU 64 H LEU 64 -5.393 4.893 1.132 549 HA LEU 64 HA LEU 64 -7.453 2.822 0.655 550 HB2 LEU 64 HB2 LEU 64 -4.846 2.546 0.702 551 HB3 LEU 64 HB3 LEU 64 -5.037 2.606 2.449 552 HG LEU 64 HG LEU 64 -6.552 0.578 2.276 553 HD11 LEU 64 HD11 LEU 64 -5.498 0.725 -0.578 554 HD12 LEU 64 HD12 LEU 64 -6.216 -0.707 0.138 555 HD13 LEU 64 HD13 LEU 64 -7.209 0.751 -0.075 556 HD21 LEU 64 HD21 LEU 64 -4.159 0.362 2.855 557 HD22 LEU 64 HD22 LEU 64 -4.675 -0.988 1.848 558 HD23 LEU 64 HD23 LEU 64 -3.724 0.340 1.141 559 H ASN 65 H ASN 65 -6.752 5.288 2.946 560 HA ASN 65 HA ASN 65 -7.740 6.009 4.829 561 HB2 ASN 65 HB2 ASN 65 -9.717 5.789 3.299 562 HB3 ASN 65 HB3 ASN 65 -10.113 4.268 4.097 563 HD21 ASN 65 HD21 ASN 65 -11.150 5.909 7.154 564 HD22 ASN 65 HD22 ASN 65 -10.335 4.450 6.575 565 H ILE 66 H ILE 66 -5.948 4.840 5.754 566 HA ILE 66 HA ILE 66 -6.749 3.096 8.002 567 HB ILE 66 HB ILE 66 -4.496 1.820 7.552 568 HG12 ILE 66 HG12 ILE 66 -5.167 2.380 4.658 569 HG13 ILE 66 HG13 ILE 66 -4.000 3.355 5.558 570 HG21 ILE 66 HG21 ILE 66 -6.963 1.141 5.941 571 HG22 ILE 66 HG22 ILE 66 -5.648 0.035 6.414 572 HG23 ILE 66 HG23 ILE 66 -6.667 0.763 7.658 573 HD11 ILE 66 HD11 ILE 66 -3.733 0.386 5.075 574 HD12 ILE 66 HD12 ILE 66 -2.829 1.722 4.299 575 HD13 ILE 66 HD13 ILE 66 -2.641 1.402 6.039 576 H THR 67 H THR 67 -4.983 2.884 9.590 577 HA THR 67 HA THR 67 -3.576 5.194 10.415 578 HB THR 67 HB THR 67 -2.806 2.284 10.808 579 HG1 THR 67 HG1 THR 67 -4.736 3.742 12.270 580 HG21 THR 67 HG21 THR 67 -2.524 4.685 12.635 581 HG22 THR 67 HG22 THR 67 -2.150 2.994 13.068 582 HG23 THR 67 HG23 THR 67 -1.217 3.803 11.805 583 H VAL 68 H VAL 68 -1.522 5.963 9.884 584 HA VAL 68 HA VAL 68 -0.148 5.186 7.523 585 HB VAL 68 HB VAL 68 1.124 6.487 9.961 586 HG11 VAL 68 HG11 VAL 68 1.738 6.704 6.974 587 HG12 VAL 68 HG12 VAL 68 2.562 7.601 8.267 588 HG13 VAL 68 HG13 VAL 68 2.726 5.847 8.176 589 HG21 VAL 68 HG21 VAL 68 -0.904 7.784 9.405 590 HG22 VAL 68 HG22 VAL 68 0.537 8.671 8.914 591 HG23 VAL 68 HG23 VAL 68 -0.429 7.818 7.693 592 H ASP 69 H ASP 69 0.317 4.117 10.871 593 HA ASP 69 HA ASP 69 2.640 2.509 10.286 594 HB2 ASP 69 HB2 ASP 69 0.740 2.574 12.652 595 HB3 ASP 69 HB3 ASP 69 2.189 1.569 12.590 596 H LYS 70 H LYS 70 -0.800 1.798 10.109 597 HA LYS 70 HA LYS 70 -0.424 -1.084 9.729 598 HB2 LYS 70 HB2 LYS 70 -2.721 0.782 9.003 599 HB3 LYS 70 HB3 LYS 70 -2.704 -0.941 8.629 600 HG2 LYS 70 HG2 LYS 70 -2.530 -1.528 11.001 601 HG3 LYS 70 HG3 LYS 70 -2.470 0.184 11.448 602 HD2 LYS 70 HD2 LYS 70 -4.747 0.484 10.366 603 HD3 LYS 70 HD3 LYS 70 -4.770 -1.249 10.036 604 HE2 LYS 70 HE2 LYS 70 -6.098 -0.834 11.986 605 HE3 LYS 70 HE3 LYS 70 -4.653 -1.722 12.478 606 HZ1 LYS 70 HZ1 LYS 70 -4.885 1.241 12.689 607 HZ2 LYS 70 HZ2 LYS 70 -5.249 0.226 13.928 608 HZ3 LYS 70 HZ3 LYS 70 -3.725 0.304 13.352 609 H ALA 71 H ALA 71 -0.384 1.777 7.630 610 HA ALA 71 HA ALA 71 -0.145 0.248 5.157 611 HB1 ALA 71 HB1 ALA 71 0.743 3.109 5.760 612 HB2 ALA 71 HB2 ALA 71 0.531 2.378 4.167 613 HB3 ALA 71 HB3 ALA 71 -0.870 2.656 5.224 614 H LYS 72 H LYS 72 2.233 1.786 7.340 615 HA LYS 72 HA LYS 72 4.617 1.080 5.933 616 HB2 LYS 72 HB2 LYS 72 4.086 1.497 8.903 617 HB3 LYS 72 HB3 LYS 72 5.706 1.247 8.240 618 HG2 LYS 72 HG2 LYS 72 5.619 3.277 6.969 619 HG3 LYS 72 HG3 LYS 72 3.902 3.472 7.309 620 HD2 LYS 72 HD2 LYS 72 5.178 5.045 8.642 621 HD3 LYS 72 HD3 LYS 72 4.288 3.911 9.639 622 HE2 LYS 72 HE2 LYS 72 6.388 4.191 10.672 623 HE3 LYS 72 HE3 LYS 72 6.396 2.578 9.964 624 HZ1 LYS 72 HZ1 LYS 72 7.670 4.991 8.763 625 HZ2 LYS 72 HZ2 LYS 72 8.469 3.783 9.505 626 HZ3 LYS 72 HZ3 LYS 72 7.702 3.499 8.094 627 H THR 73 H THR 73 2.826 -0.895 8.337 628 HA THR 73 HA THR 73 4.805 -3.065 7.970 629 HB THR 73 HB THR 73 3.837 -2.444 10.197 630 HG1 THR 73 HG1 THR 73 3.928 -4.573 10.820 631 HG21 THR 73 HG21 THR 73 1.498 -4.194 9.324 632 HG22 THR 73 HG22 THR 73 1.767 -3.438 10.910 633 HG23 THR 73 HG23 THR 73 1.408 -2.428 9.501 634 H TYR 74 H TYR 74 1.457 -2.433 6.854 635 HA TYR 74 HA TYR 74 0.977 -5.056 5.851 636 HB2 TYR 74 HB2 TYR 74 -0.849 -3.534 6.069 637 HB3 TYR 74 HB3 TYR 74 -0.055 -2.335 5.037 638 HD1 TYR 74 HD1 TYR 74 -0.728 -2.143 2.846 639 HD2 TYR 74 HD2 TYR 74 -1.137 -5.954 4.838 640 HE1 TYR 74 HE1 TYR 74 -1.678 -3.118 0.793 641 HE2 TYR 74 HE2 TYR 74 -1.992 -6.960 2.721 642 HH TYR 74 HH TYR 74 -2.275 -5.059 -0.303 643 H ILE 75 H ILE 75 2.628 -2.261 4.329 644 HA ILE 75 HA ILE 75 3.063 -3.241 1.742 645 HB ILE 75 HB ILE 75 4.764 -1.557 3.604 646 HG12 ILE 75 HG12 ILE 75 3.343 -0.767 1.021 647 HG13 ILE 75 HG13 ILE 75 2.522 -0.744 2.564 648 HG21 ILE 75 HG21 ILE 75 5.359 -2.164 0.675 649 HG22 ILE 75 HG22 ILE 75 6.167 -0.921 1.657 650 HG23 ILE 75 HG23 ILE 75 6.375 -2.606 2.075 651 HD11 ILE 75 HD11 ILE 75 4.982 0.923 1.857 652 HD12 ILE 75 HD12 ILE 75 3.329 1.496 2.070 653 HD13 ILE 75 HD13 ILE 75 4.223 0.860 3.462 654 H LYS 76 H LYS 76 5.307 -3.816 4.531 655 HA LYS 76 HA LYS 76 6.764 -5.827 3.065 656 HB2 LYS 76 HB2 LYS 76 8.048 -6.185 5.047 657 HB3 LYS 76 HB3 LYS 76 7.811 -4.458 4.796 658 HG2 LYS 76 HG2 LYS 76 6.013 -4.478 6.539 659 HG3 LYS 76 HG3 LYS 76 6.296 -6.208 6.790 660 HD2 LYS 76 HD2 LYS 76 7.434 -5.118 8.538 661 HD3 LYS 76 HD3 LYS 76 8.700 -5.606 7.398 662 HE2 LYS 76 HE2 LYS 76 8.648 -3.273 6.434 663 HE3 LYS 76 HE3 LYS 76 7.425 -2.834 7.634 664 HZ1 LYS 76 HZ1 LYS 76 10.192 -3.737 8.260 665 HZ2 LYS 76 HZ2 LYS 76 9.656 -2.201 8.365 666 HZ3 LYS 76 HZ3 LYS 76 9.067 -3.338 9.377 667 H ASN 77 H ASN 77 4.051 -6.148 5.333 668 HA ASN 77 HA ASN 77 4.284 -9.021 5.550 669 HB2 ASN 77 HB2 ASN 77 2.093 -7.023 6.158 670 HB3 ASN 77 HB3 ASN 77 1.732 -8.741 6.149 671 HD21 ASN 77 HD21 ASN 77 3.976 -7.251 9.206 672 HD22 ASN 77 HD22 ASN 77 3.682 -6.259 7.792 673 H SER 78 H SER 78 2.673 -6.998 3.139 674 HA SER 78 HA SER 78 1.374 -9.206 1.768 675 HB2 SER 78 HB2 SER 78 0.703 -6.764 1.734 676 HB3 SER 78 HB3 SER 78 2.095 -6.475 0.668 677 HG SER 78 HG SER 78 -0.028 -6.926 -0.359 678 H ASN 79 H ASN 79 4.404 -7.420 1.295 679 HA ASN 79 HA ASN 79 5.509 -9.611 -0.351 680 HB2 ASN 79 HB2 ASN 79 6.276 -7.860 -2.071 681 HB3 ASN 79 HB3 ASN 79 4.615 -8.428 -2.123 682 HD21 ASN 79 HD21 ASN 79 5.194 -4.562 -0.871 683 HD22 ASN 79 HD22 ASN 79 6.427 -5.767 -0.508 684 H ARG 80 H ARG 80 6.734 -9.993 1.477 685 HA ARG 80 HA ARG 80 8.569 -8.285 2.773 686 HB2 ARG 80 HB2 ARG 80 8.818 -11.263 2.143 687 HB3 ARG 80 HB3 ARG 80 9.843 -10.416 3.293 688 HG2 ARG 80 HG2 ARG 80 6.818 -10.604 3.569 689 HG3 ARG 80 HG3 ARG 80 7.959 -11.757 4.259 690 HD2 ARG 80 HD2 ARG 80 9.022 -10.055 5.614 691 HD3 ARG 80 HD3 ARG 80 7.941 -8.811 4.962 692 HE ARG 80 HE ARG 80 6.293 -10.865 5.966 693 HH11 ARG 80 HH11 ARG 80 5.289 -10.797 7.954 694 HH12 ARG 80 HH12 ARG 80 5.973 -9.852 9.233 695 HH21 ARG 80 HH21 ARG 80 8.582 -8.622 7.378 696 HH22 ARG 80 HH22 ARG 80 7.774 -8.634 8.923 697 H MET 81 H MET 81 9.099 -10.209 -0.114 698 HA MET 81 HA MET 81 11.587 -8.649 -0.766 699 HB2 MET 81 HB2 MET 81 11.011 -11.612 -1.158 700 HB3 MET 81 HB3 MET 81 12.330 -10.753 -1.965 701 HG2 MET 81 HG2 MET 81 13.273 -10.104 0.215 702 HG3 MET 81 HG3 MET 81 11.989 -10.992 1.046 703 HE1 MET 81 HE1 MET 81 14.032 -12.150 2.410 704 HE2 MET 81 HE2 MET 81 15.327 -13.077 1.620 705 HE3 MET 81 HE3 MET 81 15.236 -11.317 1.397 706 H GLY 82 H GLY 82 8.700 -10.309 -2.110 707 HA2 GLY 82 HA2 GLY 82 7.625 -8.701 -3.858 708 HA3 GLY 82 HA3 GLY 82 9.146 -8.881 -4.724 709 H ARG 83 H ARG 83 6.452 -10.728 -3.363 710 HA ARG 83 HA ARG 83 5.415 -12.688 -3.867 711 HB2 ARG 83 HB2 ARG 83 6.319 -12.266 -6.705 712 HB3 ARG 83 HB3 ARG 83 4.916 -13.169 -6.138 713 HG2 ARG 83 HG2 ARG 83 5.237 -10.135 -5.998 714 HG3 ARG 83 HG3 ARG 83 4.278 -11.035 -7.171 715 HD2 ARG 83 HD2 ARG 83 2.875 -11.939 -5.329 716 HD3 ARG 83 HD3 ARG 83 3.782 -10.947 -4.166 717 HE ARG 83 HE ARG 83 2.929 -9.151 -6.109 718 HH11 ARG 83 HH11 ARG 83 1.059 -7.959 -6.077 719 HH12 ARG 83 HH12 ARG 83 -0.289 -8.479 -5.110 720 HH21 ARG 83 HH21 ARG 83 1.239 -11.309 -3.928 721 HH22 ARG 83 HH22 ARG 83 -0.203 -10.332 -3.934 722 H THR 84 H THR 84 8.543 -12.846 -3.518 723 HA THR 84 HA THR 84 9.167 -15.358 -4.774 724 HB THR 84 HB THR 84 10.458 -13.812 -2.529 725 HG1 THR 84 HG1 THR 84 11.853 -13.118 -4.190 726 HG21 THR 84 HG21 THR 84 11.661 -16.038 -4.248 727 HG22 THR 84 HG22 THR 84 12.605 -14.962 -3.191 728 HG23 THR 84 HG23 THR 84 11.437 -16.078 -2.484 729 H ASN 85 H ASN 85 7.288 -14.606 -2.241 730 HA ASN 85 HA ASN 85 5.930 -15.793 -0.917 731 HB2 ASN 85 HB2 ASN 85 5.669 -16.748 -3.330 732 HB3 ASN 85 HB3 ASN 85 6.323 -18.229 -2.641 733 HD21 ASN 85 HD21 ASN 85 3.355 -18.696 -0.546 734 HD22 ASN 85 HD22 ASN 85 5.116 -18.800 -0.414 735 H ASN 86 H ASN 86 8.755 -15.865 -0.184 736 HA ASN 86 HA ASN 86 9.276 -18.469 1.027 737 HB2 ASN 86 HB2 ASN 86 11.474 -17.760 1.244 738 HB3 ASN 86 HB3 ASN 86 10.931 -16.961 -0.235 739 HD21 ASN 86 HD21 ASN 86 11.230 -13.701 1.154 740 HD22 ASN 86 HD22 ASN 86 10.513 -14.644 -0.141 741 H PHE 87 H PHE 87 7.617 -15.770 2.068 742 HA PHE 87 HA PHE 87 8.345 -15.632 4.852 743 HB2 PHE 87 HB2 PHE 87 6.639 -13.906 4.902 744 HB3 PHE 87 HB3 PHE 87 7.647 -13.757 3.461 745 HD1 PHE 87 HD1 PHE 87 6.740 -13.795 1.263 746 HD2 PHE 87 HD2 PHE 87 4.267 -14.808 4.647 747 HE1 PHE 87 HE1 PHE 87 4.731 -13.822 -0.204 748 HE2 PHE 87 HE2 PHE 87 2.279 -14.885 3.173 749 HZ PHE 87 HZ PHE 87 2.504 -14.388 0.744 750 H LYS 88 H LYS 88 7.244 -18.234 3.780 751 HA LYS 88 HA LYS 88 4.592 -18.650 4.959 752 HB2 LYS 88 HB2 LYS 88 4.804 -20.853 3.812 753 HB3 LYS 88 HB3 LYS 88 5.046 -19.462 2.750 754 HG2 LYS 88 HG2 LYS 88 7.572 -19.817 3.047 755 HG3 LYS 88 HG3 LYS 88 7.189 -21.342 3.844 756 HD2 LYS 88 HD2 LYS 88 6.330 -22.283 1.836 757 HD3 LYS 88 HD3 LYS 88 6.083 -20.693 1.088 758 HE2 LYS 88 HE2 LYS 88 8.544 -20.310 1.059 759 HE3 LYS 88 HE3 LYS 88 8.796 -21.931 1.726 760 HZ1 LYS 88 HZ1 LYS 88 7.521 -21.312 -0.890 761 HZ2 LYS 88 HZ2 LYS 88 9.016 -21.934 -0.689 762 HZ3 LYS 88 HZ3 LYS 88 7.707 -22.823 -0.288 763 H THR 89 H THR 89 7.632 -18.786 6.148 764 HA THR 89 HA THR 89 7.029 -20.697 8.356 765 HB THR 89 HB THR 89 9.431 -20.722 6.477 766 HG1 THR 89 HG1 THR 89 8.745 -22.850 6.141 767 HG21 THR 89 HG21 THR 89 8.962 -22.249 9.056 768 HG22 THR 89 HG22 THR 89 10.220 -22.639 7.847 769 HG23 THR 89 HG23 THR 89 10.272 -21.091 8.697 770 H ILE 90 H ILE 90 9.518 -18.431 7.031 771 HA ILE 90 HA ILE 90 10.456 -17.651 9.650 772 HB ILE 90 HB ILE 90 11.816 -16.067 8.482 773 HG12 ILE 90 HG12 ILE 90 10.551 -16.919 5.852 774 HG13 ILE 90 HG13 ILE 90 10.143 -15.423 6.698 775 HG21 ILE 90 HG21 ILE 90 11.867 -18.742 7.031 776 HG22 ILE 90 HG22 ILE 90 13.229 -17.641 7.316 777 HG23 ILE 90 HG23 ILE 90 12.471 -18.462 8.679 778 HD11 ILE 90 HD11 ILE 90 12.853 -16.167 5.556 779 HD12 ILE 90 HD12 ILE 90 11.766 -14.855 5.056 780 HD13 ILE 90 HD13 ILE 90 12.574 -14.773 6.629 781 H LYS 91 H LYS 91 10.522 -15.403 10.372 782 HA LYS 91 HA LYS 91 9.541 -13.496 11.165 783 HB2 LYS 91 HB2 LYS 91 7.843 -13.461 8.647 784 HB3 LYS 91 HB3 LYS 91 8.096 -12.119 9.724 785 HG2 LYS 91 HG2 LYS 91 10.365 -13.370 8.109 786 HG3 LYS 91 HG3 LYS 91 9.301 -12.115 7.512 787 HD2 LYS 91 HD2 LYS 91 11.123 -10.879 8.240 788 HD3 LYS 91 HD3 LYS 91 9.963 -10.703 9.542 789 HE2 LYS 91 HE2 LYS 91 12.004 -11.034 10.633 790 HE3 LYS 91 HE3 LYS 91 11.217 -12.604 10.751 791 HZ1 LYS 91 HZ1 LYS 91 13.313 -11.861 8.775 792 HZ2 LYS 91 HZ2 LYS 91 13.533 -12.822 10.071 793 HZ3 LYS 91 HZ3 LYS 91 12.590 -13.328 8.841 794 H MET 92 H MET 92 7.680 -16.267 10.924 795 HA MET 92 HA MET 92 5.284 -15.051 12.182 796 HB2 MET 92 HB2 MET 92 5.784 -17.914 11.309 797 HB3 MET 92 HB3 MET 92 4.264 -17.239 11.917 798 HG2 MET 92 HG2 MET 92 4.433 -15.547 9.976 799 HG3 MET 92 HG3 MET 92 5.670 -16.615 9.310 800 HE1 MET 92 HE1 MET 92 4.236 -19.536 10.373 801 HE2 MET 92 HE2 MET 92 3.588 -19.955 8.775 802 HE3 MET 92 HE3 MET 92 5.210 -19.239 8.915 803 H PHE 93 H PHE 93 7.620 -17.663 13.015 804 HA PHE 93 HA PHE 93 6.605 -17.618 15.820 805 HB2 PHE 93 HB2 PHE 93 7.309 -19.855 16.000 806 HB3 PHE 93 HB3 PHE 93 6.452 -19.717 14.479 807 HD1 PHE 93 HD1 PHE 93 7.642 -19.983 12.323 808 HD2 PHE 93 HD2 PHE 93 9.731 -20.292 16.085 809 HE1 PHE 93 HE1 PHE 93 9.583 -21.004 11.168 810 HE2 PHE 93 HE2 PHE 93 11.670 -21.316 14.923 811 HZ PHE 93 HZ PHE 93 11.601 -21.673 12.460 812 H GLU 94 H GLU 94 9.192 -16.354 14.133 813 HA GLU 94 HA GLU 94 11.300 -16.909 16.119 814 HB2 GLU 94 HB2 GLU 94 11.327 -15.285 13.555 815 HB3 GLU 94 HB3 GLU 94 12.738 -15.705 14.529 816 HG2 GLU 94 HG2 GLU 94 12.456 -18.074 14.030 817 HG3 GLU 94 HG3 GLU 94 10.942 -17.769 13.172 818 H ASP 95 H ASP 95 11.828 -15.564 17.755 819 HA ASP 95 HA ASP 95 11.494 -12.634 17.494 820 HB2 ASP 95 HB2 ASP 95 10.298 -14.303 19.742 821 HB3 ASP 95 HB3 ASP 95 10.671 -12.592 19.909 822 H ASP 96 H ASP 96 13.315 -11.674 18.053 823 HA ASP 96 HA ASP 96 14.981 -12.586 20.312 824 HB2 ASP 96 HB2 ASP 96 16.012 -12.285 17.458 825 HB3 ASP 96 HB3 ASP 96 17.052 -12.206 18.875 826 H VAL 97 H VAL 97 16.146 -10.922 21.252 827 HA VAL 97 HA VAL 97 15.813 -8.156 20.148 828 HB VAL 97 HB VAL 97 15.429 -8.948 23.062 829 HG11 VAL 97 HG11 VAL 97 15.090 -6.258 21.662 830 HG12 VAL 97 HG12 VAL 97 14.652 -6.607 23.348 831 HG13 VAL 97 HG13 VAL 97 16.343 -6.669 22.856 832 HG21 VAL 97 HG21 VAL 97 13.466 -9.657 21.772 833 HG22 VAL 97 HG22 VAL 97 13.066 -8.239 22.738 834 HG23 VAL 97 HG23 VAL 97 13.370 -8.062 20.995 835 H SER 98 H SER 98 17.627 -10.140 22.502 836 HA SER 98 HA SER 98 19.996 -8.360 22.144 837 HB2 SER 98 HB2 SER 98 20.585 -9.050 24.446 838 HB3 SER 98 HB3 SER 98 19.022 -8.226 24.348 839 HG SER 98 HG SER 98 18.934 -10.130 25.649 840 H SER 99 H SER 99 19.073 -11.145 20.855 841 HA SER 99 HA SER 99 21.695 -12.475 21.116 842 HB2 SER 99 HB2 SER 99 19.798 -13.308 22.698 843 HB3 SER 99 HB3 SER 99 19.166 -14.110 21.252 844 HG SER 99 HG SER 99 20.614 -15.437 22.476 845 H ALA 100 H ALA 100 20.491 -10.950 18.877 846 HA ALA 100 HA ALA 100 20.447 -13.049 16.748 847 HB1 ALA 100 HB1 ALA 100 19.505 -10.161 16.669 848 HB2 ALA 100 HB2 ALA 100 19.437 -11.328 15.330 849 HB3 ALA 100 HB3 ALA 100 18.475 -11.606 16.794 850 H SER 101 H SER 101 22.065 -13.209 15.308 851 HA SER 101 HA SER 101 23.880 -11.017 14.643 852 HB2 SER 101 HB2 SER 101 24.928 -11.903 16.688 853 HB3 SER 101 HB3 SER 101 24.871 -13.545 16.033 854 HG SER 101 HG SER 101 26.924 -12.338 15.832 855 H ALA 102 H ALA 102 25.524 -11.944 12.963 856 HA ALA 102 HA ALA 102 24.240 -13.650 10.984 857 HB1 ALA 102 HB1 ALA 102 27.133 -12.725 11.272 858 HB2 ALA 102 HB2 ALA 102 26.423 -13.482 9.829 859 HB3 ALA 102 HB3 ALA 102 25.863 -11.883 10.353 860 H GLN 103 H GLN 103 26.238 -14.130 13.707 861 HA GLN 103 HA GLN 103 25.800 -17.026 13.658 862 HB2 GLN 103 HB2 GLN 103 28.196 -17.534 14.008 863 HB3 GLN 103 HB3 GLN 103 27.818 -16.879 12.421 864 HG2 GLN 103 HG2 GLN 103 29.258 -15.185 12.618 865 HG3 GLN 103 HG3 GLN 103 28.623 -14.695 14.181 866 HE21 GLN 103 HE21 GLN 103 31.029 -16.600 16.080 867 HE22 GLN 103 HE22 GLN 103 29.349 -16.039 16.101 868 HA PRO 104 HA PRO 104 25.518 -15.255 17.908 869 HB2 PRO 104 HB2 PRO 104 23.006 -16.005 18.600 870 HB3 PRO 104 HB3 PRO 104 23.305 -14.695 17.429 871 HG2 PRO 104 HG2 PRO 104 22.706 -17.610 16.818 872 HG3 PRO 104 HG3 PRO 104 21.897 -16.155 16.153 873 HD2 PRO 104 HD2 PRO 104 23.942 -17.452 14.858 874 HD3 PRO 104 HD3 PRO 104 23.701 -15.686 14.735 875 H ASN 105 H ASN 105 27.179 -17.251 17.515 876 HA ASN 105 HA ASN 105 26.403 -19.601 19.213 877 HB2 ASN 105 HB2 ASN 105 28.183 -19.425 16.748 878 HB3 ASN 105 HB3 ASN 105 27.971 -20.873 17.729 879 HD21 ASN 105 HD21 ASN 105 25.625 -20.857 14.747 880 HD22 ASN 105 HD22 ASN 105 27.332 -20.450 14.864 881 H LEU 106 H LEU 106 27.152 -17.971 20.911 882 HA LEU 106 HA LEU 106 30.037 -18.438 21.496 883 HB2 LEU 106 HB2 LEU 106 29.701 -16.163 20.566 884 HB3 LEU 106 HB3 LEU 106 28.549 -15.818 21.852 885 HG LEU 106 HG LEU 106 30.410 -16.208 23.536 886 HD11 LEU 106 HD11 LEU 106 32.145 -16.255 21.024 887 HD12 LEU 106 HD12 LEU 106 32.748 -16.092 22.688 888 HD13 LEU 106 HD13 LEU 106 31.949 -17.585 22.189 889 HD21 LEU 106 HD21 LEU 106 29.786 -13.945 22.801 890 HD22 LEU 106 HD22 LEU 106 31.528 -14.059 23.096 891 HD23 LEU 106 HD23 LEU 106 30.909 -14.066 21.427 892 HA PRO 107 HA PRO 107 27.601 -19.837 25.122 893 HB2 PRO 107 HB2 PRO 107 29.303 -21.747 26.060 894 HB3 PRO 107 HB3 PRO 107 28.246 -21.992 24.637 895 HG2 PRO 107 HG2 PRO 107 31.175 -21.204 24.671 896 HG3 PRO 107 HG3 PRO 107 30.379 -22.470 23.684 897 HD2 PRO 107 HD2 PRO 107 30.900 -19.963 22.727 898 HD3 PRO 107 HD3 PRO 107 29.448 -20.878 22.224 Start of MODEL 25 1 H1 GLY -5 H1 GLY -5 1.790 -18.138 15.010 2 H2 GLY -5 H2 GLY -5 2.964 -16.999 15.054 3 H3 GLY -5 H3 GLY -5 3.094 -18.345 15.980 4 HA2 GLY -5 HA2 GLY -5 4.570 -18.519 14.094 5 HA3 GLY -5 HA3 GLY -5 3.289 -19.744 14.034 6 H SER -4 H SER -4 3.310 -19.976 11.809 7 HA SER -4 HA SER -4 2.243 -17.703 10.173 8 HB2 SER -4 HB2 SER -4 4.289 -19.783 9.317 9 HB3 SER -4 HB3 SER -4 3.530 -18.578 8.265 10 HG SER -4 HG SER -4 5.604 -17.908 9.048 11 H HIS -3 H HIS -3 0.890 -18.265 8.431 12 HA HIS -3 HA HIS -3 -0.075 -21.050 8.166 13 HB2 HIS -3 HB2 HIS -3 -1.370 -19.980 10.032 14 HB3 HIS -3 HB3 HIS -3 -1.922 -18.745 8.905 15 HD2 HIS -3 HD2 HIS -3 -4.031 -19.337 7.442 16 HE1 HIS -3 HE1 HIS -3 -4.516 -23.397 8.648 17 HE2 HIS -3 HE2 HIS -3 -5.626 -21.405 7.488 18 H MET -2 H MET -2 -0.794 -21.508 6.166 19 HA MET -2 HA MET -2 -1.377 -19.339 4.192 20 HB2 MET -2 HB2 MET -2 0.542 -21.670 3.776 21 HB3 MET -2 HB3 MET -2 -0.060 -20.603 2.499 22 HG2 MET -2 HG2 MET -2 0.958 -18.657 3.654 23 HG3 MET -2 HG3 MET -2 1.599 -19.738 4.896 24 HE1 MET -2 HE1 MET -2 4.002 -18.772 4.591 25 HE2 MET -2 HE2 MET -2 4.838 -18.650 3.026 26 HE3 MET -2 HE3 MET -2 3.399 -17.656 3.343 27 H ALA -1 H ALA -1 -3.557 -19.731 4.160 28 HA ALA -1 HA ALA -1 -4.442 -21.958 2.556 29 HB1 ALA -1 HB1 ALA -1 -5.595 -21.703 5.362 30 HB2 ALA -1 HB2 ALA -1 -6.122 -22.828 4.100 31 HB3 ALA -1 HB3 ALA -1 -4.514 -23.005 4.821 32 H SER 0 H SER 0 -5.236 -20.588 1.085 33 HA SER 0 HA SER 0 -7.335 -18.595 1.869 34 HB2 SER 0 HB2 SER 0 -5.130 -17.889 0.780 35 HB3 SER 0 HB3 SER 0 -5.738 -18.636 -0.706 36 HG SER 0 HG SER 0 -6.197 -16.373 -0.552 37 H MET 1 H MET 1 -7.089 -21.606 0.376 38 HA MET 1 HA MET 1 -9.580 -21.214 -1.249 39 HB2 MET 1 HB2 MET 1 -7.049 -22.735 -1.981 40 HB3 MET 1 HB3 MET 1 -8.548 -22.799 -2.915 41 HG2 MET 1 HG2 MET 1 -6.993 -20.254 -2.352 42 HG3 MET 1 HG3 MET 1 -6.857 -21.216 -3.823 43 HE1 MET 1 HE1 MET 1 -7.288 -18.991 -5.224 44 HE2 MET 1 HE2 MET 1 -8.710 -17.948 -5.003 45 HE3 MET 1 HE3 MET 1 -7.488 -18.065 -3.717 46 H ASP 2 H ASP 2 -8.268 -22.985 1.213 47 HA ASP 2 HA ASP 2 -10.379 -25.114 0.995 48 HB2 ASP 2 HB2 ASP 2 -7.686 -25.180 2.412 49 HB3 ASP 2 HB3 ASP 2 -8.923 -26.426 2.558 50 H GLN 3 H GLN 3 -10.044 -22.205 2.218 51 HA GLN 3 HA GLN 3 -11.255 -22.668 4.887 52 HB2 GLN 3 HB2 GLN 3 -8.744 -22.901 4.997 53 HB3 GLN 3 HB3 GLN 3 -8.607 -21.266 4.385 54 HG2 GLN 3 HG2 GLN 3 -10.315 -21.071 6.675 55 HG3 GLN 3 HG3 GLN 3 -9.094 -22.259 7.111 56 HE21 GLN 3 HE21 GLN 3 -7.784 -18.471 6.073 57 HE22 GLN 3 HE22 GLN 3 -9.298 -19.093 5.414 58 H LEU 4 H LEU 4 -12.609 -21.637 2.776 59 HA LEU 4 HA LEU 4 -13.118 -18.841 3.661 60 HB2 LEU 4 HB2 LEU 4 -12.128 -19.644 1.046 61 HB3 LEU 4 HB3 LEU 4 -13.772 -19.064 0.872 62 HG LEU 4 HG LEU 4 -13.175 -16.942 1.997 63 HD11 LEU 4 HD11 LEU 4 -10.387 -18.166 2.070 64 HD12 LEU 4 HD12 LEU 4 -10.691 -16.416 2.210 65 HD13 LEU 4 HD13 LEU 4 -11.327 -17.522 3.426 66 HD21 LEU 4 HD21 LEU 4 -13.049 -17.174 -0.461 67 HD22 LEU 4 HD22 LEU 4 -11.833 -16.039 0.148 68 HD23 LEU 4 HD23 LEU 4 -11.349 -17.683 -0.327 69 H ASP 5 H ASP 5 -14.975 -18.965 4.669 70 HA ASP 5 HA ASP 5 -17.351 -20.146 3.355 71 HB2 ASP 5 HB2 ASP 5 -16.152 -21.905 4.761 72 HB3 ASP 5 HB3 ASP 5 -16.500 -20.917 6.176 73 H GLU 6 H GLU 6 -16.270 -17.420 4.375 74 HA GLU 6 HA GLU 6 -18.251 -16.611 6.388 75 HB2 GLU 6 HB2 GLU 6 -16.993 -14.539 6.476 76 HB3 GLU 6 HB3 GLU 6 -15.927 -15.932 6.614 77 HG2 GLU 6 HG2 GLU 6 -15.284 -15.692 4.217 78 HG3 GLU 6 HG3 GLU 6 -16.359 -14.302 4.067 79 H ILE 7 H ILE 7 -18.785 -17.123 3.300 80 HA ILE 7 HA ILE 7 -19.667 -14.514 2.357 81 HB ILE 7 HB ILE 7 -19.996 -17.198 0.970 82 HG12 ILE 7 HG12 ILE 7 -17.873 -16.059 -0.318 83 HG13 ILE 7 HG13 ILE 7 -17.551 -15.473 1.307 84 HG21 ILE 7 HG21 ILE 7 -19.928 -14.327 -0.061 85 HG22 ILE 7 HG22 ILE 7 -20.019 -15.785 -1.068 86 HG23 ILE 7 HG23 ILE 7 -21.350 -15.401 0.010 87 HD11 ILE 7 HD11 ILE 7 -17.877 -18.379 0.425 88 HD12 ILE 7 HD12 ILE 7 -16.363 -17.567 0.873 89 HD13 ILE 7 HD13 ILE 7 -17.599 -17.876 2.104 90 H ILE 8 H ILE 8 -21.670 -13.692 2.305 91 HA ILE 8 HA ILE 8 -23.904 -15.183 3.536 92 HB ILE 8 HB ILE 8 -23.764 -12.272 2.649 93 HG12 ILE 8 HG12 ILE 8 -23.846 -12.040 5.308 94 HG13 ILE 8 HG13 ILE 8 -23.093 -13.628 5.283 95 HG21 ILE 8 HG21 ILE 8 -25.781 -13.755 4.394 96 HG22 ILE 8 HG22 ILE 8 -25.757 -12.003 4.101 97 HG23 ILE 8 HG23 ILE 8 -26.080 -13.099 2.768 98 HD11 ILE 8 HD11 ILE 8 -22.019 -11.106 3.917 99 HD12 ILE 8 HD12 ILE 8 -21.486 -11.734 5.487 100 HD13 ILE 8 HD13 ILE 8 -21.168 -12.663 4.021 101 H GLU 9 H GLU 9 -23.121 -13.687 0.390 102 HA GLU 9 HA GLU 9 -25.306 -15.230 -0.918 103 HB2 GLU 9 HB2 GLU 9 -26.024 -12.850 -0.382 104 HB3 GLU 9 HB3 GLU 9 -24.734 -12.288 -1.450 105 HG2 GLU 9 HG2 GLU 9 -25.808 -13.678 -3.304 106 HG3 GLU 9 HG3 GLU 9 -27.124 -14.021 -2.178 107 H GLN 10 H GLN 10 -24.682 -16.146 -2.835 108 HA GLN 10 HA GLN 10 -22.161 -15.217 -4.131 109 HB2 GLN 10 HB2 GLN 10 -21.799 -17.172 -2.530 110 HB3 GLN 10 HB3 GLN 10 -22.784 -18.142 -3.617 111 HG2 GLN 10 HG2 GLN 10 -20.571 -18.616 -4.239 112 HG3 GLN 10 HG3 GLN 10 -21.100 -17.485 -5.477 113 HE21 GLN 10 HE21 GLN 10 -18.732 -14.970 -4.499 114 HE22 GLN 10 HE22 GLN 10 -20.164 -15.284 -5.467 115 H ILE 11 H ILE 11 -24.688 -17.756 -4.705 116 HA ILE 11 HA ILE 11 -25.144 -16.653 -7.433 117 HB ILE 11 HB ILE 11 -25.143 -18.882 -8.351 118 HG12 ILE 11 HG12 ILE 11 -24.209 -19.948 -5.649 119 HG13 ILE 11 HG13 ILE 11 -25.847 -20.138 -6.278 120 HG21 ILE 11 HG21 ILE 11 -22.566 -18.547 -6.795 121 HG22 ILE 11 HG22 ILE 11 -22.780 -19.258 -8.407 122 HG23 ILE 11 HG23 ILE 11 -23.013 -17.521 -8.181 123 HD11 ILE 11 HD11 ILE 11 -23.313 -21.306 -7.490 124 HD12 ILE 11 HD12 ILE 11 -24.630 -22.169 -6.684 125 HD13 ILE 11 HD13 ILE 11 -24.925 -21.379 -8.246 126 H GLN 12 H GLN 12 -26.713 -16.609 -4.797 127 HA GLN 12 HA GLN 12 -29.284 -17.733 -5.763 128 HB2 GLN 12 HB2 GLN 12 -29.651 -18.870 -3.670 129 HB3 GLN 12 HB3 GLN 12 -28.216 -19.493 -4.453 130 HG2 GLN 12 HG2 GLN 12 -28.102 -17.452 -2.175 131 HG3 GLN 12 HG3 GLN 12 -28.167 -19.181 -1.905 132 HE21 GLN 12 HE21 GLN 12 -24.585 -18.271 -1.780 133 HE22 GLN 12 HE22 GLN 12 -25.998 -17.737 -0.873 134 H LYS 13 H LYS 13 -31.151 -17.020 -4.584 135 HA LYS 13 HA LYS 13 -30.976 -14.217 -3.633 136 HB2 LYS 13 HB2 LYS 13 -33.234 -16.023 -4.567 137 HB3 LYS 13 HB3 LYS 13 -33.568 -14.469 -3.822 138 HG2 LYS 13 HG2 LYS 13 -31.775 -14.736 -6.263 139 HG3 LYS 13 HG3 LYS 13 -33.525 -14.499 -6.348 140 HD2 LYS 13 HD2 LYS 13 -33.330 -12.413 -5.021 141 HD3 LYS 13 HD3 LYS 13 -31.573 -12.571 -4.992 142 HE2 LYS 13 HE2 LYS 13 -33.244 -12.376 -7.538 143 HE3 LYS 13 HE3 LYS 13 -32.531 -10.985 -6.720 144 HZ1 LYS 13 HZ1 LYS 13 -30.983 -13.253 -7.853 145 HZ2 LYS 13 HZ2 LYS 13 -31.087 -11.755 -8.490 146 HZ3 LYS 13 HZ3 LYS 13 -30.333 -11.974 -7.062 147 H GLU 14 H GLU 14 -30.145 -16.534 -1.973 148 HA GLU 14 HA GLU 14 -30.250 -17.469 0.080 149 HB2 GLU 14 HB2 GLU 14 -31.513 -14.815 0.777 150 HB3 GLU 14 HB3 GLU 14 -31.371 -16.115 1.964 151 HG2 GLU 14 HG2 GLU 14 -29.034 -16.219 1.790 152 HG3 GLU 14 HG3 GLU 14 -28.991 -15.193 0.349 153 H ALA 15 H ALA 15 -31.190 -19.213 0.605 154 HA ALA 15 HA ALA 15 -34.155 -19.333 0.620 155 HB1 ALA 15 HB1 ALA 15 -32.162 -21.553 0.035 156 HB2 ALA 15 HB2 ALA 15 -33.928 -21.745 0.149 157 HB3 ALA 15 HB3 ALA 15 -33.224 -20.732 -1.123 158 H ILE 16 H ILE 16 -31.881 -21.570 2.106 159 HA ILE 16 HA ILE 16 -33.225 -21.103 4.728 160 HB ILE 16 HB ILE 16 -32.591 -23.637 3.210 161 HG12 ILE 16 HG12 ILE 16 -35.192 -22.605 4.432 162 HG13 ILE 16 HG13 ILE 16 -34.734 -22.442 2.740 163 HG21 ILE 16 HG21 ILE 16 -33.451 -23.506 6.138 164 HG22 ILE 16 HG22 ILE 16 -33.367 -24.987 5.154 165 HG23 ILE 16 HG23 ILE 16 -31.896 -24.114 5.523 166 HD11 ILE 16 HD11 ILE 16 -35.370 -25.037 4.171 167 HD12 ILE 16 HD12 ILE 16 -36.261 -24.249 2.866 168 HD13 ILE 16 HD13 ILE 16 -34.662 -24.943 2.537 169 H ASN 17 H ASN 17 -30.304 -21.004 3.341 170 HA ASN 17 HA ASN 17 -28.759 -22.047 5.548 171 HB2 ASN 17 HB2 ASN 17 -27.852 -20.254 3.245 172 HB3 ASN 17 HB3 ASN 17 -26.793 -21.193 4.293 173 HD21 ASN 17 HD21 ASN 17 -28.294 -22.972 1.047 174 HD22 ASN 17 HD22 ASN 17 -28.337 -21.235 1.305 175 H SER 18 H SER 18 -30.298 -19.056 5.124 176 HA SER 18 HA SER 18 -28.400 -17.483 6.755 177 HB2 SER 18 HB2 SER 18 -29.386 -16.602 4.673 178 HB3 SER 18 HB3 SER 18 -30.993 -16.640 5.420 179 HG SER 18 HG SER 18 -29.712 -14.624 5.469 180 H ASN 19 H ASN 19 -31.928 -18.286 6.947 181 HA ASN 19 HA ASN 19 -32.222 -17.137 9.528 182 HB2 ASN 19 HB2 ASN 19 -34.454 -18.015 9.495 183 HB3 ASN 19 HB3 ASN 19 -34.063 -17.478 7.871 184 HD21 ASN 19 HD21 ASN 19 -34.678 -20.693 6.518 185 HD22 ASN 19 HD22 ASN 19 -34.365 -18.995 6.193 186 H VAL 20 H VAL 20 -30.853 -20.108 8.729 187 HA VAL 20 HA VAL 20 -31.287 -21.320 11.392 188 HB VAL 20 HB VAL 20 -31.628 -22.538 9.182 189 HG11 VAL 20 HG11 VAL 20 -28.631 -23.004 9.314 190 HG12 VAL 20 HG12 VAL 20 -29.789 -23.612 8.120 191 HG13 VAL 20 HG13 VAL 20 -29.408 -21.884 8.167 192 HG21 VAL 20 HG21 VAL 20 -31.647 -23.658 11.366 193 HG22 VAL 20 HG22 VAL 20 -30.965 -24.676 10.089 194 HG23 VAL 20 HG23 VAL 20 -29.887 -23.899 11.264 195 H VAL 21 H VAL 21 -29.021 -19.266 9.995 196 HA VAL 21 HA VAL 21 -26.989 -19.913 12.079 197 HB VAL 21 HB VAL 21 -26.198 -19.097 9.257 198 HG11 VAL 21 HG11 VAL 21 -24.600 -20.171 11.637 199 HG12 VAL 21 HG12 VAL 21 -23.944 -19.747 10.042 200 HG13 VAL 21 HG13 VAL 21 -24.599 -18.484 11.083 201 HG21 VAL 21 HG21 VAL 21 -27.037 -21.351 9.056 202 HG22 VAL 21 HG22 VAL 21 -25.280 -21.413 9.048 203 HG23 VAL 21 HG23 VAL 21 -26.167 -21.869 10.522 204 H LEU 22 H LEU 22 -28.303 -18.314 13.171 205 HA LEU 22 HA LEU 22 -27.601 -15.495 12.456 206 HB2 LEU 22 HB2 LEU 22 -30.181 -16.762 13.361 207 HB3 LEU 22 HB3 LEU 22 -29.836 -15.106 13.854 208 HG LEU 22 HG LEU 22 -29.853 -16.025 10.957 209 HD11 LEU 22 HD11 LEU 22 -32.004 -14.583 12.562 210 HD12 LEU 22 HD12 LEU 22 -32.053 -14.923 10.817 211 HD13 LEU 22 HD13 LEU 22 -32.086 -16.261 11.979 212 HD21 LEU 22 HD21 LEU 22 -28.547 -13.958 11.278 213 HD22 LEU 22 HD22 LEU 22 -30.077 -13.588 10.488 214 HD23 LEU 22 HD23 LEU 22 -29.877 -13.243 12.219 215 H LYS 23 H LYS 23 -26.294 -14.581 13.782 216 HA LYS 23 HA LYS 23 -26.477 -14.936 16.736 217 HB2 LYS 23 HB2 LYS 23 -23.920 -15.242 15.098 218 HB3 LYS 23 HB3 LYS 23 -23.971 -15.003 16.850 219 HG2 LYS 23 HG2 LYS 23 -25.356 -17.082 17.068 220 HG3 LYS 23 HG3 LYS 23 -25.094 -17.389 15.336 221 HD2 LYS 23 HD2 LYS 23 -22.655 -17.460 15.696 222 HD3 LYS 23 HD3 LYS 23 -22.882 -17.071 17.416 223 HE2 LYS 23 HE2 LYS 23 -24.231 -19.152 17.692 224 HE3 LYS 23 HE3 LYS 23 -23.935 -19.559 15.997 225 HZ1 LYS 23 HZ1 LYS 23 -21.825 -19.261 18.073 226 HZ2 LYS 23 HZ2 LYS 23 -22.360 -20.680 17.473 227 HZ3 LYS 23 HZ3 LYS 23 -21.548 -19.644 16.508 228 H ASN 24 H ASN 24 -27.678 -12.904 15.792 229 HA ASN 24 HA ASN 24 -27.904 -10.678 15.463 230 HB2 ASN 24 HB2 ASN 24 -27.643 -10.974 17.888 231 HB3 ASN 24 HB3 ASN 24 -25.919 -10.629 17.750 232 HD21 ASN 24 HD21 ASN 24 -26.362 -7.140 17.600 233 HD22 ASN 24 HD22 ASN 24 -25.264 -8.501 17.330 234 HA PRO 25 HA PRO 25 -24.124 -10.100 12.855 235 HB2 PRO 25 HB2 PRO 25 -25.223 -10.085 10.372 236 HB3 PRO 25 HB3 PRO 25 -24.999 -11.589 11.308 237 HG2 PRO 25 HG2 PRO 25 -27.528 -9.910 11.102 238 HG3 PRO 25 HG3 PRO 25 -27.348 -11.673 10.829 239 HD2 PRO 25 HD2 PRO 25 -28.157 -10.644 13.224 240 HD3 PRO 25 HD3 PRO 25 -27.126 -12.102 13.128 241 H ARG 26 H ARG 26 -24.282 -8.105 14.174 242 HA ARG 26 HA ARG 26 -24.965 -5.699 12.489 243 HB2 ARG 26 HB2 ARG 26 -25.204 -6.091 15.492 244 HB3 ARG 26 HB3 ARG 26 -25.208 -4.502 14.710 245 HG2 ARG 26 HG2 ARG 26 -27.144 -5.162 13.324 246 HG3 ARG 26 HG3 ARG 26 -27.203 -6.740 14.130 247 HD2 ARG 26 HD2 ARG 26 -27.729 -5.697 16.270 248 HD3 ARG 26 HD3 ARG 26 -27.414 -4.091 15.613 249 HE ARG 26 HE ARG 26 -29.456 -4.059 14.524 250 HH11 ARG 26 HH11 ARG 26 -31.503 -4.686 14.041 251 HH12 ARG 26 HH12 ARG 26 -32.072 -6.264 14.500 252 HH21 ARG 26 HH21 ARG 26 -29.174 -7.249 16.043 253 HH22 ARG 26 HH22 ARG 26 -30.781 -7.675 15.548 254 H VAL 27 H VAL 27 -22.749 -6.619 15.167 255 HA VAL 27 HA VAL 27 -20.574 -5.130 13.764 256 HB VAL 27 HB VAL 27 -21.031 -4.764 16.743 257 HG11 VAL 27 HG11 VAL 27 -19.395 -3.198 14.685 258 HG12 VAL 27 HG12 VAL 27 -19.498 -2.857 16.425 259 HG13 VAL 27 HG13 VAL 27 -18.716 -4.334 15.866 260 HG21 VAL 27 HG21 VAL 27 -22.954 -3.700 15.693 261 HG22 VAL 27 HG22 VAL 27 -21.816 -2.474 16.237 262 HG23 VAL 27 HG23 VAL 27 -21.898 -2.887 14.511 263 HA PRO 28 HA PRO 28 -18.949 -9.161 15.408 264 HB2 PRO 28 HB2 PRO 28 -18.208 -10.384 13.104 265 HB3 PRO 28 HB3 PRO 28 -19.865 -10.502 13.782 266 HG2 PRO 28 HG2 PRO 28 -18.877 -8.668 11.582 267 HG3 PRO 28 HG3 PRO 28 -20.376 -9.642 11.616 268 HD2 PRO 28 HD2 PRO 28 -20.326 -6.964 12.259 269 HD3 PRO 28 HD3 PRO 28 -21.458 -8.120 13.023 270 H THR 29 H THR 29 -16.787 -9.804 15.459 271 HA THR 29 HA THR 29 -14.854 -7.671 15.199 272 HB THR 29 HB THR 29 -13.405 -9.488 16.337 273 HG1 THR 29 HG1 THR 29 -14.586 -11.140 17.287 274 HG21 THR 29 HG21 THR 29 -15.966 -8.547 17.699 275 HG22 THR 29 HG22 THR 29 -14.488 -9.105 18.515 276 HG23 THR 29 HG23 THR 29 -14.458 -7.616 17.559 277 H GLN 30 H GLN 30 -15.299 -7.827 12.817 278 HA GLN 30 HA GLN 30 -13.898 -9.844 11.362 279 HB2 GLN 30 HB2 GLN 30 -14.883 -8.770 9.388 280 HB3 GLN 30 HB3 GLN 30 -16.062 -8.836 10.695 281 HG2 GLN 30 HG2 GLN 30 -15.097 -6.373 11.233 282 HG3 GLN 30 HG3 GLN 30 -14.614 -6.442 9.542 283 HE21 GLN 30 HE21 GLN 30 -18.576 -6.088 10.563 284 HE22 GLN 30 HE22 GLN 30 -17.396 -6.544 11.794 285 H LYS 31 H LYS 31 -12.130 -8.399 12.960 286 HA LYS 31 HA LYS 31 -10.491 -6.593 11.322 287 HB2 LYS 31 HB2 LYS 31 -10.618 -7.541 14.188 288 HB3 LYS 31 HB3 LYS 31 -9.251 -6.555 13.662 289 HG2 LYS 31 HG2 LYS 31 -12.048 -5.526 13.115 290 HG3 LYS 31 HG3 LYS 31 -11.432 -5.497 14.763 291 HD2 LYS 31 HD2 LYS 31 -10.953 -3.359 13.776 292 HD3 LYS 31 HD3 LYS 31 -9.453 -4.223 14.062 293 HE2 LYS 31 HE2 LYS 31 -9.111 -3.278 11.972 294 HE3 LYS 31 HE3 LYS 31 -9.546 -4.938 11.570 295 HZ1 LYS 31 HZ1 LYS 31 -11.454 -2.651 11.561 296 HZ2 LYS 31 HZ2 LYS 31 -10.671 -3.175 10.240 297 HZ3 LYS 31 HZ3 LYS 31 -11.766 -4.156 10.989 298 H THR 32 H THR 32 -10.287 -8.656 9.908 299 HA THR 32 HA THR 32 -7.716 -10.057 10.495 300 HB THR 32 HB THR 32 -9.594 -11.190 11.618 301 HG1 THR 32 HG1 THR 32 -9.086 -13.232 10.934 302 HG21 THR 32 HG21 THR 32 -10.643 -11.782 8.825 303 HG22 THR 32 HG22 THR 32 -11.264 -12.435 10.358 304 HG23 THR 32 HG23 THR 32 -11.394 -10.703 10.020 305 H GLY 33 H GLY 33 -8.804 -8.180 8.269 306 HA2 GLY 33 HA2 GLY 33 -7.338 -9.465 6.107 307 HA3 GLY 33 HA3 GLY 33 -9.073 -9.416 5.788 308 H GLU 34 H GLU 34 -10.100 -7.187 6.068 309 HA GLU 34 HA GLU 34 -10.376 -5.089 5.470 310 HB2 GLU 34 HB2 GLU 34 -8.796 -4.996 7.511 311 HB3 GLU 34 HB3 GLU 34 -7.584 -4.388 6.377 312 HG2 GLU 34 HG2 GLU 34 -8.978 -2.453 5.865 313 HG3 GLU 34 HG3 GLU 34 -10.372 -3.202 6.655 314 H LEU 35 H LEU 35 -9.096 -6.876 3.399 315 HA LEU 35 HA LEU 35 -8.978 -4.732 1.427 316 HB2 LEU 35 HB2 LEU 35 -6.876 -6.939 1.566 317 HB3 LEU 35 HB3 LEU 35 -7.302 -6.093 0.090 318 HG LEU 35 HG LEU 35 -6.819 -3.917 1.605 319 HD11 LEU 35 HD11 LEU 35 -4.876 -6.012 2.673 320 HD12 LEU 35 HD12 LEU 35 -4.803 -4.261 2.968 321 HD13 LEU 35 HD13 LEU 35 -6.141 -5.210 3.624 322 HD21 LEU 35 HD21 LEU 35 -5.802 -4.418 -0.567 323 HD22 LEU 35 HD22 LEU 35 -4.561 -3.903 0.585 324 HD23 LEU 35 HD23 LEU 35 -4.750 -5.628 0.185 325 H SER 36 H SER 36 -10.288 -5.057 -0.100 326 HA SER 36 HA SER 36 -11.577 -7.704 -0.590 327 HB2 SER 36 HB2 SER 36 -12.825 -4.965 -0.795 328 HB3 SER 36 HB3 SER 36 -13.613 -6.521 -1.119 329 HG SER 36 HG SER 36 -14.038 -5.755 1.009 330 H GLU 37 H GLU 37 -11.283 -4.673 -2.382 331 HA GLU 37 HA GLU 37 -10.279 -6.053 -4.764 332 HB2 GLU 37 HB2 GLU 37 -12.254 -6.039 -6.077 333 HB3 GLU 37 HB3 GLU 37 -12.695 -6.761 -4.519 334 HG2 GLU 37 HG2 GLU 37 -13.644 -4.551 -3.821 335 HG3 GLU 37 HG3 GLU 37 -13.369 -3.968 -5.469 336 H GLU 38 H GLU 38 -11.899 -3.159 -3.504 337 HA GLU 38 HA GLU 38 -10.740 -1.365 -5.516 338 HB2 GLU 38 HB2 GLU 38 -12.052 -0.835 -2.815 339 HB3 GLU 38 HB3 GLU 38 -11.515 0.422 -3.937 340 HG2 GLU 38 HG2 GLU 38 -13.026 -0.507 -5.689 341 HG3 GLU 38 HG3 GLU 38 -13.631 -1.689 -4.524 342 H GLN 39 H GLN 39 -9.757 -2.700 -2.444 343 HA GLN 39 HA GLN 39 -7.744 -0.738 -1.801 344 HB2 GLN 39 HB2 GLN 39 -8.118 -3.581 -0.774 345 HB3 GLN 39 HB3 GLN 39 -7.118 -2.317 -0.062 346 HG2 GLN 39 HG2 GLN 39 -9.075 -2.290 1.250 347 HG3 GLN 39 HG3 GLN 39 -9.245 -0.901 0.185 348 HE21 GLN 39 HE21 GLN 39 -12.560 -2.386 -0.106 349 HE22 GLN 39 HE22 GLN 39 -11.660 -1.238 0.898 350 H LYS 40 H LYS 40 -7.708 -3.800 -3.581 351 HA LYS 40 HA LYS 40 -4.825 -3.822 -4.053 352 HB2 LYS 40 HB2 LYS 40 -7.207 -5.178 -5.388 353 HB3 LYS 40 HB3 LYS 40 -5.551 -5.439 -5.943 354 HG2 LYS 40 HG2 LYS 40 -4.925 -6.665 -4.156 355 HG3 LYS 40 HG3 LYS 40 -5.863 -5.735 -3.013 356 HD2 LYS 40 HD2 LYS 40 -7.822 -7.117 -4.594 357 HD3 LYS 40 HD3 LYS 40 -6.521 -8.284 -4.271 358 HE2 LYS 40 HE2 LYS 40 -6.624 -7.519 -1.835 359 HE3 LYS 40 HE3 LYS 40 -8.059 -6.569 -2.279 360 HZ1 LYS 40 HZ1 LYS 40 -7.851 -9.529 -2.631 361 HZ2 LYS 40 HZ2 LYS 40 -8.564 -8.829 -1.341 362 HZ3 LYS 40 HZ3 LYS 40 -9.205 -8.614 -2.825 363 H LYS 41 H LYS 41 -7.609 -2.500 -5.752 364 HA LYS 41 HA LYS 41 -6.073 -1.436 -7.964 365 HB2 LYS 41 HB2 LYS 41 -8.735 -0.466 -6.824 366 HB3 LYS 41 HB3 LYS 41 -8.031 0.101 -8.333 367 HG2 LYS 41 HG2 LYS 41 -8.142 -2.121 -9.308 368 HG3 LYS 41 HG3 LYS 41 -8.750 -2.800 -7.791 369 HD2 LYS 41 HD2 LYS 41 -10.750 -1.347 -7.920 370 HD3 LYS 41 HD3 LYS 41 -10.186 -0.673 -9.452 371 HE2 LYS 41 HE2 LYS 41 -10.765 -3.634 -8.967 372 HE3 LYS 41 HE3 LYS 41 -11.952 -2.492 -9.604 373 HZ1 LYS 41 HZ1 LYS 41 -9.379 -3.167 -10.929 374 HZ2 LYS 41 HZ2 LYS 41 -10.858 -3.663 -11.405 375 HZ3 LYS 41 HZ3 LYS 41 -10.467 -2.083 -11.492 376 H ILE 42 H ILE 42 -5.814 -0.558 -4.773 377 HA ILE 42 HA ILE 42 -4.472 2.025 -5.491 378 HB ILE 42 HB ILE 42 -5.470 0.951 -2.848 379 HG12 ILE 42 HG12 ILE 42 -6.350 3.619 -3.921 380 HG13 ILE 42 HG13 ILE 42 -6.945 2.228 -4.800 381 HG21 ILE 42 HG21 ILE 42 -3.976 3.562 -3.337 382 HG22 ILE 42 HG22 ILE 42 -4.774 3.083 -1.825 383 HG23 ILE 42 HG23 ILE 42 -3.388 2.171 -2.401 384 HD11 ILE 42 HD11 ILE 42 -7.314 2.689 -1.831 385 HD12 ILE 42 HD12 ILE 42 -8.556 2.741 -3.114 386 HD13 ILE 42 HD13 ILE 42 -7.769 1.211 -2.712 387 H VAL 43 H VAL 43 -4.001 -0.926 -3.447 388 HA VAL 43 HA VAL 43 -1.195 -0.410 -3.070 389 HB VAL 43 HB VAL 43 -2.814 -2.941 -2.611 390 HG11 VAL 43 HG11 VAL 43 -0.061 -2.208 -1.506 391 HG12 VAL 43 HG12 VAL 43 -0.995 -3.687 -1.172 392 HG13 VAL 43 HG13 VAL 43 -0.346 -3.425 -2.766 393 HG21 VAL 43 HG21 VAL 43 -3.536 -0.931 -1.281 394 HG22 VAL 43 HG22 VAL 43 -2.909 -2.239 -0.294 395 HG23 VAL 43 HG23 VAL 43 -1.890 -0.818 -0.629 396 H ALA 44 H ALA 44 -2.747 -3.096 -4.924 397 HA ALA 44 HA ALA 44 -0.230 -3.995 -6.008 398 HB1 ALA 44 HB1 ALA 44 -3.083 -4.604 -6.870 399 HB2 ALA 44 HB2 ALA 44 -1.612 -5.536 -7.264 400 HB3 ALA 44 HB3 ALA 44 -2.170 -5.454 -5.581 401 H ASP 45 H ASP 45 -2.752 -1.799 -7.123 402 HA ASP 45 HA ASP 45 -1.732 -1.213 -9.735 403 HB2 ASP 45 HB2 ASP 45 -3.866 -0.376 -8.820 404 HB3 ASP 45 HB3 ASP 45 -2.982 0.671 -7.705 405 H TYR 46 H TYR 46 -0.719 0.164 -6.533 406 HA TYR 46 HA TYR 46 1.346 1.840 -7.540 407 HB2 TYR 46 HB2 TYR 46 0.191 1.439 -5.117 408 HB3 TYR 46 HB3 TYR 46 1.661 0.538 -4.848 409 HD1 TYR 46 HD1 TYR 46 3.429 2.502 -6.601 410 HD2 TYR 46 HD2 TYR 46 0.597 3.015 -3.424 411 HE1 TYR 46 HE1 TYR 46 4.484 4.655 -6.061 412 HE2 TYR 46 HE2 TYR 46 1.707 5.145 -2.775 413 HH TYR 46 HH TYR 46 4.477 6.491 -4.630 414 H ILE 47 H ILE 47 1.397 -1.584 -6.526 415 HA ILE 47 HA ILE 47 4.208 -2.011 -6.816 416 HB ILE 47 HB ILE 47 1.896 -3.964 -7.080 417 HG12 ILE 47 HG12 ILE 47 1.632 -3.218 -4.914 418 HG13 ILE 47 HG13 ILE 47 2.681 -4.577 -4.663 419 HG21 ILE 47 HG21 ILE 47 4.770 -4.669 -6.440 420 HG22 ILE 47 HG22 ILE 47 3.383 -5.766 -6.503 421 HG23 ILE 47 HG23 ILE 47 3.940 -4.996 -7.980 422 HD11 ILE 47 HD11 ILE 47 3.443 -1.623 -4.619 423 HD12 ILE 47 HD12 ILE 47 3.420 -2.766 -3.266 424 HD13 ILE 47 HD13 ILE 47 4.635 -2.949 -4.541 425 H SER 48 H SER 48 1.802 -1.544 -9.236 426 HA SER 48 HA SER 48 3.500 -2.550 -11.432 427 HB2 SER 48 HB2 SER 48 0.918 -2.704 -11.245 428 HB3 SER 48 HB3 SER 48 0.927 -1.005 -11.755 429 HG SER 48 HG SER 48 0.768 -2.493 -13.520 430 H GLU 49 H GLU 49 3.310 0.444 -9.663 431 HA GLU 49 HA GLU 49 4.019 2.119 -12.023 432 HB2 GLU 49 HB2 GLU 49 3.351 2.796 -9.134 433 HB3 GLU 49 HB3 GLU 49 3.801 3.982 -10.355 434 HG2 GLU 49 HG2 GLU 49 1.425 2.126 -10.624 435 HG3 GLU 49 HG3 GLU 49 1.339 3.709 -9.867 436 H VAL 50 H VAL 50 5.198 1.553 -8.709 437 HA VAL 50 HA VAL 50 7.867 2.623 -9.542 438 HB VAL 50 HB VAL 50 8.110 3.630 -7.415 439 HG11 VAL 50 HG11 VAL 50 5.259 4.182 -8.245 440 HG12 VAL 50 HG12 VAL 50 6.387 5.252 -7.385 441 HG13 VAL 50 HG13 VAL 50 6.701 4.816 -9.071 442 HG21 VAL 50 HG21 VAL 50 7.229 1.943 -5.920 443 HG22 VAL 50 HG22 VAL 50 6.405 3.476 -5.644 444 HG23 VAL 50 HG23 VAL 50 5.596 2.176 -6.553 445 H GLY 51 H GLY 51 6.421 -0.159 -8.077 446 HA2 GLY 51 HA2 GLY 51 7.861 -2.139 -8.648 447 HA3 GLY 51 HA3 GLY 51 9.130 -1.381 -7.687 448 H LEU 52 H LEU 52 8.711 -1.034 -5.446 449 HA LEU 52 HA LEU 52 6.572 -2.302 -3.971 450 HB2 LEU 52 HB2 LEU 52 7.757 -4.327 -4.857 451 HB3 LEU 52 HB3 LEU 52 9.247 -3.775 -4.111 452 HG LEU 52 HG LEU 52 8.268 -4.097 -1.877 453 HD11 LEU 52 HD11 LEU 52 5.760 -4.866 -3.415 454 HD12 LEU 52 HD12 LEU 52 6.048 -5.416 -1.761 455 HD13 LEU 52 HD13 LEU 52 5.931 -3.691 -2.078 456 HD21 LEU 52 HD21 LEU 52 9.457 -5.927 -2.941 457 HD22 LEU 52 HD22 LEU 52 8.100 -6.576 -2.027 458 HD23 LEU 52 HD23 LEU 52 7.973 -6.451 -3.786 459 H ASN 53 H ASN 53 9.915 -1.245 -3.947 460 HA ASN 53 HA ASN 53 9.780 -0.483 -1.074 461 HB2 ASN 53 HB2 ASN 53 12.128 -0.943 -2.956 462 HB3 ASN 53 HB3 ASN 53 12.284 -0.375 -1.299 463 HD21 ASN 53 HD21 ASN 53 11.639 -4.323 -1.911 464 HD22 ASN 53 HD22 ASN 53 11.740 -3.221 -3.274 465 H ASN 54 H ASN 54 9.482 1.098 -4.042 466 HA ASN 54 HA ASN 54 10.703 3.630 -3.110 467 HB2 ASN 54 HB2 ASN 54 9.499 2.910 -5.798 468 HB3 ASN 54 HB3 ASN 54 10.475 4.330 -5.432 469 HD21 ASN 54 HD21 ASN 54 12.312 0.948 -6.512 470 HD22 ASN 54 HD22 ASN 54 10.615 1.306 -6.822 471 H LEU 55 H LEU 55 7.582 2.218 -3.183 472 HA LEU 55 HA LEU 55 6.007 4.666 -3.176 473 HB2 LEU 55 HB2 LEU 55 4.175 3.186 -2.536 474 HB3 LEU 55 HB3 LEU 55 5.070 2.582 -3.913 475 HG LEU 55 HG LEU 55 6.331 1.114 -2.073 476 HD11 LEU 55 HD11 LEU 55 3.590 1.580 -0.814 477 HD12 LEU 55 HD12 LEU 55 4.790 0.359 -0.331 478 HD13 LEU 55 HD13 LEU 55 5.144 2.073 -0.108 479 HD21 LEU 55 HD21 LEU 55 5.030 0.248 -3.973 480 HD22 LEU 55 HD22 LEU 55 4.696 -0.665 -2.494 481 HD23 LEU 55 HD23 LEU 55 3.520 0.535 -3.083 482 H ASN 56 H ASN 56 4.647 5.263 -1.229 483 HA ASN 56 HA ASN 56 6.100 4.841 1.323 484 HB2 ASN 56 HB2 ASN 56 5.982 7.083 1.962 485 HB3 ASN 56 HB3 ASN 56 6.616 7.088 0.330 486 HD21 ASN 56 HD21 ASN 56 4.334 9.816 0.067 487 HD22 ASN 56 HD22 ASN 56 6.011 9.387 0.377 488 H ALA 57 H ALA 57 4.769 5.442 3.210 489 HA ALA 57 HA ALA 57 2.358 3.803 3.151 490 HB1 ALA 57 HB1 ALA 57 3.866 5.317 5.322 491 HB2 ALA 57 HB2 ALA 57 2.526 4.196 5.620 492 HB3 ALA 57 HB3 ALA 57 4.032 3.594 4.905 493 H THR 58 H THR 58 3.069 7.247 3.179 494 HA THR 58 HA THR 58 0.653 8.294 4.216 495 HB THR 58 HB THR 58 2.501 9.543 2.150 496 HG1 THR 58 HG1 THR 58 3.587 10.347 3.966 497 HG21 THR 58 HG21 THR 58 0.653 10.764 4.246 498 HG22 THR 58 HG22 THR 58 1.846 11.671 3.281 499 HG23 THR 58 HG23 THR 58 0.492 10.871 2.477 500 H GLU 59 H GLU 59 1.588 7.671 0.792 501 HA GLU 59 HA GLU 59 -0.932 8.525 -0.320 502 HB2 GLU 59 HB2 GLU 59 1.220 6.626 -1.303 503 HB3 GLU 59 HB3 GLU 59 -0.157 7.110 -2.299 504 HG2 GLU 59 HG2 GLU 59 1.926 9.020 -1.144 505 HG3 GLU 59 HG3 GLU 59 1.929 8.382 -2.779 506 H LEU 60 H LEU 60 0.131 5.327 0.858 507 HA LEU 60 HA LEU 60 -2.297 3.924 0.157 508 HB2 LEU 60 HB2 LEU 60 0.064 3.419 1.950 509 HB3 LEU 60 HB3 LEU 60 -1.422 2.567 2.332 510 HG LEU 60 HG LEU 60 -1.531 1.666 0.019 511 HD11 LEU 60 HD11 LEU 60 1.255 2.870 -0.254 512 HD12 LEU 60 HD12 LEU 60 0.506 1.717 -1.379 513 HD13 LEU 60 HD13 LEU 60 -0.186 3.336 -1.185 514 HD21 LEU 60 HD21 LEU 60 -0.560 0.354 1.853 515 HD22 LEU 60 HD22 LEU 60 0.306 0.034 0.340 516 HD23 LEU 60 HD23 LEU 60 1.028 1.099 1.564 517 H SER 61 H SER 61 -1.343 5.566 3.244 518 HA SER 61 HA SER 61 -3.763 4.949 4.600 519 HB2 SER 61 HB2 SER 61 -3.043 6.605 6.238 520 HB3 SER 61 HB3 SER 61 -1.713 5.533 5.764 521 HG SER 61 HG SER 61 -0.991 7.652 5.768 522 H LYS 62 H LYS 62 -3.027 7.459 2.319 523 HA LYS 62 HA LYS 62 -5.331 9.188 2.918 524 HB2 LYS 62 HB2 LYS 62 -3.310 9.016 0.653 525 HB3 LYS 62 HB3 LYS 62 -4.682 10.125 0.587 526 HG2 LYS 62 HG2 LYS 62 -3.954 11.378 2.469 527 HG3 LYS 62 HG3 LYS 62 -2.796 10.148 2.964 528 HD2 LYS 62 HD2 LYS 62 -1.608 12.008 1.964 529 HD3 LYS 62 HD3 LYS 62 -1.428 10.578 0.937 530 HE2 LYS 62 HE2 LYS 62 -3.258 11.457 -0.540 531 HE3 LYS 62 HE3 LYS 62 -3.368 12.900 0.479 532 HZ1 LYS 62 HZ1 LYS 62 -0.952 12.029 -1.028 533 HZ2 LYS 62 HZ2 LYS 62 -1.943 13.256 -1.474 534 HZ3 LYS 62 HZ3 LYS 62 -1.046 13.389 -0.113 535 H ARG 63 H ARG 63 -4.700 6.553 0.665 536 HA ARG 63 HA ARG 63 -7.331 6.930 -0.682 537 HB2 ARG 63 HB2 ARG 63 -4.865 5.282 -1.328 538 HB3 ARG 63 HB3 ARG 63 -6.324 5.296 -2.322 539 HG2 ARG 63 HG2 ARG 63 -4.695 7.798 -1.688 540 HG3 ARG 63 HG3 ARG 63 -4.398 6.785 -3.090 541 HD2 ARG 63 HD2 ARG 63 -7.115 8.054 -2.544 542 HD3 ARG 63 HD3 ARG 63 -5.847 8.879 -3.428 543 HE ARG 63 HE ARG 63 -7.451 6.581 -4.345 544 HH11 ARG 63 HH11 ARG 63 -7.343 5.992 -6.490 545 HH12 ARG 63 HH12 ARG 63 -6.115 6.672 -7.515 546 HH21 ARG 63 HH21 ARG 63 -4.670 8.592 -5.078 547 HH22 ARG 63 HH22 ARG 63 -4.648 8.106 -6.749 548 H LEU 64 H LEU 64 -5.699 4.495 1.303 549 HA LEU 64 HA LEU 64 -8.019 2.666 1.208 550 HB2 LEU 64 HB2 LEU 64 -5.490 2.619 2.887 551 HB3 LEU 64 HB3 LEU 64 -6.670 1.320 2.785 552 HG LEU 64 HG LEU 64 -5.072 2.289 0.373 553 HD11 LEU 64 HD11 LEU 64 -4.504 -0.046 2.241 554 HD12 LEU 64 HD12 LEU 64 -3.629 0.357 0.747 555 HD13 LEU 64 HD13 LEU 64 -3.558 1.457 2.123 556 HD21 LEU 64 HD21 LEU 64 -7.155 1.024 -0.134 557 HD22 LEU 64 HD22 LEU 64 -5.704 0.092 -0.544 558 HD23 LEU 64 HD23 LEU 64 -6.609 -0.278 0.942 559 H ASN 65 H ASN 65 -6.951 5.338 3.171 560 HA ASN 65 HA ASN 65 -7.709 6.329 5.031 561 HB2 ASN 65 HB2 ASN 65 -9.856 6.233 3.693 562 HB3 ASN 65 HB3 ASN 65 -10.351 4.881 4.712 563 HD21 ASN 65 HD21 ASN 65 -10.767 6.995 7.633 564 HD22 ASN 65 HD22 ASN 65 -10.205 5.383 7.169 565 H ILE 66 H ILE 66 -5.986 4.775 5.669 566 HA ILE 66 HA ILE 66 -6.747 3.264 8.131 567 HB ILE 66 HB ILE 66 -4.665 1.894 7.754 568 HG12 ILE 66 HG12 ILE 66 -4.792 3.090 4.961 569 HG13 ILE 66 HG13 ILE 66 -3.506 3.322 6.150 570 HG21 ILE 66 HG21 ILE 66 -6.783 1.506 5.614 571 HG22 ILE 66 HG22 ILE 66 -5.735 0.272 6.360 572 HG23 ILE 66 HG23 ILE 66 -6.969 1.068 7.330 573 HD11 ILE 66 HD11 ILE 66 -4.200 0.729 4.719 574 HD12 ILE 66 HD12 ILE 66 -2.839 1.801 4.394 575 HD13 ILE 66 HD13 ILE 66 -2.919 0.925 5.946 576 H THR 67 H THR 67 -4.880 3.237 9.733 577 HA THR 67 HA THR 67 -3.570 5.861 9.933 578 HB THR 67 HB THR 67 -4.273 4.733 11.972 579 HG1 THR 67 HG1 THR 67 -2.384 5.171 13.054 580 HG21 THR 67 HG21 THR 67 -2.021 2.739 11.459 581 HG22 THR 67 HG22 THR 67 -3.045 2.850 12.902 582 HG23 THR 67 HG23 THR 67 -3.758 2.358 11.361 583 H VAL 68 H VAL 68 -1.297 6.210 9.873 584 HA VAL 68 HA VAL 68 -0.046 5.156 7.544 585 HB VAL 68 HB VAL 68 1.425 6.501 9.842 586 HG11 VAL 68 HG11 VAL 68 1.877 6.521 6.821 587 HG12 VAL 68 HG12 VAL 68 2.851 7.391 8.025 588 HG13 VAL 68 HG13 VAL 68 2.852 5.628 8.007 589 HG21 VAL 68 HG21 VAL 68 -0.497 7.940 9.357 590 HG22 VAL 68 HG22 VAL 68 0.964 8.664 8.692 591 HG23 VAL 68 HG23 VAL 68 -0.171 7.832 7.612 592 H ASP 69 H ASP 69 0.289 4.220 10.949 593 HA ASP 69 HA ASP 69 2.506 2.466 10.548 594 HB2 ASP 69 HB2 ASP 69 1.813 3.437 12.735 595 HB3 ASP 69 HB3 ASP 69 0.367 2.425 12.715 596 H LYS 70 H LYS 70 -0.958 1.880 10.121 597 HA LYS 70 HA LYS 70 -0.628 -1.016 9.798 598 HB2 LYS 70 HB2 LYS 70 -2.888 0.925 9.180 599 HB3 LYS 70 HB3 LYS 70 -2.914 -0.752 8.619 600 HG2 LYS 70 HG2 LYS 70 -2.617 -1.559 10.941 601 HG3 LYS 70 HG3 LYS 70 -2.679 0.110 11.531 602 HD2 LYS 70 HD2 LYS 70 -4.963 0.352 10.549 603 HD3 LYS 70 HD3 LYS 70 -4.910 -1.321 9.993 604 HE2 LYS 70 HE2 LYS 70 -4.709 -0.434 12.912 605 HE3 LYS 70 HE3 LYS 70 -6.198 -0.954 12.121 606 HZ1 LYS 70 HZ1 LYS 70 -3.795 -2.660 12.505 607 HZ2 LYS 70 HZ2 LYS 70 -5.200 -2.791 13.318 608 HZ3 LYS 70 HZ3 LYS 70 -5.154 -3.128 11.722 609 H ALA 71 H ALA 71 -0.396 1.807 7.697 610 HA ALA 71 HA ALA 71 -0.266 0.230 5.226 611 HB1 ALA 71 HB1 ALA 71 0.641 3.080 5.835 612 HB2 ALA 71 HB2 ALA 71 0.494 2.353 4.224 613 HB3 ALA 71 HB3 ALA 71 -0.944 2.626 5.228 614 H LYS 72 H LYS 72 2.151 1.735 7.375 615 HA LYS 72 HA LYS 72 4.530 0.933 6.040 616 HB2 LYS 72 HB2 LYS 72 3.900 1.475 8.962 617 HB3 LYS 72 HB3 LYS 72 5.537 1.103 8.396 618 HG2 LYS 72 HG2 LYS 72 5.602 3.077 7.012 619 HG3 LYS 72 HG3 LYS 72 3.895 3.395 7.310 620 HD2 LYS 72 HD2 LYS 72 5.274 4.915 8.628 621 HD3 LYS 72 HD3 LYS 72 4.266 3.885 9.632 622 HE2 LYS 72 HE2 LYS 72 6.390 4.059 10.693 623 HE3 LYS 72 HE3 LYS 72 6.229 2.411 10.094 624 HZ1 LYS 72 HZ1 LYS 72 7.771 4.582 8.756 625 HZ2 LYS 72 HZ2 LYS 72 8.425 3.351 9.599 626 HZ3 LYS 72 HZ3 LYS 72 7.651 3.050 8.195 627 H THR 73 H THR 73 2.681 -0.908 8.524 628 HA THR 73 HA THR 73 4.610 -3.126 8.295 629 HB THR 73 HB THR 73 3.485 -2.455 10.442 630 HG1 THR 73 HG1 THR 73 3.446 -4.595 11.095 631 HG21 THR 73 HG21 THR 73 1.177 -4.176 9.431 632 HG22 THR 73 HG22 THR 73 1.340 -3.380 11.012 633 HG23 THR 73 HG23 THR 73 1.114 -2.406 9.553 634 H TYR 74 H TYR 74 1.329 -2.491 7.016 635 HA TYR 74 HA TYR 74 0.926 -5.122 5.987 636 HB2 TYR 74 HB2 TYR 74 -0.932 -3.642 6.235 637 HB3 TYR 74 HB3 TYR 74 -0.168 -2.416 5.209 638 HD1 TYR 74 HD1 TYR 74 -0.590 -2.291 2.963 639 HD2 TYR 74 HD2 TYR 74 -1.378 -5.987 5.056 640 HE1 TYR 74 HE1 TYR 74 -1.372 -3.293 0.881 641 HE2 TYR 74 HE2 TYR 74 -2.156 -7.021 2.920 642 HH TYR 74 HH TYR 74 -2.095 -5.248 -0.185 643 H ILE 75 H ILE 75 2.570 -2.272 4.538 644 HA ILE 75 HA ILE 75 3.161 -3.291 1.975 645 HB ILE 75 HB ILE 75 4.707 -1.493 3.865 646 HG12 ILE 75 HG12 ILE 75 3.443 -0.846 1.168 647 HG13 ILE 75 HG13 ILE 75 2.511 -0.802 2.646 648 HG21 ILE 75 HG21 ILE 75 5.514 -2.281 1.026 649 HG22 ILE 75 HG22 ILE 75 6.202 -0.915 1.925 650 HG23 ILE 75 HG23 ILE 75 6.453 -2.540 2.521 651 HD11 ILE 75 HD11 ILE 75 4.978 0.913 2.098 652 HD12 ILE 75 HD12 ILE 75 3.296 1.446 2.101 653 HD13 ILE 75 HD13 ILE 75 4.050 0.899 3.610 654 H LYS 76 H LYS 76 5.348 -3.590 4.772 655 HA LYS 76 HA LYS 76 7.072 -5.634 3.936 656 HB2 LYS 76 HB2 LYS 76 6.065 -4.716 6.638 657 HB3 LYS 76 HB3 LYS 76 7.110 -6.139 6.527 658 HG2 LYS 76 HG2 LYS 76 8.793 -4.923 5.308 659 HG3 LYS 76 HG3 LYS 76 7.818 -3.442 5.325 660 HD2 LYS 76 HD2 LYS 76 8.832 -4.887 7.816 661 HD3 LYS 76 HD3 LYS 76 9.661 -3.522 7.047 662 HE2 LYS 76 HE2 LYS 76 7.639 -2.102 7.403 663 HE3 LYS 76 HE3 LYS 76 6.846 -3.454 8.222 664 HZ1 LYS 76 HZ1 LYS 76 9.357 -2.157 9.144 665 HZ2 LYS 76 HZ2 LYS 76 7.888 -1.941 9.819 666 HZ3 LYS 76 HZ3 LYS 76 8.614 -3.400 9.899 667 H ASN 77 H ASN 77 3.784 -6.131 5.069 668 HA ASN 77 HA ASN 77 4.262 -8.990 5.329 669 HB2 ASN 77 HB2 ASN 77 1.854 -7.229 5.723 670 HB3 ASN 77 HB3 ASN 77 1.624 -8.962 5.505 671 HD21 ASN 77 HD21 ASN 77 3.503 -7.693 8.917 672 HD22 ASN 77 HD22 ASN 77 3.296 -6.559 7.589 673 H SER 78 H SER 78 3.602 -7.017 2.620 674 HA SER 78 HA SER 78 3.296 -9.474 0.924 675 HB2 SER 78 HB2 SER 78 1.764 -7.587 0.452 676 HB3 SER 78 HB3 SER 78 3.163 -6.540 0.146 677 HG SER 78 HG SER 78 2.267 -7.495 -1.777 678 H ASN 79 H ASN 79 5.329 -6.637 1.489 679 HA ASN 79 HA ASN 79 7.499 -7.461 -0.232 680 HB2 ASN 79 HB2 ASN 79 6.863 -5.059 0.175 681 HB3 ASN 79 HB3 ASN 79 7.304 -5.247 1.848 682 HD21 ASN 79 HD21 ASN 79 10.265 -3.753 0.572 683 HD22 ASN 79 HD22 ASN 79 8.632 -3.383 1.145 684 H ARG 80 H ARG 80 7.814 -9.532 0.681 685 HA ARG 80 HA ARG 80 9.640 -9.461 3.041 686 HB2 ARG 80 HB2 ARG 80 7.235 -10.676 3.057 687 HB3 ARG 80 HB3 ARG 80 8.106 -11.948 2.211 688 HG2 ARG 80 HG2 ARG 80 8.247 -12.594 4.457 689 HG3 ARG 80 HG3 ARG 80 9.803 -11.826 4.171 690 HD2 ARG 80 HD2 ARG 80 9.148 -10.886 6.226 691 HD3 ARG 80 HD3 ARG 80 8.698 -9.647 5.063 692 HE ARG 80 HE ARG 80 6.468 -9.974 5.514 693 HH11 ARG 80 HH11 ARG 80 4.702 -10.760 6.743 694 HH12 ARG 80 HH12 ARG 80 4.931 -12.140 7.758 695 HH21 ARG 80 HH21 ARG 80 8.232 -12.599 7.040 696 HH22 ARG 80 HH22 ARG 80 6.845 -13.146 7.937 697 H MET 81 H MET 81 9.919 -9.637 -0.139 698 HA MET 81 HA MET 81 11.839 -11.937 -0.234 699 HB2 MET 81 HB2 MET 81 9.715 -11.010 -2.180 700 HB3 MET 81 HB3 MET 81 10.972 -12.180 -2.607 701 HG2 MET 81 HG2 MET 81 8.959 -12.510 -0.353 702 HG3 MET 81 HG3 MET 81 8.819 -13.231 -1.950 703 HE1 MET 81 HE1 MET 81 11.811 -14.305 -2.605 704 HE2 MET 81 HE2 MET 81 11.619 -15.958 -1.994 705 HE3 MET 81 HE3 MET 81 10.288 -15.185 -2.880 706 H GLY 82 H GLY 82 13.032 -9.775 0.528 707 HA2 GLY 82 HA2 GLY 82 15.026 -9.243 -1.434 708 HA3 GLY 82 HA3 GLY 82 13.939 -7.849 -1.306 709 H ARG 83 H ARG 83 14.746 -6.371 0.044 710 HA ARG 83 HA ARG 83 16.853 -6.987 1.965 711 HB2 ARG 83 HB2 ARG 83 15.364 -4.426 1.365 712 HB3 ARG 83 HB3 ARG 83 16.748 -4.570 2.472 713 HG2 ARG 83 HG2 ARG 83 18.101 -5.553 0.571 714 HG3 ARG 83 HG3 ARG 83 16.797 -5.102 -0.534 715 HD2 ARG 83 HD2 ARG 83 18.290 -3.163 1.286 716 HD3 ARG 83 HD3 ARG 83 18.743 -3.480 -0.379 717 HE ARG 83 HE ARG 83 16.404 -1.950 0.586 718 HH11 ARG 83 HH11 ARG 83 15.399 -0.591 -0.847 719 HH12 ARG 83 HH12 ARG 83 15.713 -0.732 -2.552 720 HH21 ARG 83 HH21 ARG 83 17.951 -3.309 -2.255 721 HH22 ARG 83 HH22 ARG 83 17.114 -2.228 -3.336 722 H THR 84 H THR 84 13.636 -7.453 2.409 723 HA THR 84 HA THR 84 13.418 -6.693 5.172 724 HB THR 84 HB THR 84 11.754 -8.711 3.674 725 HG1 THR 84 HG1 THR 84 10.449 -6.915 3.161 726 HG21 THR 84 HG21 THR 84 11.150 -6.872 6.045 727 HG22 THR 84 HG22 THR 84 9.877 -7.657 5.095 728 HG23 THR 84 HG23 THR 84 11.018 -8.646 6.003 729 H ASN 85 H ASN 85 15.501 -8.695 4.066 730 HA ASN 85 HA ASN 85 17.079 -9.901 5.056 731 HB2 ASN 85 HB2 ASN 85 16.973 -8.078 6.721 732 HB3 ASN 85 HB3 ASN 85 15.792 -8.983 7.666 733 HD21 ASN 85 HD21 ASN 85 19.717 -10.206 7.746 734 HD22 ASN 85 HD22 ASN 85 19.144 -9.337 6.333 735 H ASN 86 H ASN 86 14.892 -11.083 4.097 736 HA ASN 86 HA ASN 86 13.954 -13.309 5.639 737 HB2 ASN 86 HB2 ASN 86 12.977 -11.978 3.588 738 HB3 ASN 86 HB3 ASN 86 13.970 -13.040 2.580 739 HD21 ASN 86 HD21 ASN 86 10.947 -14.567 4.913 740 HD22 ASN 86 HD22 ASN 86 11.837 -13.073 5.302 741 H PHE 87 H PHE 87 16.833 -12.876 3.914 742 HA PHE 87 HA PHE 87 16.858 -15.569 2.758 743 HB2 PHE 87 HB2 PHE 87 18.180 -14.460 1.009 744 HB3 PHE 87 HB3 PHE 87 16.669 -13.615 1.362 745 HD1 PHE 87 HD1 PHE 87 20.371 -13.417 1.749 746 HD2 PHE 87 HD2 PHE 87 16.592 -11.390 2.252 747 HE1 PHE 87 HE1 PHE 87 21.569 -11.300 2.225 748 HE2 PHE 87 HE2 PHE 87 17.803 -9.267 2.704 749 HZ PHE 87 HZ PHE 87 20.291 -9.218 2.699 750 H LYS 88 H LYS 88 17.850 -14.926 5.468 751 HA LYS 88 HA LYS 88 20.780 -15.196 5.488 752 HB2 LYS 88 HB2 LYS 88 20.518 -14.790 7.889 753 HB3 LYS 88 HB3 LYS 88 19.661 -13.597 6.906 754 HG2 LYS 88 HG2 LYS 88 17.546 -15.111 7.322 755 HG3 LYS 88 HG3 LYS 88 18.507 -15.831 8.622 756 HD2 LYS 88 HD2 LYS 88 18.727 -13.635 9.707 757 HD3 LYS 88 HD3 LYS 88 18.012 -12.848 8.289 758 HE2 LYS 88 HE2 LYS 88 15.975 -14.468 8.763 759 HE3 LYS 88 HE3 LYS 88 16.658 -14.545 10.395 760 HZ1 LYS 88 HZ1 LYS 88 15.874 -12.088 8.919 761 HZ2 LYS 88 HZ2 LYS 88 15.050 -12.726 10.191 762 HZ3 LYS 88 HZ3 LYS 88 16.540 -12.069 10.408 763 H THR 89 H THR 89 18.692 -17.405 4.880 764 HA THR 89 HA THR 89 19.917 -19.657 6.393 765 HB THR 89 HB THR 89 16.926 -19.077 6.148 766 HG1 THR 89 HG1 THR 89 17.027 -18.758 8.374 767 HG21 THR 89 HG21 THR 89 18.487 -21.212 7.631 768 HG22 THR 89 HG22 THR 89 16.726 -20.930 7.768 769 HG23 THR 89 HG23 THR 89 17.420 -21.455 6.222 770 H ILE 90 H ILE 90 17.556 -18.638 3.917 771 HA ILE 90 HA ILE 90 17.778 -21.137 2.397 772 HB ILE 90 HB ILE 90 16.332 -18.615 1.521 773 HG12 ILE 90 HG12 ILE 90 15.228 -20.760 3.395 774 HG13 ILE 90 HG13 ILE 90 15.575 -19.086 3.837 775 HG21 ILE 90 HG21 ILE 90 15.731 -21.576 1.028 776 HG22 ILE 90 HG22 ILE 90 14.868 -20.196 0.317 777 HG23 ILE 90 HG23 ILE 90 16.516 -20.501 -0.142 778 HD11 ILE 90 HD11 ILE 90 13.390 -20.009 1.966 779 HD12 ILE 90 HD12 ILE 90 13.243 -19.217 3.541 780 HD13 ILE 90 HD13 ILE 90 13.893 -18.308 2.161 781 H LYS 91 H LYS 91 18.432 -21.176 0.148 782 HA LYS 91 HA LYS 91 19.957 -20.942 -1.523 783 HB2 LYS 91 HB2 LYS 91 20.018 -17.975 -0.912 784 HB3 LYS 91 HB3 LYS 91 20.442 -18.727 -2.426 785 HG2 LYS 91 HG2 LYS 91 17.593 -18.941 -1.389 786 HG3 LYS 91 HG3 LYS 91 18.186 -17.464 -2.108 787 HD2 LYS 91 HD2 LYS 91 17.022 -18.743 -3.761 788 HD3 LYS 91 HD3 LYS 91 18.726 -18.586 -4.197 789 HE2 LYS 91 HE2 LYS 91 19.159 -20.892 -3.420 790 HE3 LYS 91 HE3 LYS 91 17.474 -21.048 -2.894 791 HZ1 LYS 91 HZ1 LYS 91 18.357 -20.624 -5.704 792 HZ2 LYS 91 HZ2 LYS 91 17.824 -22.038 -5.090 793 HZ3 LYS 91 HZ3 LYS 91 16.802 -20.775 -5.224 794 H MET 92 H MET 92 21.012 -21.012 1.433 795 HA MET 92 HA MET 92 23.861 -20.338 0.753 796 HB2 MET 92 HB2 MET 92 22.602 -20.583 3.497 797 HB3 MET 92 HB3 MET 92 24.265 -20.115 3.115 798 HG2 MET 92 HG2 MET 92 23.186 -18.188 1.736 799 HG3 MET 92 HG3 MET 92 21.729 -18.553 2.660 800 HE1 MET 92 HE1 MET 92 23.740 -19.459 5.465 801 HE2 MET 92 HE2 MET 92 23.246 -18.024 6.380 802 HE3 MET 92 HE3 MET 92 22.042 -18.935 5.437 803 H PHE 93 H PHE 93 21.863 -23.079 1.656 804 HA PHE 93 HA PHE 93 24.333 -24.752 1.935 805 HB2 PHE 93 HB2 PHE 93 23.397 -25.916 3.750 806 HB3 PHE 93 HB3 PHE 93 23.213 -24.212 4.110 807 HD1 PHE 93 HD1 PHE 93 21.463 -27.369 3.365 808 HD2 PHE 93 HD2 PHE 93 20.963 -23.152 4.107 809 HE1 PHE 93 HE1 PHE 93 19.039 -27.727 3.763 810 HE2 PHE 93 HE2 PHE 93 18.535 -23.510 4.495 811 HZ PHE 93 HZ PHE 93 17.569 -25.798 4.324 812 H GLU 94 H GLU 94 21.615 -24.343 0.036 813 HA GLU 94 HA GLU 94 21.095 -27.218 -0.441 814 HB2 GLU 94 HB2 GLU 94 19.668 -24.737 -1.453 815 HB3 GLU 94 HB3 GLU 94 19.146 -26.411 -1.701 816 HG2 GLU 94 HG2 GLU 94 18.920 -26.721 0.745 817 HG3 GLU 94 HG3 GLU 94 19.396 -25.042 1.012 818 H ASP 95 H ASP 95 23.563 -25.717 -1.400 819 HA ASP 95 HA ASP 95 23.272 -25.547 -4.283 820 HB2 ASP 95 HB2 ASP 95 25.624 -24.970 -2.447 821 HB3 ASP 95 HB3 ASP 95 25.563 -24.581 -4.165 822 H ASP 96 H ASP 96 23.389 -28.261 -2.899 823 HA ASP 96 HA ASP 96 25.236 -29.564 -4.847 824 HB2 ASP 96 HB2 ASP 96 24.968 -30.246 -1.895 825 HB3 ASP 96 HB3 ASP 96 25.640 -31.347 -3.094 826 H VAL 97 H VAL 97 24.486 -31.377 -5.804 827 HA VAL 97 HA VAL 97 21.718 -32.328 -5.143 828 HB VAL 97 HB VAL 97 22.846 -31.855 -7.930 829 HG11 VAL 97 HG11 VAL 97 20.068 -32.728 -7.016 830 HG12 VAL 97 HG12 VAL 97 20.527 -32.315 -8.683 831 HG13 VAL 97 HG13 VAL 97 21.243 -33.725 -7.905 832 HG21 VAL 97 HG21 VAL 97 22.307 -29.700 -6.886 833 HG22 VAL 97 HG22 VAL 97 21.100 -30.093 -8.109 834 HG23 VAL 97 HG23 VAL 97 20.715 -30.312 -6.387 835 H SER 98 H SER 98 24.704 -33.180 -6.927 836 HA SER 98 HA SER 98 24.191 -36.062 -6.326 837 HB2 SER 98 HB2 SER 98 25.695 -34.864 -8.673 838 HB3 SER 98 HB3 SER 98 25.352 -36.583 -8.396 839 HG SER 98 HG SER 98 23.844 -35.628 -9.837 840 H SER 99 H SER 99 25.862 -33.895 -4.835 841 HA SER 99 HA SER 99 28.240 -35.576 -4.407 842 HB2 SER 99 HB2 SER 99 28.561 -33.595 -6.081 843 HB3 SER 99 HB3 SER 99 28.579 -32.585 -4.629 844 HG SER 99 HG SER 99 30.682 -33.305 -5.271 845 H ALA 100 H ALA 100 25.737 -34.908 -2.837 846 HA ALA 100 HA ALA 100 26.806 -33.602 -0.406 847 HB1 ALA 100 HB1 ALA 100 24.029 -34.655 -1.074 848 HB2 ALA 100 HB2 ALA 100 24.482 -33.727 0.370 849 HB3 ALA 100 HB3 ALA 100 24.575 -32.968 -1.229 850 H SER 101 H SER 101 26.648 -34.609 1.681 851 HA SER 101 HA SER 101 26.572 -37.589 1.790 852 HB2 SER 101 HB2 SER 101 28.723 -35.814 3.017 853 HB3 SER 101 HB3 SER 101 28.523 -37.550 3.320 854 HG SER 101 HG SER 101 30.091 -37.125 1.694 855 H ALA 102 H ALA 102 26.255 -38.412 3.982 856 HA ALA 102 HA ALA 102 24.176 -36.943 5.356 857 HB1 ALA 102 HB1 ALA 102 25.423 -39.657 5.923 858 HB2 ALA 102 HB2 ALA 102 23.875 -39.051 6.555 859 HB3 ALA 102 HB3 ALA 102 24.057 -39.354 4.818 860 H GLN 103 H GLN 103 26.850 -35.798 5.598 861 HA GLN 103 HA GLN 103 28.380 -34.899 6.945 862 HB2 GLN 103 HB2 GLN 103 25.925 -34.977 8.685 863 HB3 GLN 103 HB3 GLN 103 27.407 -34.271 9.305 864 HG2 GLN 103 HG2 GLN 103 27.490 -32.730 7.345 865 HG3 GLN 103 HG3 GLN 103 25.965 -33.410 6.763 866 HE21 GLN 103 HE21 GLN 103 23.983 -31.715 9.261 867 HE22 GLN 103 HE22 GLN 103 24.003 -33.113 8.195 868 HA PRO 104 HA PRO 104 30.711 -37.845 9.246 869 HB2 PRO 104 HB2 PRO 104 32.349 -36.417 10.888 870 HB3 PRO 104 HB3 PRO 104 32.434 -36.327 9.108 871 HG2 PRO 104 HG2 PRO 104 30.945 -34.444 10.972 872 HG3 PRO 104 HG3 PRO 104 32.127 -34.021 9.690 873 HD2 PRO 104 HD2 PRO 104 29.474 -33.945 9.225 874 HD3 PRO 104 HD3 PRO 104 30.593 -34.543 7.972 875 H ASN 105 H ASN 105 28.498 -38.438 10.090 876 HA ASN 105 HA ASN 105 28.432 -38.521 13.082 877 HB2 ASN 105 HB2 ASN 105 26.155 -37.942 11.132 878 HB3 ASN 105 HB3 ASN 105 25.920 -38.336 12.835 879 HD21 ASN 105 HD21 ASN 105 27.001 -35.156 14.026 880 HD22 ASN 105 HD22 ASN 105 26.767 -36.837 14.480 881 H LEU 106 H LEU 106 29.702 -40.496 12.306 882 HA LEU 106 HA LEU 106 27.878 -42.810 11.799 883 HB2 LEU 106 HB2 LEU 106 29.393 -42.220 9.924 884 HB3 LEU 106 HB3 LEU 106 30.777 -42.451 10.984 885 HG LEU 106 HG LEU 106 30.091 -44.873 11.267 886 HD11 LEU 106 HD11 LEU 106 28.074 -44.175 9.087 887 HD12 LEU 106 HD12 LEU 106 28.506 -45.820 9.602 888 HD13 LEU 106 HD13 LEU 106 27.693 -44.736 10.732 889 HD21 LEU 106 HD21 LEU 106 31.787 -44.193 9.616 890 HD22 LEU 106 HD22 LEU 106 30.835 -45.565 9.030 891 HD23 LEU 106 HD23 LEU 106 30.515 -43.932 8.401 892 HA PRO 107 HA PRO 107 29.695 -43.356 16.040 893 HB2 PRO 107 HB2 PRO 107 27.459 -44.247 17.328 894 HB3 PRO 107 HB3 PRO 107 27.786 -42.515 17.014 895 HG2 PRO 107 HG2 PRO 107 26.050 -44.406 15.391 896 HG3 PRO 107 HG3 PRO 107 25.646 -42.762 15.979 897 HD2 PRO 107 HD2 PRO 107 26.543 -43.206 13.450 898 HD3 PRO 107 HD3 PRO 107 27.015 -41.740 14.363 Start of MODEL 26 1 H1 GLY -5 H1 GLY -5 15.517 -53.596 21.221 2 H2 GLY -5 H2 GLY -5 14.409 -52.398 21.349 3 H3 GLY -5 H3 GLY -5 15.913 -52.067 20.787 4 HA2 GLY -5 HA2 GLY -5 14.431 -52.087 18.932 5 HA3 GLY -5 HA3 GLY -5 15.526 -53.477 18.846 6 H SER -4 H SER -4 13.818 -54.330 17.419 7 HA SER -4 HA SER -4 12.008 -56.105 18.919 8 HB2 SER -4 HB2 SER -4 10.645 -54.058 18.329 9 HB3 SER -4 HB3 SER -4 10.944 -54.426 16.616 10 HG SER -4 HG SER -4 8.963 -55.319 17.384 11 H HIS -3 H HIS -3 11.338 -57.943 17.669 12 HA HIS -3 HA HIS -3 12.579 -58.382 15.015 13 HB2 HIS -3 HB2 HIS -3 14.166 -59.075 16.952 14 HB3 HIS -3 HB3 HIS -3 13.056 -60.409 17.227 15 HD2 HIS -3 HD2 HIS -3 12.566 -61.788 14.588 16 HE1 HIS -3 HE1 HIS -3 16.707 -61.403 13.623 17 HE2 HIS -3 HE2 HIS -3 14.541 -62.611 13.047 18 H MET -2 H MET -2 10.947 -59.049 13.784 19 HA MET -2 HA MET -2 9.044 -61.151 14.741 20 HB2 MET -2 HB2 MET -2 8.282 -58.505 13.434 21 HB3 MET -2 HB3 MET -2 7.207 -59.900 13.591 22 HG2 MET -2 HG2 MET -2 7.461 -59.813 16.062 23 HG3 MET -2 HG3 MET -2 8.484 -58.386 15.890 24 HE1 MET -2 HE1 MET -2 4.892 -59.883 15.691 25 HE2 MET -2 HE2 MET -2 3.908 -58.517 15.124 26 HE3 MET -2 HE3 MET -2 5.021 -59.326 14.005 27 H ALA -1 H ALA -1 10.531 -62.450 13.532 28 HA ALA -1 HA ALA -1 11.307 -63.691 11.862 29 HB1 ALA -1 HB1 ALA -1 8.823 -62.865 10.336 30 HB2 ALA -1 HB2 ALA -1 9.829 -64.303 10.071 31 HB3 ALA -1 HB3 ALA -1 8.909 -64.139 11.575 32 H SER 0 H SER 0 10.513 -60.520 10.666 33 HA SER 0 HA SER 0 11.332 -59.006 9.339 34 HB2 SER 0 HB2 SER 0 13.640 -58.539 9.253 35 HB3 SER 0 HB3 SER 0 13.225 -59.137 10.865 36 HG SER 0 HG SER 0 15.169 -60.056 10.059 37 H MET 1 H MET 1 12.642 -62.076 8.207 38 HA MET 1 HA MET 1 12.674 -61.044 5.419 39 HB2 MET 1 HB2 MET 1 14.254 -62.840 4.948 40 HB3 MET 1 HB3 MET 1 14.782 -61.851 6.310 41 HG2 MET 1 HG2 MET 1 13.975 -63.556 7.891 42 HG3 MET 1 HG3 MET 1 13.399 -64.551 6.550 43 HE1 MET 1 HE1 MET 1 14.704 -66.560 7.758 44 HE2 MET 1 HE2 MET 1 16.442 -66.517 8.131 45 HE3 MET 1 HE3 MET 1 15.322 -65.443 8.996 46 H ASP 2 H ASP 2 10.536 -62.796 7.177 47 HA ASP 2 HA ASP 2 9.556 -64.390 4.830 48 HB2 ASP 2 HB2 ASP 2 9.131 -64.779 7.810 49 HB3 ASP 2 HB3 ASP 2 8.353 -65.741 6.558 50 H GLN 3 H GLN 3 8.949 -61.435 5.936 51 HA GLN 3 HA GLN 3 6.006 -61.557 5.532 52 HB2 GLN 3 HB2 GLN 3 5.568 -60.357 7.590 53 HB3 GLN 3 HB3 GLN 3 6.380 -61.875 7.870 54 HG2 GLN 3 HG2 GLN 3 7.557 -60.628 9.335 55 HG3 GLN 3 HG3 GLN 3 8.596 -60.400 7.945 56 HE21 GLN 3 HE21 GLN 3 8.323 -56.902 8.465 57 HE22 GLN 3 HE22 GLN 3 9.342 -58.266 8.031 58 H LEU 4 H LEU 4 8.142 -60.499 3.821 59 HA LEU 4 HA LEU 4 7.171 -57.679 3.526 60 HB2 LEU 4 HB2 LEU 4 9.993 -58.739 3.122 61 HB3 LEU 4 HB3 LEU 4 9.446 -57.106 2.747 62 HG LEU 4 HG LEU 4 9.567 -58.353 5.524 63 HD11 LEU 4 HD11 LEU 4 11.206 -56.138 4.220 64 HD12 LEU 4 HD12 LEU 4 11.360 -56.721 5.896 65 HD13 LEU 4 HD13 LEU 4 11.760 -57.798 4.553 66 HD21 LEU 4 HD21 LEU 4 7.732 -56.787 5.511 67 HD22 LEU 4 HD22 LEU 4 9.104 -56.002 6.296 68 HD23 LEU 4 HD23 LEU 4 8.692 -55.578 4.620 69 H ASP 5 H ASP 5 5.564 -58.843 2.185 70 HA ASP 5 HA ASP 5 6.543 -59.190 -0.632 71 HB2 ASP 5 HB2 ASP 5 4.594 -60.929 0.932 72 HB3 ASP 5 HB3 ASP 5 4.836 -61.040 -0.807 73 H GLU 6 H GLU 6 4.396 -57.362 1.258 74 HA GLU 6 HA GLU 6 2.427 -57.041 -0.941 75 HB2 GLU 6 HB2 GLU 6 1.643 -57.651 1.325 76 HB3 GLU 6 HB3 GLU 6 2.307 -56.137 1.960 77 HG2 GLU 6 HG2 GLU 6 0.844 -54.867 0.403 78 HG3 GLU 6 HG3 GLU 6 0.228 -56.385 -0.254 79 H ILE 7 H ILE 7 3.688 -55.822 -2.361 80 HA ILE 7 HA ILE 7 4.034 -52.952 -1.610 81 HB ILE 7 HB ILE 7 5.970 -54.383 -3.468 82 HG12 ILE 7 HG12 ILE 7 7.594 -53.815 -1.411 83 HG13 ILE 7 HG13 ILE 7 6.139 -54.095 -0.466 84 HG21 ILE 7 HG21 ILE 7 6.059 -51.689 -2.036 85 HG22 ILE 7 HG22 ILE 7 7.276 -52.328 -3.161 86 HG23 ILE 7 HG23 ILE 7 5.664 -51.932 -3.753 87 HD11 ILE 7 HD11 ILE 7 7.511 -56.021 -2.398 88 HD12 ILE 7 HD12 ILE 7 7.445 -56.143 -0.628 89 HD13 ILE 7 HD13 ILE 7 5.975 -56.376 -1.590 90 H ILE 8 H ILE 8 2.208 -52.220 -2.557 91 HA ILE 8 HA ILE 8 1.871 -52.510 -5.500 92 HB ILE 8 HB ILE 8 -0.356 -52.913 -3.461 93 HG12 ILE 8 HG12 ILE 8 0.960 -54.884 -5.390 94 HG13 ILE 8 HG13 ILE 8 1.091 -54.900 -3.630 95 HG21 ILE 8 HG21 ILE 8 -0.451 -52.973 -6.517 96 HG22 ILE 8 HG22 ILE 8 -1.805 -53.348 -5.429 97 HG23 ILE 8 HG23 ILE 8 -1.174 -51.726 -5.471 98 HD11 ILE 8 HD11 ILE 8 -1.385 -55.544 -5.248 99 HD12 ILE 8 HD12 ILE 8 -0.427 -56.611 -4.217 100 HD13 ILE 8 HD13 ILE 8 -1.380 -55.308 -3.479 101 H GLU 9 H GLU 9 1.117 -50.730 -6.522 102 HA GLU 9 HA GLU 9 0.332 -48.303 -4.973 103 HB2 GLU 9 HB2 GLU 9 2.443 -48.404 -7.168 104 HB3 GLU 9 HB3 GLU 9 1.765 -46.932 -6.454 105 HG2 GLU 9 HG2 GLU 9 2.631 -47.635 -4.223 106 HG3 GLU 9 HG3 GLU 9 3.403 -49.034 -4.980 107 H GLN 10 H GLN 10 -1.692 -49.548 -5.800 108 HA GLN 10 HA GLN 10 -2.618 -48.220 -8.298 109 HB2 GLN 10 HB2 GLN 10 -1.839 -50.497 -8.913 110 HB3 GLN 10 HB3 GLN 10 -2.994 -51.195 -7.776 111 HG2 GLN 10 HG2 GLN 10 -4.862 -50.091 -9.071 112 HG3 GLN 10 HG3 GLN 10 -3.663 -49.473 -10.211 113 HE21 GLN 10 HE21 GLN 10 -3.146 -52.700 -11.761 114 HE22 GLN 10 HE22 GLN 10 -2.369 -51.150 -11.461 115 H ILE 11 H ILE 11 -4.082 -50.634 -6.049 116 HA ILE 11 HA ILE 11 -5.830 -48.606 -4.890 117 HB ILE 11 HB ILE 11 -7.137 -49.237 -6.764 118 HG12 ILE 11 HG12 ILE 11 -8.150 -50.760 -4.342 119 HG13 ILE 11 HG13 ILE 11 -8.144 -48.998 -4.487 120 HG21 ILE 11 HG21 ILE 11 -6.889 -52.179 -6.004 121 HG22 ILE 11 HG22 ILE 11 -7.807 -51.496 -7.361 122 HG23 ILE 11 HG23 ILE 11 -6.051 -51.405 -7.364 123 HD11 ILE 11 HD11 ILE 11 -9.733 -50.938 -6.222 124 HD12 ILE 11 HD12 ILE 11 -10.363 -49.812 -5.010 125 HD13 ILE 11 HD13 ILE 11 -9.632 -49.181 -6.498 126 H GLN 12 H GLN 12 -5.714 -48.837 -2.832 127 HA GLN 12 HA GLN 12 -5.631 -51.329 -1.350 128 HB2 GLN 12 HB2 GLN 12 -3.406 -50.886 -0.340 129 HB3 GLN 12 HB3 GLN 12 -3.313 -51.327 -2.026 130 HG2 GLN 12 HG2 GLN 12 -3.123 -48.448 -1.032 131 HG3 GLN 12 HG3 GLN 12 -1.737 -49.503 -1.272 132 HE21 GLN 12 HE21 GLN 12 -3.092 -47.499 -4.452 133 HE22 GLN 12 HE22 GLN 12 -3.445 -47.068 -2.786 134 H LYS 13 H LYS 13 -5.218 -50.725 1.062 135 HA LYS 13 HA LYS 13 -7.278 -49.103 1.990 136 HB2 LYS 13 HB2 LYS 13 -6.013 -50.923 3.162 137 HB3 LYS 13 HB3 LYS 13 -4.688 -49.791 3.450 138 HG2 LYS 13 HG2 LYS 13 -6.206 -48.358 4.795 139 HG3 LYS 13 HG3 LYS 13 -7.548 -49.465 4.478 140 HD2 LYS 13 HD2 LYS 13 -4.970 -50.185 5.948 141 HD3 LYS 13 HD3 LYS 13 -6.501 -49.758 6.723 142 HE2 LYS 13 HE2 LYS 13 -7.605 -51.701 5.630 143 HE3 LYS 13 HE3 LYS 13 -6.069 -52.153 4.880 144 HZ1 LYS 13 HZ1 LYS 13 -6.557 -52.046 7.808 145 HZ2 LYS 13 HZ2 LYS 13 -6.456 -53.408 6.917 146 HZ3 LYS 13 HZ3 LYS 13 -5.140 -52.464 7.109 147 H GLU 14 H GLU 14 -4.044 -48.027 1.210 148 HA GLU 14 HA GLU 14 -4.601 -45.316 2.293 149 HB2 GLU 14 HB2 GLU 14 -2.186 -44.989 2.362 150 HB3 GLU 14 HB3 GLU 14 -2.648 -46.436 3.243 151 HG2 GLU 14 HG2 GLU 14 -1.911 -47.872 1.400 152 HG3 GLU 14 HG3 GLU 14 -1.591 -46.469 0.375 153 H ALA 15 H ALA 15 -5.511 -46.374 -0.372 154 HA ALA 15 HA ALA 15 -4.334 -45.037 -2.534 155 HB1 ALA 15 HB1 ALA 15 -7.204 -45.694 -1.811 156 HB2 ALA 15 HB2 ALA 15 -6.689 -45.168 -3.439 157 HB3 ALA 15 HB3 ALA 15 -6.076 -46.687 -2.751 158 H ILE 16 H ILE 16 -7.255 -43.772 -0.945 159 HA ILE 16 HA ILE 16 -6.341 -40.981 -1.421 160 HB ILE 16 HB ILE 16 -8.888 -42.389 -2.241 161 HG12 ILE 16 HG12 ILE 16 -6.886 -40.726 -3.833 162 HG13 ILE 16 HG13 ILE 16 -6.994 -42.483 -3.816 163 HG21 ILE 16 HG21 ILE 16 -8.509 -39.361 -2.257 164 HG22 ILE 16 HG22 ILE 16 -9.870 -40.232 -2.999 165 HG23 ILE 16 HG23 ILE 16 -9.672 -40.275 -1.266 166 HD11 ILE 16 HD11 ILE 16 -9.007 -40.583 -5.033 167 HD12 ILE 16 HD12 ILE 16 -7.983 -41.779 -5.834 168 HD13 ILE 16 HD13 ILE 16 -9.306 -42.325 -4.784 169 H ASN 17 H ASN 17 -7.277 -43.012 0.870 170 HA ASN 17 HA ASN 17 -9.082 -41.338 2.322 171 HB2 ASN 17 HB2 ASN 17 -7.447 -43.729 3.305 172 HB3 ASN 17 HB3 ASN 17 -8.841 -43.040 4.133 173 HD21 ASN 17 HD21 ASN 17 -9.521 -45.805 1.349 174 HD22 ASN 17 HD22 ASN 17 -7.975 -45.579 2.155 175 H SER 18 H SER 18 -5.688 -41.216 2.106 176 HA SER 18 HA SER 18 -5.215 -39.941 4.715 177 HB2 SER 18 HB2 SER 18 -3.555 -41.422 3.639 178 HB3 SER 18 HB3 SER 18 -3.366 -40.247 2.324 179 HG SER 18 HG SER 18 -1.780 -40.021 3.998 180 H ASN 19 H ASN 19 -5.305 -38.794 1.294 181 HA ASN 19 HA ASN 19 -4.529 -36.123 2.121 182 HB2 ASN 19 HB2 ASN 19 -4.464 -35.590 -0.219 183 HB3 ASN 19 HB3 ASN 19 -3.716 -37.159 0.029 184 HD21 ASN 19 HD21 ASN 19 -5.951 -38.738 -2.210 185 HD22 ASN 19 HD22 ASN 19 -4.480 -38.861 -1.256 186 H VAL 20 H VAL 20 -7.570 -37.595 1.816 187 HA VAL 20 HA VAL 20 -9.128 -35.181 1.271 188 HB VAL 20 HB VAL 20 -9.888 -37.972 2.191 189 HG11 VAL 20 HG11 VAL 20 -11.744 -35.667 1.447 190 HG12 VAL 20 HG12 VAL 20 -12.235 -37.369 1.604 191 HG13 VAL 20 HG13 VAL 20 -11.659 -36.496 3.021 192 HG21 VAL 20 HG21 VAL 20 -9.058 -37.739 -0.154 193 HG22 VAL 20 HG22 VAL 20 -10.767 -38.177 -0.098 194 HG23 VAL 20 HG23 VAL 20 -10.290 -36.502 -0.456 195 H VAL 21 H VAL 21 -8.002 -36.785 4.204 196 HA VAL 21 HA VAL 21 -9.565 -34.895 5.905 197 HB VAL 21 HB VAL 21 -8.226 -37.452 6.832 198 HG11 VAL 21 HG11 VAL 21 -10.449 -35.712 8.021 199 HG12 VAL 21 HG12 VAL 21 -9.806 -37.212 8.726 200 HG13 VAL 21 HG13 VAL 21 -8.778 -35.785 8.617 201 HG21 VAL 21 HG21 VAL 21 -9.926 -38.109 5.198 202 HG22 VAL 21 HG22 VAL 21 -10.523 -38.429 6.823 203 HG23 VAL 21 HG23 VAL 21 -11.109 -37.004 5.937 204 H LEU 22 H LEU 22 -7.888 -33.384 4.928 205 HA LEU 22 HA LEU 22 -5.721 -32.961 6.888 206 HB2 LEU 22 HB2 LEU 22 -4.905 -34.371 4.878 207 HB3 LEU 22 HB3 LEU 22 -5.209 -32.950 3.886 208 HG LEU 22 HG LEU 22 -3.556 -31.682 5.355 209 HD11 LEU 22 HD11 LEU 22 -2.980 -34.490 6.404 210 HD12 LEU 22 HD12 LEU 22 -1.947 -33.072 6.664 211 HD13 LEU 22 HD13 LEU 22 -3.568 -33.119 7.365 212 HD21 LEU 22 HD21 LEU 22 -2.919 -32.597 3.167 213 HD22 LEU 22 HD22 LEU 22 -1.576 -32.703 4.315 214 HD23 LEU 22 HD23 LEU 22 -2.521 -34.158 3.919 215 H LYS 23 H LYS 23 -5.128 -30.813 7.150 216 HA LYS 23 HA LYS 23 -6.660 -28.729 5.632 217 HB2 LYS 23 HB2 LYS 23 -6.072 -28.729 8.616 218 HB3 LYS 23 HB3 LYS 23 -6.854 -27.447 7.701 219 HG2 LYS 23 HG2 LYS 23 -8.780 -28.380 8.326 220 HG3 LYS 23 HG3 LYS 23 -8.500 -29.467 6.985 221 HD2 LYS 23 HD2 LYS 23 -9.129 -30.818 8.860 222 HD3 LYS 23 HD3 LYS 23 -7.412 -31.090 8.601 223 HE2 LYS 23 HE2 LYS 23 -7.758 -30.907 10.959 224 HE3 LYS 23 HE3 LYS 23 -6.903 -29.454 10.447 225 HZ1 LYS 23 HZ1 LYS 23 -9.831 -29.624 10.954 226 HZ2 LYS 23 HZ2 LYS 23 -8.742 -28.947 11.959 227 HZ3 LYS 23 HZ3 LYS 23 -9.039 -28.264 10.510 228 H ASN 24 H ASN 24 -4.178 -29.511 4.782 229 HA ASN 24 HA ASN 24 -2.059 -28.852 4.261 230 HB2 ASN 24 HB2 ASN 24 -3.718 -27.426 3.022 231 HB3 ASN 24 HB3 ASN 24 -3.411 -26.133 4.177 232 HD21 ASN 24 HD21 ASN 24 -0.216 -25.333 2.780 233 HD22 ASN 24 HD22 ASN 24 -1.177 -25.294 4.266 234 HA PRO 25 HA PRO 25 -1.042 -27.274 8.504 235 HB2 PRO 25 HB2 PRO 25 0.041 -29.441 9.731 236 HB3 PRO 25 HB3 PRO 25 -1.709 -29.328 9.393 237 HG2 PRO 25 HG2 PRO 25 0.402 -30.706 7.685 238 HG3 PRO 25 HG3 PRO 25 -1.127 -31.399 8.318 239 HD2 PRO 25 HD2 PRO 25 -0.960 -30.336 5.808 240 HD3 PRO 25 HD3 PRO 25 -2.427 -30.160 6.818 241 H ARG 26 H ARG 26 0.293 -26.075 6.889 242 HA ARG 26 HA ARG 26 3.112 -26.127 7.870 243 HB2 ARG 26 HB2 ARG 26 2.282 -26.080 4.948 244 HB3 ARG 26 HB3 ARG 26 3.837 -25.445 5.515 245 HG2 ARG 26 HG2 ARG 26 4.240 -27.762 6.579 246 HG3 ARG 26 HG3 ARG 26 2.833 -28.310 5.659 247 HD2 ARG 26 HD2 ARG 26 4.767 -28.872 4.388 248 HD3 ARG 26 HD3 ARG 26 3.982 -27.520 3.555 249 HE ARG 26 HE ARG 26 5.938 -26.481 5.362 250 HH11 ARG 26 HH11 ARG 26 7.924 -25.751 4.698 251 HH12 ARG 26 HH12 ARG 26 8.596 -26.305 3.193 252 HH21 ARG 26 HH21 ARG 26 5.932 -28.306 2.372 253 HH22 ARG 26 HH22 ARG 26 7.503 -27.713 1.903 254 H VAL 27 H VAL 27 0.948 -24.236 5.729 255 HA VAL 27 HA VAL 27 1.276 -21.853 7.394 256 HB VAL 27 HB VAL 27 3.231 -21.761 6.074 257 HG11 VAL 27 HG11 VAL 27 1.615 -21.728 3.507 258 HG12 VAL 27 HG12 VAL 27 3.365 -21.550 3.691 259 HG13 VAL 27 HG13 VAL 27 2.601 -23.092 4.089 260 HG21 VAL 27 HG21 VAL 27 2.043 -19.657 6.610 261 HG22 VAL 27 HG22 VAL 27 2.998 -19.539 5.123 262 HG23 VAL 27 HG23 VAL 27 1.236 -19.717 5.027 263 HA PRO 28 HA PRO 28 -2.822 -21.473 5.429 264 HB2 PRO 28 HB2 PRO 28 -4.142 -20.223 7.395 265 HB3 PRO 28 HB3 PRO 28 -3.676 -21.946 7.527 266 HG2 PRO 28 HG2 PRO 28 -2.260 -19.547 8.732 267 HG3 PRO 28 HG3 PRO 28 -2.638 -21.120 9.503 268 HD2 PRO 28 HD2 PRO 28 -0.196 -20.453 8.359 269 HD3 PRO 28 HD3 PRO 28 -0.802 -22.129 8.532 270 H THR 29 H THR 29 -4.321 -19.604 5.079 271 HA THR 29 HA THR 29 -2.828 -17.170 4.295 272 HB THR 29 HB THR 29 -4.224 -17.555 2.134 273 HG1 THR 29 HG1 THR 29 -4.528 -19.703 1.605 274 HG21 THR 29 HG21 THR 29 -1.804 -19.318 2.700 275 HG22 THR 29 HG22 THR 29 -2.383 -18.813 1.096 276 HG23 THR 29 HG23 THR 29 -1.746 -17.606 2.223 277 H GLN 30 H GLN 30 -3.810 -16.022 5.841 278 HA GLN 30 HA GLN 30 -6.702 -15.399 5.479 279 HB2 GLN 30 HB2 GLN 30 -6.821 -14.925 7.882 280 HB3 GLN 30 HB3 GLN 30 -6.380 -16.586 7.558 281 HG2 GLN 30 HG2 GLN 30 -4.306 -14.434 8.185 282 HG3 GLN 30 HG3 GLN 30 -5.120 -15.356 9.446 283 HE21 GLN 30 HE21 GLN 30 -1.826 -16.966 8.088 284 HE22 GLN 30 HE22 GLN 30 -2.180 -15.253 8.261 285 H LYS 31 H LYS 31 -4.510 -14.081 4.109 286 HA LYS 31 HA LYS 31 -4.198 -11.453 5.314 287 HB2 LYS 31 HB2 LYS 31 -2.497 -12.886 3.989 288 HB3 LYS 31 HB3 LYS 31 -3.329 -12.342 2.551 289 HG2 LYS 31 HG2 LYS 31 -1.442 -10.961 2.787 290 HG3 LYS 31 HG3 LYS 31 -2.775 -9.927 3.274 291 HD2 LYS 31 HD2 LYS 31 -1.208 -11.484 5.361 292 HD3 LYS 31 HD3 LYS 31 -0.500 -10.047 4.637 293 HE2 LYS 31 HE2 LYS 31 -2.297 -8.628 5.398 294 HE3 LYS 31 HE3 LYS 31 -3.222 -10.008 6.000 295 HZ1 LYS 31 HZ1 LYS 31 -0.555 -9.237 7.048 296 HZ2 LYS 31 HZ2 LYS 31 -1.972 -8.872 7.776 297 HZ3 LYS 31 HZ3 LYS 31 -1.493 -10.426 7.629 298 H THR 32 H THR 32 -6.745 -11.616 5.181 299 HA THR 32 HA THR 32 -7.750 -10.017 2.862 300 HB THR 32 HB THR 32 -7.974 -12.498 2.570 301 HG1 THR 32 HG1 THR 32 -10.106 -12.396 1.872 302 HG21 THR 32 HG21 THR 32 -10.089 -12.316 4.755 303 HG22 THR 32 HG22 THR 32 -9.699 -13.730 3.754 304 HG23 THR 32 HG23 THR 32 -8.515 -13.122 4.917 305 H GLY 33 H GLY 33 -7.356 -9.709 5.987 306 HA2 GLY 33 HA2 GLY 33 -9.942 -9.408 7.144 307 HA3 GLY 33 HA3 GLY 33 -8.433 -8.759 7.783 308 H GLU 34 H GLU 34 -7.901 -6.998 5.496 309 HA GLU 34 HA GLU 34 -10.105 -4.984 5.685 310 HB2 GLU 34 HB2 GLU 34 -7.164 -4.449 6.264 311 HB3 GLU 34 HB3 GLU 34 -8.426 -3.218 6.126 312 HG2 GLU 34 HG2 GLU 34 -9.665 -4.321 8.010 313 HG3 GLU 34 HG3 GLU 34 -8.284 -5.399 8.239 314 H LEU 35 H LEU 35 -9.043 -6.800 3.446 315 HA LEU 35 HA LEU 35 -8.982 -4.722 1.373 316 HB2 LEU 35 HB2 LEU 35 -6.937 -6.982 1.545 317 HB3 LEU 35 HB3 LEU 35 -7.352 -6.124 0.073 318 HG LEU 35 HG LEU 35 -6.784 -3.963 1.560 319 HD11 LEU 35 HD11 LEU 35 -4.920 -6.119 2.661 320 HD12 LEU 35 HD12 LEU 35 -4.794 -4.372 2.949 321 HD13 LEU 35 HD13 LEU 35 -6.166 -5.275 3.602 322 HD21 LEU 35 HD21 LEU 35 -5.767 -4.534 -0.598 323 HD22 LEU 35 HD22 LEU 35 -4.516 -4.048 0.556 324 HD23 LEU 35 HD23 LEU 35 -4.765 -5.771 0.181 325 H SER 36 H SER 36 -10.277 -5.116 -0.136 326 HA SER 36 HA SER 36 -11.502 -7.811 -0.597 327 HB2 SER 36 HB2 SER 36 -12.783 -5.096 -0.928 328 HB3 SER 36 HB3 SER 36 -13.521 -6.660 -1.323 329 HG SER 36 HG SER 36 -14.132 -5.919 0.763 330 H GLU 37 H GLU 37 -11.190 -4.825 -2.458 331 HA GLU 37 HA GLU 37 -9.989 -6.216 -4.733 332 HB2 GLU 37 HB2 GLU 37 -12.750 -6.525 -4.378 333 HB3 GLU 37 HB3 GLU 37 -12.675 -5.126 -5.460 334 HG2 GLU 37 HG2 GLU 37 -11.126 -6.443 -6.937 335 HG3 GLU 37 HG3 GLU 37 -11.306 -7.811 -5.827 336 H GLU 38 H GLU 38 -11.852 -3.407 -3.624 337 HA GLU 38 HA GLU 38 -10.790 -1.533 -5.536 338 HB2 GLU 38 HB2 GLU 38 -12.958 -1.555 -4.057 339 HB3 GLU 38 HB3 GLU 38 -11.955 -0.823 -2.821 340 HG2 GLU 38 HG2 GLU 38 -12.276 0.259 -5.667 341 HG3 GLU 38 HG3 GLU 38 -13.383 0.668 -4.367 342 H GLN 39 H GLN 39 -9.729 -2.765 -2.404 343 HA GLN 39 HA GLN 39 -7.720 -0.746 -1.895 344 HB2 GLN 39 HB2 GLN 39 -8.017 -3.566 -0.787 345 HB3 GLN 39 HB3 GLN 39 -6.947 -2.302 -0.181 346 HG2 GLN 39 HG2 GLN 39 -8.776 -2.211 1.272 347 HG3 GLN 39 HG3 GLN 39 -9.015 -0.848 0.192 348 HE21 GLN 39 HE21 GLN 39 -12.367 -2.219 0.324 349 HE22 GLN 39 HE22 GLN 39 -11.298 -1.106 1.167 350 H LYS 40 H LYS 40 -7.650 -3.873 -3.608 351 HA LYS 40 HA LYS 40 -4.756 -3.841 -4.060 352 HB2 LYS 40 HB2 LYS 40 -7.109 -5.330 -5.269 353 HB3 LYS 40 HB3 LYS 40 -5.484 -5.514 -5.942 354 HG2 LYS 40 HG2 LYS 40 -4.613 -6.560 -4.116 355 HG3 LYS 40 HG3 LYS 40 -5.694 -5.786 -2.971 356 HD2 LYS 40 HD2 LYS 40 -7.321 -7.428 -4.727 357 HD3 LYS 40 HD3 LYS 40 -5.949 -8.398 -4.148 358 HE2 LYS 40 HE2 LYS 40 -6.466 -7.672 -1.811 359 HE3 LYS 40 HE3 LYS 40 -7.854 -6.754 -2.421 360 HZ1 LYS 40 HZ1 LYS 40 -7.575 -9.697 -2.801 361 HZ2 LYS 40 HZ2 LYS 40 -8.380 -9.044 -1.540 362 HZ3 LYS 40 HZ3 LYS 40 -8.924 -8.785 -3.047 363 H LYS 41 H LYS 41 -7.545 -2.716 -5.858 364 HA LYS 41 HA LYS 41 -6.111 -1.614 -8.097 365 HB2 LYS 41 HB2 LYS 41 -8.735 -0.757 -6.788 366 HB3 LYS 41 HB3 LYS 41 -8.124 -0.024 -8.262 367 HG2 LYS 41 HG2 LYS 41 -8.261 -2.080 -9.472 368 HG3 LYS 41 HG3 LYS 41 -8.656 -3.002 -8.010 369 HD2 LYS 41 HD2 LYS 41 -10.784 -1.979 -7.773 370 HD3 LYS 41 HD3 LYS 41 -10.429 -0.704 -8.944 371 HE2 LYS 41 HE2 LYS 41 -10.537 -3.655 -9.707 372 HE3 LYS 41 HE3 LYS 41 -11.981 -2.640 -9.659 373 HZ1 LYS 41 HZ1 LYS 41 -9.610 -2.086 -11.358 374 HZ2 LYS 41 HZ2 LYS 41 -11.036 -2.674 -11.884 375 HZ3 LYS 41 HZ3 LYS 41 -10.956 -1.161 -11.287 376 H ILE 42 H ILE 42 -5.782 -0.676 -4.896 377 HA ILE 42 HA ILE 42 -4.494 1.907 -5.685 378 HB ILE 42 HB ILE 42 -5.503 0.875 -3.034 379 HG12 ILE 42 HG12 ILE 42 -6.357 3.528 -4.157 380 HG13 ILE 42 HG13 ILE 42 -6.940 2.120 -5.017 381 HG21 ILE 42 HG21 ILE 42 -4.040 3.512 -3.468 382 HG22 ILE 42 HG22 ILE 42 -4.790 2.927 -1.964 383 HG23 ILE 42 HG23 ILE 42 -3.392 2.100 -2.606 384 HD11 ILE 42 HD11 ILE 42 -7.392 2.690 -2.084 385 HD12 ILE 42 HD12 ILE 42 -8.587 2.638 -3.401 386 HD13 ILE 42 HD13 ILE 42 -7.786 1.153 -2.884 387 H VAL 43 H VAL 43 -3.961 -0.928 -3.497 388 HA VAL 43 HA VAL 43 -1.187 -0.322 -3.110 389 HB VAL 43 HB VAL 43 -2.732 -2.895 -2.633 390 HG11 VAL 43 HG11 VAL 43 -0.001 -2.095 -1.521 391 HG12 VAL 43 HG12 VAL 43 -0.912 -3.584 -1.169 392 HG13 VAL 43 HG13 VAL 43 -0.260 -3.337 -2.765 393 HG21 VAL 43 HG21 VAL 43 -3.498 -0.888 -1.330 394 HG22 VAL 43 HG22 VAL 43 -2.847 -2.169 -0.319 395 HG23 VAL 43 HG23 VAL 43 -1.863 -0.727 -0.669 396 H ALA 44 H ALA 44 -2.629 -3.057 -4.982 397 HA ALA 44 HA ALA 44 -0.073 -3.903 -6.012 398 HB1 ALA 44 HB1 ALA 44 -2.882 -4.538 -6.996 399 HB2 ALA 44 HB2 ALA 44 -1.383 -5.444 -7.334 400 HB3 ALA 44 HB3 ALA 44 -2.018 -5.392 -5.680 401 H ASP 45 H ASP 45 -2.614 -1.763 -7.197 402 HA ASP 45 HA ASP 45 -1.550 -1.184 -9.792 403 HB2 ASP 45 HB2 ASP 45 -3.754 -0.443 -8.965 404 HB3 ASP 45 HB3 ASP 45 -2.964 0.677 -7.850 405 H TYR 46 H TYR 46 -0.697 0.328 -6.604 406 HA TYR 46 HA TYR 46 1.329 2.047 -7.679 407 HB2 TYR 46 HB2 TYR 46 0.039 1.981 -5.380 408 HB3 TYR 46 HB3 TYR 46 1.377 0.986 -4.847 409 HD1 TYR 46 HD1 TYR 46 0.519 3.476 -3.579 410 HD2 TYR 46 HD2 TYR 46 3.359 2.867 -6.738 411 HE1 TYR 46 HE1 TYR 46 1.673 5.578 -2.944 412 HE2 TYR 46 HE2 TYR 46 4.502 4.957 -6.167 413 HH TYR 46 HH TYR 46 3.356 7.077 -3.480 414 H ILE 47 H ILE 47 1.463 -1.286 -6.369 415 HA ILE 47 HA ILE 47 4.300 -1.620 -6.464 416 HB ILE 47 HB ILE 47 2.079 -3.659 -6.835 417 HG12 ILE 47 HG12 ILE 47 1.618 -3.165 -4.678 418 HG13 ILE 47 HG13 ILE 47 2.966 -4.192 -4.334 419 HG21 ILE 47 HG21 ILE 47 4.929 -4.240 -6.011 420 HG22 ILE 47 HG22 ILE 47 3.593 -5.397 -6.186 421 HG23 ILE 47 HG23 ILE 47 4.228 -4.590 -7.612 422 HD11 ILE 47 HD11 ILE 47 2.942 -1.145 -4.317 423 HD12 ILE 47 HD12 ILE 47 3.160 -2.256 -2.962 424 HD13 ILE 47 HD13 ILE 47 4.431 -2.111 -4.191 425 H SER 48 H SER 48 1.929 -1.656 -9.057 426 HA SER 48 HA SER 48 3.782 -2.571 -11.107 427 HB2 SER 48 HB2 SER 48 1.198 -2.722 -11.034 428 HB3 SER 48 HB3 SER 48 1.222 -1.044 -11.607 429 HG SER 48 HG SER 48 1.137 -2.599 -13.318 430 H GLU 49 H GLU 49 3.471 0.537 -9.537 431 HA GLU 49 HA GLU 49 4.323 2.068 -11.941 432 HB2 GLU 49 HB2 GLU 49 3.603 2.920 -9.112 433 HB3 GLU 49 HB3 GLU 49 4.093 4.021 -10.392 434 HG2 GLU 49 HG2 GLU 49 1.691 2.195 -10.615 435 HG3 GLU 49 HG3 GLU 49 1.615 3.798 -9.901 436 H VAL 50 H VAL 50 5.386 1.592 -8.570 437 HA VAL 50 HA VAL 50 8.055 2.686 -9.340 438 HB VAL 50 HB VAL 50 8.196 3.728 -7.191 439 HG11 VAL 50 HG11 VAL 50 5.436 4.296 -8.269 440 HG12 VAL 50 HG12 VAL 50 6.514 5.374 -7.358 441 HG13 VAL 50 HG13 VAL 50 6.948 4.879 -8.999 442 HG21 VAL 50 HG21 VAL 50 7.147 2.079 -5.751 443 HG22 VAL 50 HG22 VAL 50 6.381 3.661 -5.573 444 HG23 VAL 50 HG23 VAL 50 5.569 2.382 -6.503 445 H GLY 51 H GLY 51 6.721 -0.182 -8.015 446 HA2 GLY 51 HA2 GLY 51 8.376 -1.998 -8.556 447 HA3 GLY 51 HA3 GLY 51 9.496 -1.193 -7.459 448 H LEU 52 H LEU 52 8.770 -0.913 -5.241 449 HA LEU 52 HA LEU 52 6.518 -2.276 -4.132 450 HB2 LEU 52 HB2 LEU 52 7.833 -4.311 -4.471 451 HB3 LEU 52 HB3 LEU 52 9.236 -3.583 -3.694 452 HG LEU 52 HG LEU 52 8.084 -3.588 -1.524 453 HD11 LEU 52 HD11 LEU 52 5.757 -4.931 -2.969 454 HD12 LEU 52 HD12 LEU 52 5.935 -4.695 -1.209 455 HD13 LEU 52 HD13 LEU 52 5.726 -3.303 -2.255 456 HD21 LEU 52 HD21 LEU 52 9.347 -5.582 -2.285 457 HD22 LEU 52 HD22 LEU 52 8.026 -5.991 -1.172 458 HD23 LEU 52 HD23 LEU 52 7.846 -6.281 -2.919 459 H ASN 53 H ASN 53 9.761 -1.092 -3.478 460 HA ASN 53 HA ASN 53 8.962 -0.122 -0.784 461 HB2 ASN 53 HB2 ASN 53 11.685 -0.780 -1.972 462 HB3 ASN 53 HB3 ASN 53 11.410 -0.233 -0.322 463 HD21 ASN 53 HD21 ASN 53 11.082 -4.128 -1.032 464 HD22 ASN 53 HD22 ASN 53 11.813 -3.009 -2.170 465 H ASN 54 H ASN 54 9.415 1.296 -3.777 466 HA ASN 54 HA ASN 54 10.717 3.751 -2.788 467 HB2 ASN 54 HB2 ASN 54 9.671 3.077 -5.557 468 HB3 ASN 54 HB3 ASN 54 10.746 4.407 -5.130 469 HD21 ASN 54 HD21 ASN 54 12.325 0.809 -5.928 470 HD22 ASN 54 HD22 ASN 54 10.696 1.308 -6.384 471 H LEU 55 H LEU 55 7.477 2.641 -3.252 472 HA LEU 55 HA LEU 55 6.107 5.180 -3.212 473 HB2 LEU 55 HB2 LEU 55 4.170 3.851 -2.509 474 HB3 LEU 55 HB3 LEU 55 4.998 3.176 -3.891 475 HG LEU 55 HG LEU 55 6.150 1.587 -2.132 476 HD11 LEU 55 HD11 LEU 55 3.575 2.370 -0.692 477 HD12 LEU 55 HD12 LEU 55 4.610 0.980 -0.313 478 HD13 LEU 55 HD13 LEU 55 5.224 2.615 -0.076 479 HD21 LEU 55 HD21 LEU 55 4.641 0.873 -3.936 480 HD22 LEU 55 HD22 LEU 55 4.288 0.009 -2.434 481 HD23 LEU 55 HD23 LEU 55 3.229 1.339 -2.960 482 H ASN 56 H ASN 56 4.743 5.904 -1.319 483 HA ASN 56 HA ASN 56 6.179 5.570 1.262 484 HB2 ASN 56 HB2 ASN 56 5.794 7.784 1.878 485 HB3 ASN 56 HB3 ASN 56 6.435 7.849 0.250 486 HD21 ASN 56 HD21 ASN 56 3.846 10.309 0.023 487 HD22 ASN 56 HD22 ASN 56 5.546 10.088 0.420 488 H ALA 57 H ALA 57 4.771 5.991 3.138 489 HA ALA 57 HA ALA 57 2.501 4.150 3.014 490 HB1 ALA 57 HB1 ALA 57 3.871 5.691 5.255 491 HB2 ALA 57 HB2 ALA 57 2.647 4.426 5.487 492 HB3 ALA 57 HB3 ALA 57 4.210 4.017 4.755 493 H THR 58 H THR 58 2.971 7.623 3.126 494 HA THR 58 HA THR 58 0.525 8.528 4.185 495 HB THR 58 HB THR 58 2.224 9.859 2.048 496 HG1 THR 58 HG1 THR 58 3.321 10.748 3.819 497 HG21 THR 58 HG21 THR 58 0.383 10.998 4.193 498 HG22 THR 58 HG22 THR 58 1.484 11.958 3.173 499 HG23 THR 58 HG23 THR 58 0.149 11.069 2.432 500 H GLU 59 H GLU 59 1.386 7.925 0.736 501 HA GLU 59 HA GLU 59 -1.205 8.634 -0.305 502 HB2 GLU 59 HB2 GLU 59 1.002 6.830 -1.331 503 HB3 GLU 59 HB3 GLU 59 -0.438 7.213 -2.283 504 HG2 GLU 59 HG2 GLU 59 1.569 9.270 -1.250 505 HG3 GLU 59 HG3 GLU 59 1.553 8.592 -2.869 506 H LEU 60 H LEU 60 0.086 5.440 0.713 507 HA LEU 60 HA LEU 60 -2.314 3.968 0.136 508 HB2 LEU 60 HB2 LEU 60 0.099 3.504 1.894 509 HB3 LEU 60 HB3 LEU 60 -1.336 2.517 2.141 510 HG LEU 60 HG LEU 60 -1.318 1.803 -0.219 511 HD11 LEU 60 HD11 LEU 60 1.324 3.312 -0.356 512 HD12 LEU 60 HD12 LEU 60 0.751 2.141 -1.563 513 HD13 LEU 60 HD13 LEU 60 -0.141 3.647 -1.303 514 HD21 LEU 60 HD21 LEU 60 -0.228 0.450 1.527 515 HD22 LEU 60 HD22 LEU 60 0.633 0.310 -0.015 516 HD23 LEU 60 HD23 LEU 60 1.291 1.339 1.276 517 H SER 61 H SER 61 -1.330 5.631 3.202 518 HA SER 61 HA SER 61 -3.649 4.840 4.639 519 HB2 SER 61 HB2 SER 61 -3.001 6.583 6.250 520 HB3 SER 61 HB3 SER 61 -1.641 5.551 5.769 521 HG SER 61 HG SER 61 -0.953 7.649 5.695 522 H LYS 62 H LYS 62 -3.216 7.323 2.270 523 HA LYS 62 HA LYS 62 -5.635 8.887 2.974 524 HB2 LYS 62 HB2 LYS 62 -3.652 8.937 0.667 525 HB3 LYS 62 HB3 LYS 62 -5.109 9.928 0.670 526 HG2 LYS 62 HG2 LYS 62 -4.416 11.218 2.527 527 HG3 LYS 62 HG3 LYS 62 -3.177 10.062 3.001 528 HD2 LYS 62 HD2 LYS 62 -2.118 11.996 1.997 529 HD3 LYS 62 HD3 LYS 62 -1.862 10.588 0.958 530 HE2 LYS 62 HE2 LYS 62 -3.773 11.356 -0.485 531 HE3 LYS 62 HE3 LYS 62 -3.940 12.791 0.537 532 HZ1 LYS 62 HZ1 LYS 62 -1.512 12.054 -1.021 533 HZ2 LYS 62 HZ2 LYS 62 -2.574 13.229 -1.437 534 HZ3 LYS 62 HZ3 LYS 62 -1.657 13.402 -0.096 535 H ARG 63 H ARG 63 -4.787 6.267 0.824 536 HA ARG 63 HA ARG 63 -7.363 6.435 -0.658 537 HB2 ARG 63 HB2 ARG 63 -4.747 4.985 -1.131 538 HB3 ARG 63 HB3 ARG 63 -6.143 4.866 -2.210 539 HG2 ARG 63 HG2 ARG 63 -4.910 7.564 -1.539 540 HG3 ARG 63 HG3 ARG 63 -4.197 6.526 -2.759 541 HD2 ARG 63 HD2 ARG 63 -7.134 7.305 -2.858 542 HD3 ARG 63 HD3 ARG 63 -5.880 8.346 -3.515 543 HE ARG 63 HE ARG 63 -6.874 5.858 -4.663 544 HH11 ARG 63 HH11 ARG 63 -6.115 5.176 -6.648 545 HH12 ARG 63 HH12 ARG 63 -4.690 5.905 -7.325 546 HH21 ARG 63 HH21 ARG 63 -4.141 8.059 -4.726 547 HH22 ARG 63 HH22 ARG 63 -3.607 7.493 -6.282 548 H LEU 64 H LEU 64 -5.558 4.011 1.277 549 HA LEU 64 HA LEU 64 -7.844 2.141 1.247 550 HB2 LEU 64 HB2 LEU 64 -5.019 2.077 2.241 551 HB3 LEU 64 HB3 LEU 64 -6.191 1.250 3.247 552 HG LEU 64 HG LEU 64 -6.955 -0.103 1.346 553 HD11 LEU 64 HD11 LEU 64 -4.637 1.196 -0.145 554 HD12 LEU 64 HD12 LEU 64 -5.599 -0.190 -0.707 555 HD13 LEU 64 HD13 LEU 64 -6.365 1.387 -0.520 556 HD21 LEU 64 HD21 LEU 64 -5.198 -0.937 2.863 557 HD22 LEU 64 HD22 LEU 64 -4.956 -1.532 1.216 558 HD23 LEU 64 HD23 LEU 64 -3.948 -0.204 1.832 559 H ASN 65 H ASN 65 -6.900 4.874 3.162 560 HA ASN 65 HA ASN 65 -7.737 5.828 5.031 561 HB2 ASN 65 HB2 ASN 65 -9.884 5.559 3.733 562 HB3 ASN 65 HB3 ASN 65 -10.239 4.144 4.722 563 HD21 ASN 65 HD21 ASN 65 -10.857 6.121 7.692 564 HD22 ASN 65 HD22 ASN 65 -10.146 4.583 7.182 565 H ILE 66 H ILE 66 -5.875 4.452 5.641 566 HA ILE 66 HA ILE 66 -6.433 2.857 8.099 567 HB ILE 66 HB ILE 66 -4.254 1.657 7.613 568 HG12 ILE 66 HG12 ILE 66 -4.648 2.790 4.809 569 HG13 ILE 66 HG13 ILE 66 -3.315 3.128 5.926 570 HG21 ILE 66 HG21 ILE 66 -6.513 1.085 5.669 571 HG22 ILE 66 HG22 ILE 66 -5.302 -0.063 6.298 572 HG23 ILE 66 HG23 ILE 66 -6.492 0.638 7.390 573 HD11 ILE 66 HD11 ILE 66 -3.890 0.472 4.567 574 HD12 ILE 66 HD12 ILE 66 -2.631 1.638 4.156 575 HD13 ILE 66 HD13 ILE 66 -2.565 0.784 5.720 576 H THR 67 H THR 67 -4.559 3.008 9.673 577 HA THR 67 HA THR 67 -3.459 5.728 9.785 578 HB THR 67 HB THR 67 -4.060 4.586 11.854 579 HG1 THR 67 HG1 THR 67 -2.231 5.251 12.916 580 HG21 THR 67 HG21 THR 67 -1.613 2.823 11.403 581 HG22 THR 67 HG22 THR 67 -2.659 2.862 12.831 582 HG23 THR 67 HG23 THR 67 -3.300 2.259 11.298 583 H VAL 68 H VAL 68 -1.194 6.232 9.762 584 HA VAL 68 HA VAL 68 0.112 5.296 7.413 585 HB VAL 68 HB VAL 68 1.512 6.683 9.729 586 HG11 VAL 68 HG11 VAL 68 1.924 6.833 6.706 587 HG12 VAL 68 HG12 VAL 68 2.872 7.691 7.940 588 HG13 VAL 68 HG13 VAL 68 2.954 5.931 7.838 589 HG21 VAL 68 HG21 VAL 68 -0.506 8.006 9.298 590 HG22 VAL 68 HG22 VAL 68 0.900 8.839 8.641 591 HG23 VAL 68 HG23 VAL 68 -0.192 7.962 7.550 592 H ASP 69 H ASP 69 0.574 4.380 10.813 593 HA ASP 69 HA ASP 69 2.836 2.710 10.342 594 HB2 ASP 69 HB2 ASP 69 2.165 3.713 12.538 595 HB3 ASP 69 HB3 ASP 69 0.817 2.575 12.612 596 H LYS 70 H LYS 70 -0.604 1.995 9.997 597 HA LYS 70 HA LYS 70 -0.203 -0.899 9.729 598 HB2 LYS 70 HB2 LYS 70 -2.487 1.001 9.103 599 HB3 LYS 70 HB3 LYS 70 -2.452 -0.612 8.392 600 HG2 LYS 70 HG2 LYS 70 -2.251 -1.617 10.663 601 HG3 LYS 70 HG3 LYS 70 -2.439 -0.002 11.374 602 HD2 LYS 70 HD2 LYS 70 -4.660 0.222 10.273 603 HD3 LYS 70 HD3 LYS 70 -4.432 -1.353 9.487 604 HE2 LYS 70 HE2 LYS 70 -4.246 -2.397 11.779 605 HE3 LYS 70 HE3 LYS 70 -4.692 -0.833 12.478 606 HZ1 LYS 70 HZ1 LYS 70 -6.356 -2.428 10.580 607 HZ2 LYS 70 HZ2 LYS 70 -6.636 -2.267 12.184 608 HZ3 LYS 70 HZ3 LYS 70 -6.789 -0.976 11.195 609 H ALA 71 H ALA 71 -0.083 1.886 7.553 610 HA ALA 71 HA ALA 71 0.131 0.243 5.136 611 HB1 ALA 71 HB1 ALA 71 0.830 3.166 5.669 612 HB2 ALA 71 HB2 ALA 71 0.786 2.390 4.074 613 HB3 ALA 71 HB3 ALA 71 -0.697 2.569 5.035 614 H LYS 72 H LYS 72 2.475 1.959 7.200 615 HA LYS 72 HA LYS 72 4.911 1.239 5.937 616 HB2 LYS 72 HB2 LYS 72 4.175 1.827 8.819 617 HB3 LYS 72 HB3 LYS 72 5.846 1.535 8.314 618 HG2 LYS 72 HG2 LYS 72 5.861 3.471 6.901 619 HG3 LYS 72 HG3 LYS 72 4.124 3.704 7.114 620 HD2 LYS 72 HD2 LYS 72 5.466 5.299 8.435 621 HD3 LYS 72 HD3 LYS 72 4.354 4.323 9.408 622 HE2 LYS 72 HE2 LYS 72 6.140 2.896 10.183 623 HE3 LYS 72 HE3 LYS 72 7.299 3.637 9.064 624 HZ1 LYS 72 HZ1 LYS 72 5.985 5.046 11.331 625 HZ2 LYS 72 HZ2 LYS 72 7.528 4.518 11.320 626 HZ3 LYS 72 HZ3 LYS 72 7.078 5.714 10.309 627 H THR 73 H THR 73 3.018 -0.731 8.240 628 HA THR 73 HA THR 73 5.095 -2.870 8.034 629 HB THR 73 HB THR 73 4.019 -2.318 10.223 630 HG1 THR 73 HG1 THR 73 4.056 -4.482 10.773 631 HG21 THR 73 HG21 THR 73 1.702 -4.015 9.193 632 HG22 THR 73 HG22 THR 73 1.927 -3.356 10.825 633 HG23 THR 73 HG23 THR 73 1.621 -2.261 9.474 634 H TYR 74 H TYR 74 1.696 -2.412 6.947 635 HA TYR 74 HA TYR 74 1.338 -4.982 5.902 636 HB2 TYR 74 HB2 TYR 74 -0.488 -3.476 6.202 637 HB3 TYR 74 HB3 TYR 74 0.227 -2.293 5.098 638 HD1 TYR 74 HD1 TYR 74 -0.340 -2.243 2.871 639 HD2 TYR 74 HD2 TYR 74 -1.063 -5.834 5.158 640 HE1 TYR 74 HE1 TYR 74 -1.331 -3.291 0.897 641 HE2 TYR 74 HE2 TYR 74 -2.052 -6.915 3.130 642 HH TYR 74 HH TYR 74 -2.148 -5.267 -0.039 643 H ILE 75 H ILE 75 2.921 -2.202 4.333 644 HA ILE 75 HA ILE 75 3.326 -3.131 1.725 645 HB ILE 75 HB ILE 75 4.996 -1.460 3.621 646 HG12 ILE 75 HG12 ILE 75 3.600 -0.637 1.039 647 HG13 ILE 75 HG13 ILE 75 2.729 -0.713 2.554 648 HG21 ILE 75 HG21 ILE 75 5.669 -2.041 0.704 649 HG22 ILE 75 HG22 ILE 75 6.389 -0.735 1.666 650 HG23 ILE 75 HG23 ILE 75 6.673 -2.399 2.134 651 HD11 ILE 75 HD11 ILE 75 5.144 1.066 2.013 652 HD12 ILE 75 HD12 ILE 75 3.458 1.570 2.193 653 HD13 ILE 75 HD13 ILE 75 4.338 0.906 3.580 654 H LYS 76 H LYS 76 5.238 -4.049 4.616 655 HA LYS 76 HA LYS 76 6.749 -6.050 2.976 656 HB2 LYS 76 HB2 LYS 76 8.118 -6.320 5.063 657 HB3 LYS 76 HB3 LYS 76 8.202 -4.719 4.316 658 HG2 LYS 76 HG2 LYS 76 6.717 -3.789 6.016 659 HG3 LYS 76 HG3 LYS 76 6.486 -5.397 6.741 660 HD2 LYS 76 HD2 LYS 76 8.817 -5.529 7.362 661 HD3 LYS 76 HD3 LYS 76 9.203 -4.024 6.520 662 HE2 LYS 76 HE2 LYS 76 7.163 -4.165 8.784 663 HE3 LYS 76 HE3 LYS 76 8.889 -3.960 9.091 664 HZ1 LYS 76 HZ1 LYS 76 7.256 -2.066 7.459 665 HZ2 LYS 76 HZ2 LYS 76 7.782 -1.817 8.987 666 HZ3 LYS 76 HZ3 LYS 76 8.855 -1.930 7.771 667 H ASN 77 H ASN 77 4.234 -5.955 5.412 668 HA ASN 77 HA ASN 77 4.437 -8.691 6.177 669 HB2 ASN 77 HB2 ASN 77 3.184 -6.694 7.279 670 HB3 ASN 77 HB3 ASN 77 1.879 -7.053 6.136 671 HD21 ASN 77 HD21 ASN 77 2.672 -9.597 9.243 672 HD22 ASN 77 HD22 ASN 77 3.876 -8.405 8.765 673 H SER 78 H SER 78 2.736 -7.170 3.474 674 HA SER 78 HA SER 78 1.398 -9.650 2.657 675 HB2 SER 78 HB2 SER 78 0.425 -7.354 2.510 676 HB3 SER 78 HB3 SER 78 1.572 -6.985 1.214 677 HG SER 78 HG SER 78 -0.525 -7.738 0.499 678 H ASN 79 H ASN 79 4.218 -7.817 1.567 679 HA ASN 79 HA ASN 79 4.561 -9.622 -0.778 680 HB2 ASN 79 HB2 ASN 79 5.870 -6.943 -0.251 681 HB3 ASN 79 HB3 ASN 79 5.848 -7.842 -1.766 682 HD21 ASN 79 HD21 ASN 79 2.745 -5.439 -0.770 683 HD22 ASN 79 HD22 ASN 79 4.163 -5.638 0.267 684 H ARG 80 H ARG 80 6.292 -8.526 2.058 685 HA ARG 80 HA ARG 80 8.306 -8.801 2.876 686 HB2 ARG 80 HB2 ARG 80 6.908 -10.839 3.451 687 HB3 ARG 80 HB3 ARG 80 7.778 -11.735 2.214 688 HG2 ARG 80 HG2 ARG 80 8.634 -12.217 4.442 689 HG3 ARG 80 HG3 ARG 80 9.895 -11.437 3.487 690 HD2 ARG 80 HD2 ARG 80 9.526 -9.316 4.622 691 HD3 ARG 80 HD3 ARG 80 8.103 -9.963 5.466 692 HE ARG 80 HE ARG 80 10.114 -11.682 6.222 693 HH11 ARG 80 HH11 ARG 80 11.362 -11.513 8.048 694 HH12 ARG 80 HH12 ARG 80 11.662 -9.955 8.758 695 HH21 ARG 80 HH21 ARG 80 9.835 -8.197 6.453 696 HH22 ARG 80 HH22 ARG 80 10.834 -8.123 7.879 697 H MET 81 H MET 81 8.862 -7.715 0.790 698 HA MET 81 HA MET 81 10.311 -7.115 -0.825 699 HB2 MET 81 HB2 MET 81 12.131 -9.300 0.223 700 HB3 MET 81 HB3 MET 81 12.574 -8.041 -0.930 701 HG2 MET 81 HG2 MET 81 12.032 -6.300 0.745 702 HG3 MET 81 HG3 MET 81 11.634 -7.560 1.921 703 HE1 MET 81 HE1 MET 81 13.277 -6.382 3.644 704 HE2 MET 81 HE2 MET 81 14.983 -6.023 3.293 705 HE3 MET 81 HE3 MET 81 13.699 -5.154 2.425 706 H GLY 82 H GLY 82 9.877 -10.632 -0.836 707 HA2 GLY 82 HA2 GLY 82 8.658 -10.737 -3.390 708 HA3 GLY 82 HA3 GLY 82 10.372 -11.153 -3.594 709 H ARG 83 H ARG 83 8.171 -11.842 -0.874 710 HA ARG 83 HA ARG 83 7.999 -13.680 0.467 711 HB2 ARG 83 HB2 ARG 83 7.330 -14.887 -2.218 712 HB3 ARG 83 HB3 ARG 83 7.058 -15.676 -0.655 713 HG2 ARG 83 HG2 ARG 83 5.591 -13.866 0.087 714 HG3 ARG 83 HG3 ARG 83 5.868 -12.961 -1.418 715 HD2 ARG 83 HD2 ARG 83 4.819 -14.661 -2.740 716 HD3 ARG 83 HD3 ARG 83 4.762 -15.781 -1.379 717 HE ARG 83 HE ARG 83 3.141 -13.258 -1.632 718 HH11 ARG 83 HH11 ARG 83 1.163 -13.203 -0.650 719 HH12 ARG 83 HH12 ARG 83 0.582 -14.588 0.229 720 HH21 ARG 83 HH21 ARG 83 3.387 -16.487 -0.272 721 HH22 ARG 83 HH22 ARG 83 1.810 -16.391 0.456 722 H THR 84 H THR 84 10.393 -13.436 0.812 723 HA THR 84 HA THR 84 12.249 -14.485 1.557 724 HB THR 84 HB THR 84 11.897 -16.705 2.579 725 HG1 THR 84 HG1 THR 84 9.821 -17.534 2.632 726 HG21 THR 84 HG21 THR 84 9.742 -14.623 3.130 727 HG22 THR 84 HG22 THR 84 10.319 -15.868 4.262 728 HG23 THR 84 HG23 THR 84 11.410 -14.572 3.741 729 H ASN 85 H ASN 85 12.452 -14.214 -0.947 730 HA ASN 85 HA ASN 85 13.108 -16.635 -2.429 731 HB2 ASN 85 HB2 ASN 85 11.808 -14.857 -3.446 732 HB3 ASN 85 HB3 ASN 85 13.073 -13.671 -3.124 733 HD21 ASN 85 HD21 ASN 85 14.798 -14.438 -6.106 734 HD22 ASN 85 HD22 ASN 85 14.656 -13.394 -4.696 735 H ASN 86 H ASN 86 14.673 -14.647 -0.328 736 HA ASN 86 HA ASN 86 17.359 -14.321 -1.245 737 HB2 ASN 86 HB2 ASN 86 16.602 -12.911 0.462 738 HB3 ASN 86 HB3 ASN 86 15.747 -14.191 1.312 739 HD21 ASN 86 HD21 ASN 86 18.359 -15.072 3.410 740 HD22 ASN 86 HD22 ASN 86 16.726 -15.401 2.822 741 H PHE 87 H PHE 87 15.701 -17.138 -0.192 742 HA PHE 87 HA PHE 87 17.821 -18.571 1.069 743 HB2 PHE 87 HB2 PHE 87 16.235 -20.196 1.436 744 HB3 PHE 87 HB3 PHE 87 15.238 -18.753 1.281 745 HD1 PHE 87 HD1 PHE 87 14.495 -18.243 -1.305 746 HD2 PHE 87 HD2 PHE 87 15.489 -22.122 0.278 747 HE1 PHE 87 HE1 PHE 87 13.178 -19.281 -3.095 748 HE2 PHE 87 HE2 PHE 87 14.171 -23.187 -1.539 749 HZ PHE 87 HZ PHE 87 13.008 -21.779 -3.231 750 H LYS 88 H LYS 88 18.393 -17.723 -1.855 751 HA LYS 88 HA LYS 88 18.471 -20.130 -3.456 752 HB2 LYS 88 HB2 LYS 88 19.964 -17.509 -3.732 753 HB3 LYS 88 HB3 LYS 88 19.939 -18.771 -4.952 754 HG2 LYS 88 HG2 LYS 88 17.714 -18.446 -5.541 755 HG3 LYS 88 HG3 LYS 88 17.278 -17.697 -4.014 756 HD2 LYS 88 HD2 LYS 88 19.048 -16.400 -6.127 757 HD3 LYS 88 HD3 LYS 88 17.322 -16.071 -5.875 758 HE2 LYS 88 HE2 LYS 88 17.808 -15.385 -3.526 759 HE3 LYS 88 HE3 LYS 88 19.525 -15.647 -3.802 760 HZ1 LYS 88 HZ1 LYS 88 17.868 -13.665 -5.281 761 HZ2 LYS 88 HZ2 LYS 88 18.943 -13.301 -4.107 762 HZ3 LYS 88 HZ3 LYS 88 19.463 -13.916 -5.523 763 H THR 89 H THR 89 19.434 -21.644 -2.455 764 HA THR 89 HA THR 89 21.056 -23.182 -2.081 765 HB THR 89 HB THR 89 22.382 -21.383 -3.631 766 HG1 THR 89 HG1 THR 89 23.814 -23.111 -3.909 767 HG21 THR 89 HG21 THR 89 24.329 -22.027 -1.405 768 HG22 THR 89 HG22 THR 89 24.573 -21.016 -2.851 769 HG23 THR 89 HG23 THR 89 23.490 -20.469 -1.553 770 H ILE 90 H ILE 90 20.097 -20.844 -0.124 771 HA ILE 90 HA ILE 90 21.864 -21.654 2.147 772 HB ILE 90 HB ILE 90 20.388 -19.024 2.048 773 HG12 ILE 90 HG12 ILE 90 23.301 -19.430 1.205 774 HG13 ILE 90 HG13 ILE 90 21.974 -19.096 0.092 775 HG21 ILE 90 HG21 ILE 90 22.827 -19.990 3.625 776 HG22 ILE 90 HG22 ILE 90 22.051 -18.403 3.794 777 HG23 ILE 90 HG23 ILE 90 21.180 -19.831 4.273 778 HD11 ILE 90 HD11 ILE 90 22.995 -17.213 2.208 779 HD12 ILE 90 HD12 ILE 90 23.059 -17.046 0.444 780 HD13 ILE 90 HD13 ILE 90 21.491 -16.979 1.276 781 H LYS 91 H LYS 91 20.902 -21.960 4.140 782 HA LYS 91 HA LYS 91 19.455 -23.149 5.464 783 HB2 LYS 91 HB2 LYS 91 17.169 -21.609 4.196 784 HB3 LYS 91 HB3 LYS 91 17.231 -22.316 5.801 785 HG2 LYS 91 HG2 LYS 91 18.890 -19.937 4.852 786 HG3 LYS 91 HG3 LYS 91 17.429 -19.855 5.824 787 HD2 LYS 91 HD2 LYS 91 18.460 -20.875 7.711 788 HD3 LYS 91 HD3 LYS 91 19.841 -21.436 6.766 789 HE2 LYS 91 HE2 LYS 91 20.560 -19.609 8.132 790 HE3 LYS 91 HE3 LYS 91 20.644 -19.156 6.432 791 HZ1 LYS 91 HZ1 LYS 91 18.463 -18.364 8.300 792 HZ2 LYS 91 HZ2 LYS 91 19.672 -17.390 7.806 793 HZ3 LYS 91 HZ3 LYS 91 18.562 -17.910 6.732 794 H MET 92 H MET 92 19.852 -23.998 2.521 795 HA MET 92 HA MET 92 18.044 -26.373 2.666 796 HB2 MET 92 HB2 MET 92 17.723 -26.185 0.204 797 HB3 MET 92 HB3 MET 92 17.003 -24.860 1.103 798 HG2 MET 92 HG2 MET 92 18.449 -23.289 0.295 799 HG3 MET 92 HG3 MET 92 19.798 -24.406 0.124 800 HE1 MET 92 HE1 MET 92 19.199 -26.659 -1.707 801 HE2 MET 92 HE2 MET 92 19.525 -25.938 -3.299 802 HE3 MET 92 HE3 MET 92 20.551 -25.521 -1.906 803 H PHE 93 H PHE 93 21.129 -25.719 3.025 804 HA PHE 93 HA PHE 93 22.202 -27.858 1.227 805 HB2 PHE 93 HB2 PHE 93 22.193 -25.655 0.071 806 HB3 PHE 93 HB3 PHE 93 23.136 -24.977 1.394 807 HD1 PHE 93 HD1 PHE 93 23.274 -27.845 -1.055 808 HD2 PHE 93 HD2 PHE 93 25.436 -24.765 1.055 809 HE1 PHE 93 HE1 PHE 93 25.350 -28.466 -2.275 810 HE2 PHE 93 HE2 PHE 93 27.510 -25.388 -0.169 811 HZ PHE 93 HZ PHE 93 27.469 -27.238 -1.833 812 H GLU 94 H GLU 94 22.871 -25.723 4.050 813 HA GLU 94 HA GLU 94 25.477 -26.887 4.515 814 HB2 GLU 94 HB2 GLU 94 23.795 -25.171 6.375 815 HB3 GLU 94 HB3 GLU 94 25.512 -25.554 6.541 816 HG2 GLU 94 HG2 GLU 94 25.859 -24.453 4.251 817 HG3 GLU 94 HG3 GLU 94 24.199 -23.857 4.383 818 H ASP 95 H ASP 95 26.206 -28.228 6.150 819 HA ASP 95 HA ASP 95 24.222 -30.108 7.340 820 HB2 ASP 95 HB2 ASP 95 27.220 -30.324 6.890 821 HB3 ASP 95 HB3 ASP 95 26.245 -31.530 7.723 822 H ASP 96 H ASP 96 24.599 -30.906 9.529 823 HA ASP 96 HA ASP 96 25.174 -28.819 11.478 824 HB2 ASP 96 HB2 ASP 96 24.535 -31.780 11.731 825 HB3 ASP 96 HB3 ASP 96 24.876 -30.742 13.112 826 H VAL 97 H VAL 97 26.948 -28.459 12.635 827 HA VAL 97 HA VAL 97 29.304 -30.322 12.461 828 HB VAL 97 HB VAL 97 29.372 -27.283 12.514 829 HG11 VAL 97 HG11 VAL 97 31.619 -29.333 12.257 830 HG12 VAL 97 HG12 VAL 97 31.799 -27.576 12.053 831 HG13 VAL 97 HG13 VAL 97 31.353 -28.230 13.628 832 HG21 VAL 97 HG21 VAL 97 28.657 -28.072 10.298 833 HG22 VAL 97 HG22 VAL 97 30.320 -27.494 10.220 834 HG23 VAL 97 HG23 VAL 97 29.994 -29.242 10.258 835 H SER 98 H SER 98 27.577 -27.948 14.486 836 HA SER 98 HA SER 98 28.707 -29.251 16.919 837 HB2 SER 98 HB2 SER 98 29.721 -26.976 16.239 838 HB3 SER 98 HB3 SER 98 28.187 -26.276 16.781 839 HG SER 98 HG SER 98 29.791 -26.364 18.448 840 H SER 99 H SER 99 26.301 -29.902 15.635 841 HA SER 99 HA SER 99 24.074 -30.215 15.906 842 HB2 SER 99 HB2 SER 99 23.534 -31.264 18.050 843 HB3 SER 99 HB3 SER 99 25.056 -31.810 17.348 844 HG SER 99 HG SER 99 25.214 -31.416 19.608 845 H ALA 100 H ALA 100 24.362 -27.450 15.783 846 HA ALA 100 HA ALA 100 22.918 -26.111 17.877 847 HB1 ALA 100 HB1 ALA 100 23.594 -25.244 15.037 848 HB2 ALA 100 HB2 ALA 100 23.014 -24.189 16.345 849 HB3 ALA 100 HB3 ALA 100 24.591 -24.992 16.490 850 H SER 101 H SER 101 20.920 -26.820 18.303 851 HA SER 101 HA SER 101 18.729 -26.270 16.425 852 HB2 SER 101 HB2 SER 101 19.484 -28.632 15.939 853 HB3 SER 101 HB3 SER 101 19.045 -29.062 17.604 854 HG SER 101 HG SER 101 17.395 -29.396 15.911 855 H ALA 102 H ALA 102 16.586 -26.779 17.555 856 HA ALA 102 HA ALA 102 16.596 -25.350 20.109 857 HB1 ALA 102 HB1 ALA 102 14.323 -26.254 18.313 858 HB2 ALA 102 HB2 ALA 102 14.207 -25.109 19.669 859 HB3 ALA 102 HB3 ALA 102 15.152 -24.678 18.230 860 H GLN 103 H GLN 103 17.681 -27.848 20.387 861 HA GLN 103 HA GLN 103 17.644 -29.881 21.475 862 HB2 GLN 103 HB2 GLN 103 16.136 -27.992 23.265 863 HB3 GLN 103 HB3 GLN 103 16.626 -29.607 23.810 864 HG2 GLN 103 HG2 GLN 103 18.938 -29.129 23.616 865 HG3 GLN 103 HG3 GLN 103 18.670 -27.706 22.610 866 HE21 GLN 103 HE21 GLN 103 17.903 -25.513 25.321 867 HE22 GLN 103 HE22 GLN 103 17.647 -25.793 23.601 868 HA PRO 104 HA PRO 104 13.436 -31.232 20.025 869 HB2 PRO 104 HB2 PRO 104 14.039 -32.552 17.728 870 HB3 PRO 104 HB3 PRO 104 14.065 -30.769 17.817 871 HG2 PRO 104 HG2 PRO 104 16.432 -32.654 18.161 872 HG3 PRO 104 HG3 PRO 104 16.286 -31.274 17.025 873 HD2 PRO 104 HD2 PRO 104 17.473 -30.999 19.470 874 HD3 PRO 104 HD3 PRO 104 16.474 -29.698 18.763 875 H ASN 105 H ASN 105 14.590 -32.284 22.171 876 HA ASN 105 HA ASN 105 15.234 -35.134 21.905 877 HB2 ASN 105 HB2 ASN 105 15.074 -33.247 24.294 878 HB3 ASN 105 HB3 ASN 105 15.599 -34.927 24.379 879 HD21 ASN 105 HD21 ASN 105 18.793 -34.308 22.924 880 HD22 ASN 105 HD22 ASN 105 17.607 -35.553 23.285 881 H LEU 106 H LEU 106 12.995 -35.344 20.865 882 HA LEU 106 HA LEU 106 10.981 -36.205 22.920 883 HB2 LEU 106 HB2 LEU 106 10.505 -35.136 20.112 884 HB3 LEU 106 HB3 LEU 106 9.308 -35.922 21.129 885 HG LEU 106 HG LEU 106 9.824 -34.066 22.886 886 HD11 LEU 106 HD11 LEU 106 10.814 -32.720 20.323 887 HD12 LEU 106 HD12 LEU 106 10.377 -31.868 21.820 888 HD13 LEU 106 HD13 LEU 106 11.746 -32.966 21.817 889 HD21 LEU 106 HD21 LEU 106 7.700 -34.315 21.672 890 HD22 LEU 106 HD22 LEU 106 8.136 -32.609 21.822 891 HD23 LEU 106 HD23 LEU 106 8.377 -33.451 20.274 892 HA PRO 107 HA PRO 107 12.523 -40.012 20.704 893 HB2 PRO 107 HB2 PRO 107 12.902 -41.621 22.878 894 HB3 PRO 107 HB3 PRO 107 14.113 -40.425 22.321 895 HG2 PRO 107 HG2 PRO 107 12.043 -40.091 24.520 896 HG3 PRO 107 HG3 PRO 107 13.797 -39.727 24.586 897 HD2 PRO 107 HD2 PRO 107 11.951 -37.795 24.085 898 HD3 PRO 107 HD3 PRO 107 13.545 -37.793 23.270 Start of MODEL 27 1 H1 GLY -5 H1 GLY -5 -26.065 -17.175 11.173 2 H2 GLY -5 H2 GLY -5 -27.253 -16.092 11.490 3 H3 GLY -5 H3 GLY -5 -26.941 -16.537 9.944 4 HA2 GLY -5 HA2 GLY -5 -28.943 -17.620 10.692 5 HA3 GLY -5 HA3 GLY -5 -27.652 -18.795 10.384 6 H SER -4 H SER -4 -28.320 -20.356 11.819 7 HA SER -4 HA SER -4 -27.947 -19.823 14.719 8 HB2 SER -4 HB2 SER -4 -29.932 -21.224 15.224 9 HB3 SER -4 HB3 SER -4 -30.341 -19.700 14.416 10 HG SER -4 HG SER -4 -31.474 -21.472 13.509 11 H HIS -3 H HIS -3 -27.702 -21.831 15.987 12 HA HIS -3 HA HIS -3 -26.777 -24.218 14.473 13 HB2 HIS -3 HB2 HIS -3 -24.837 -22.635 14.957 14 HB3 HIS -3 HB3 HIS -3 -25.093 -22.969 16.668 15 HD2 HIS -3 HD2 HIS -3 -24.345 -25.421 17.551 16 HE1 HIS -3 HE1 HIS -3 -22.571 -26.785 13.915 17 HE2 HIS -3 HE2 HIS -3 -22.844 -27.263 16.401 18 H MET -2 H MET -2 -27.473 -26.022 15.290 19 HA MET -2 HA MET -2 -28.344 -26.229 18.150 20 HB2 MET -2 HB2 MET -2 -29.777 -27.215 15.652 21 HB3 MET -2 HB3 MET -2 -30.188 -27.716 17.291 22 HG2 MET -2 HG2 MET -2 -30.239 -24.839 16.305 23 HG3 MET -2 HG3 MET -2 -31.636 -25.899 16.344 24 HE1 MET -2 HE1 MET -2 -31.769 -27.406 19.012 25 HE2 MET -2 HE2 MET -2 -32.593 -26.223 20.046 26 HE3 MET -2 HE3 MET -2 -33.093 -26.418 18.354 27 H ALA -1 H ALA -1 -26.798 -27.454 18.996 28 HA ALA -1 HA ALA -1 -26.368 -30.201 17.927 29 HB1 ALA -1 HB1 ALA -1 -24.110 -28.264 18.582 30 HB2 ALA -1 HB2 ALA -1 -23.926 -29.997 18.223 31 HB3 ALA -1 HB3 ALA -1 -24.547 -28.899 16.981 32 H SER 0 H SER 0 -25.157 -28.156 20.620 33 HA SER 0 HA SER 0 -24.901 -28.492 22.826 34 HB2 SER 0 HB2 SER 0 -27.597 -29.841 22.576 35 HB3 SER 0 HB3 SER 0 -26.904 -29.134 24.049 36 HG SER 0 HG SER 0 -28.330 -27.683 22.983 37 H MET 1 H MET 1 -24.109 -30.966 21.089 38 HA MET 1 HA MET 1 -23.472 -32.754 23.385 39 HB2 MET 1 HB2 MET 1 -24.682 -33.637 20.728 40 HB3 MET 1 HB3 MET 1 -24.059 -34.735 21.963 41 HG2 MET 1 HG2 MET 1 -25.723 -33.834 23.580 42 HG3 MET 1 HG3 MET 1 -26.430 -32.863 22.288 43 HE1 MET 1 HE1 MET 1 -26.445 -34.794 19.727 44 HE2 MET 1 HE2 MET 1 -28.063 -35.493 19.928 45 HE3 MET 1 HE3 MET 1 -27.793 -33.772 20.277 46 H ASP 2 H ASP 2 -22.432 -31.368 20.498 47 HA ASP 2 HA ASP 2 -19.835 -32.870 20.579 48 HB2 ASP 2 HB2 ASP 2 -21.095 -31.188 18.381 49 HB3 ASP 2 HB3 ASP 2 -19.488 -31.905 18.300 50 H GLN 3 H GLN 3 -21.089 -30.251 21.996 51 HA GLN 3 HA GLN 3 -18.647 -28.576 21.953 52 HB2 GLN 3 HB2 GLN 3 -20.077 -27.979 19.985 53 HB3 GLN 3 HB3 GLN 3 -21.407 -27.643 21.076 54 HG2 GLN 3 HG2 GLN 3 -19.251 -26.055 22.052 55 HG3 GLN 3 HG3 GLN 3 -19.096 -25.983 20.302 56 HE21 GLN 3 HE21 GLN 3 -22.565 -24.516 22.056 57 HE22 GLN 3 HE22 GLN 3 -21.685 -25.856 22.809 58 H LEU 4 H LEU 4 -19.178 -29.950 24.124 59 HA LEU 4 HA LEU 4 -19.978 -27.859 26.057 60 HB2 LEU 4 HB2 LEU 4 -21.204 -29.310 27.457 61 HB3 LEU 4 HB3 LEU 4 -21.936 -29.354 25.870 62 HG LEU 4 HG LEU 4 -20.004 -31.535 26.803 63 HD11 LEU 4 HD11 LEU 4 -23.024 -31.435 27.174 64 HD12 LEU 4 HD12 LEU 4 -21.971 -32.831 27.502 65 HD13 LEU 4 HD13 LEU 4 -21.801 -31.359 28.466 66 HD21 LEU 4 HD21 LEU 4 -20.509 -31.613 24.399 67 HD22 LEU 4 HD22 LEU 4 -21.358 -32.923 25.212 68 HD23 LEU 4 HD23 LEU 4 -22.249 -31.456 24.743 69 H ASP 5 H ASP 5 -19.257 -28.318 28.275 70 HA ASP 5 HA ASP 5 -17.588 -28.502 29.760 71 HB2 ASP 5 HB2 ASP 5 -18.579 -30.774 29.677 72 HB3 ASP 5 HB3 ASP 5 -17.276 -31.285 28.607 73 H GLU 6 H GLU 6 -16.732 -27.051 27.676 74 HA GLU 6 HA GLU 6 -13.873 -27.788 27.209 75 HB2 GLU 6 HB2 GLU 6 -14.087 -26.676 25.047 76 HB3 GLU 6 HB3 GLU 6 -15.229 -28.001 25.231 77 HG2 GLU 6 HG2 GLU 6 -17.066 -26.413 25.684 78 HG3 GLU 6 HG3 GLU 6 -15.938 -25.059 25.624 79 H ILE 7 H ILE 7 -15.139 -25.988 29.377 80 HA ILE 7 HA ILE 7 -14.208 -23.315 28.701 81 HB ILE 7 HB ILE 7 -15.255 -24.150 31.421 82 HG12 ILE 7 HG12 ILE 7 -17.449 -23.044 30.333 83 HG13 ILE 7 HG13 ILE 7 -16.798 -23.733 28.854 84 HG21 ILE 7 HG21 ILE 7 -15.319 -21.519 29.865 85 HG22 ILE 7 HG22 ILE 7 -15.921 -21.784 31.515 86 HG23 ILE 7 HG23 ILE 7 -14.195 -21.897 31.187 87 HD11 ILE 7 HD11 ILE 7 -17.477 -25.219 31.443 88 HD12 ILE 7 HD12 ILE 7 -18.419 -25.237 29.941 89 HD13 ILE 7 HD13 ILE 7 -16.823 -26.001 29.992 90 H ILE 8 H ILE 8 -12.022 -24.261 28.308 91 HA ILE 8 HA ILE 8 -10.275 -23.748 30.671 92 HB ILE 8 HB ILE 8 -10.734 -26.196 30.316 93 HG12 ILE 8 HG12 ILE 8 -8.473 -27.040 30.544 94 HG13 ILE 8 HG13 ILE 8 -7.788 -25.510 30.012 95 HG21 ILE 8 HG21 ILE 8 -9.043 -25.922 27.799 96 HG22 ILE 8 HG22 ILE 8 -9.701 -27.414 28.494 97 HG23 ILE 8 HG23 ILE 8 -10.800 -26.203 27.833 98 HD11 ILE 8 HD11 ILE 8 -9.534 -25.863 32.496 99 HD12 ILE 8 HD12 ILE 8 -7.760 -25.853 32.497 100 HD13 ILE 8 HD13 ILE 8 -8.643 -24.391 32.029 101 H GLU 9 H GLU 9 -10.897 -22.977 27.446 102 HA GLU 9 HA GLU 9 -8.076 -22.663 26.652 103 HB2 GLU 9 HB2 GLU 9 -10.617 -22.482 25.004 104 HB3 GLU 9 HB3 GLU 9 -8.955 -22.447 24.391 105 HG2 GLU 9 HG2 GLU 9 -8.601 -24.728 25.432 106 HG3 GLU 9 HG3 GLU 9 -10.336 -24.780 25.765 107 H GLN 10 H GLN 10 -8.522 -20.759 28.523 108 HA GLN 10 HA GLN 10 -8.329 -18.265 26.887 109 HB2 GLN 10 HB2 GLN 10 -10.642 -18.495 27.808 110 HB3 GLN 10 HB3 GLN 10 -9.963 -18.417 29.442 111 HG2 GLN 10 HG2 GLN 10 -9.077 -16.152 28.981 112 HG3 GLN 10 HG3 GLN 10 -9.615 -16.260 27.302 113 HE21 GLN 10 HE21 GLN 10 -13.052 -15.560 28.093 114 HE22 GLN 10 HE22 GLN 10 -11.994 -16.275 26.884 115 H ILE 11 H ILE 11 -7.717 -19.622 30.186 116 HA ILE 11 HA ILE 11 -5.238 -18.000 30.298 117 HB ILE 11 HB ILE 11 -5.670 -17.689 32.764 118 HG12 ILE 11 HG12 ILE 11 -8.606 -18.027 31.989 119 HG13 ILE 11 HG13 ILE 11 -7.689 -19.193 32.944 120 HG21 ILE 11 HG21 ILE 11 -7.426 -16.115 30.837 121 HG22 ILE 11 HG22 ILE 11 -6.728 -15.540 32.365 122 HG23 ILE 11 HG23 ILE 11 -5.671 -15.912 31.008 123 HD11 ILE 11 HD11 ILE 11 -8.352 -16.337 33.751 124 HD12 ILE 11 HD12 ILE 11 -8.982 -17.836 34.444 125 HD13 ILE 11 HD13 ILE 11 -7.271 -17.419 34.665 126 H GLN 12 H GLN 12 -3.658 -19.205 30.359 127 HA GLN 12 HA GLN 12 -3.209 -21.450 32.141 128 HB2 GLN 12 HB2 GLN 12 -2.632 -22.940 30.038 129 HB3 GLN 12 HB3 GLN 12 -4.244 -22.884 30.699 130 HG2 GLN 12 HG2 GLN 12 -4.214 -22.874 28.231 131 HG3 GLN 12 HG3 GLN 12 -5.082 -21.524 28.930 132 HE21 GLN 12 HE21 GLN 12 -3.257 -19.333 26.821 133 HE22 GLN 12 HE22 GLN 12 -4.819 -19.828 27.468 134 H LYS 13 H LYS 13 -0.912 -22.480 31.197 135 HA LYS 13 HA LYS 13 1.003 -20.322 31.480 136 HB2 LYS 13 HB2 LYS 13 1.271 -23.299 30.943 137 HB3 LYS 13 HB3 LYS 13 2.661 -22.208 30.950 138 HG2 LYS 13 HG2 LYS 13 2.132 -21.483 33.248 139 HG3 LYS 13 HG3 LYS 13 0.761 -22.612 33.294 140 HD2 LYS 13 HD2 LYS 13 2.266 -24.529 33.055 141 HD3 LYS 13 HD3 LYS 13 3.636 -23.465 32.728 142 HE2 LYS 13 HE2 LYS 13 3.861 -24.246 34.971 143 HE3 LYS 13 HE3 LYS 13 3.494 -22.523 35.011 144 HZ1 LYS 13 HZ1 LYS 13 1.519 -24.697 35.487 145 HZ2 LYS 13 HZ2 LYS 13 2.195 -23.773 36.646 146 HZ3 LYS 13 HZ3 LYS 13 1.186 -23.095 35.561 147 H GLU 14 H GLU 14 0.743 -18.866 29.876 148 HA GLU 14 HA GLU 14 2.383 -19.482 27.518 149 HB2 GLU 14 HB2 GLU 14 1.058 -18.082 26.049 150 HB3 GLU 14 HB3 GLU 14 0.142 -19.482 26.593 151 HG2 GLU 14 HG2 GLU 14 -1.134 -18.093 28.169 152 HG3 GLU 14 HG3 GLU 14 -0.140 -16.685 27.785 153 H ALA 15 H ALA 15 3.601 -17.778 26.813 154 HA ALA 15 HA ALA 15 3.883 -15.363 28.547 155 HB1 ALA 15 HB1 ALA 15 6.137 -17.286 27.849 156 HB2 ALA 15 HB2 ALA 15 6.243 -15.853 28.890 157 HB3 ALA 15 HB3 ALA 15 5.293 -17.253 29.419 158 H ILE 16 H ILE 16 2.904 -15.647 25.803 159 HA ILE 16 HA ILE 16 3.209 -15.165 23.643 160 HB ILE 16 HB ILE 16 4.933 -12.921 24.671 161 HG12 ILE 16 HG12 ILE 16 1.888 -12.904 24.418 162 HG13 ILE 16 HG13 ILE 16 2.764 -13.021 25.945 163 HG21 ILE 16 HG21 ILE 16 3.048 -12.810 22.284 164 HG22 ILE 16 HG22 ILE 16 4.278 -11.618 22.747 165 HG23 ILE 16 HG23 ILE 16 4.767 -13.183 22.127 166 HD11 ILE 16 HD11 ILE 16 2.742 -10.609 24.105 167 HD12 ILE 16 HD12 ILE 16 2.047 -10.766 25.723 168 HD13 ILE 16 HD13 ILE 16 3.809 -10.794 25.521 169 H ASN 17 H ASN 17 4.414 -17.168 24.090 170 HA ASN 17 HA ASN 17 7.204 -17.203 23.064 171 HB2 ASN 17 HB2 ASN 17 7.334 -19.250 24.546 172 HB3 ASN 17 HB3 ASN 17 7.085 -17.733 25.394 173 HD21 ASN 17 HD21 ASN 17 4.868 -20.011 27.090 174 HD22 ASN 17 HD22 ASN 17 6.592 -19.704 26.935 175 H SER 18 H SER 18 4.108 -17.937 22.204 176 HA SER 18 HA SER 18 4.911 -20.239 20.410 177 HB2 SER 18 HB2 SER 18 2.191 -19.626 21.613 178 HB3 SER 18 HB3 SER 18 2.526 -20.899 20.424 179 HG SER 18 HG SER 18 2.568 -21.703 22.568 180 H ASN 19 H ASN 19 2.972 -17.234 20.510 181 HA ASN 19 HA ASN 19 2.262 -17.374 17.700 182 HB2 ASN 19 HB2 ASN 19 1.190 -15.202 18.164 183 HB3 ASN 19 HB3 ASN 19 0.735 -16.406 19.363 184 HD21 ASN 19 HD21 ASN 19 1.504 -13.183 21.083 185 HD22 ASN 19 HD22 ASN 19 0.439 -13.606 19.750 186 H VAL 20 H VAL 20 4.898 -16.049 19.419 187 HA VAL 20 HA VAL 20 5.887 -14.387 17.163 188 HB VAL 20 HB VAL 20 6.963 -14.969 19.942 189 HG11 VAL 20 HG11 VAL 20 8.168 -13.162 17.798 190 HG12 VAL 20 HG12 VAL 20 8.633 -13.173 19.514 191 HG13 VAL 20 HG13 VAL 20 8.927 -14.600 18.523 192 HG21 VAL 20 HG21 VAL 20 4.998 -13.440 19.792 193 HG22 VAL 20 HG22 VAL 20 6.456 -12.593 20.323 194 HG23 VAL 20 HG23 VAL 20 5.889 -12.420 18.647 195 H VAL 21 H VAL 21 6.475 -17.567 18.576 196 HA VAL 21 HA VAL 21 8.819 -18.046 16.842 197 HB VAL 21 HB VAL 21 7.670 -19.920 18.931 198 HG11 VAL 21 HG11 VAL 21 10.433 -19.706 17.624 199 HG12 VAL 21 HG12 VAL 21 9.969 -20.855 18.896 200 HG13 VAL 21 HG13 VAL 21 9.242 -20.980 17.297 201 HG21 VAL 21 HG21 VAL 21 8.317 -17.830 20.064 202 HG22 VAL 21 HG22 VAL 21 9.512 -19.080 20.390 203 HG23 VAL 21 HG23 VAL 21 9.868 -17.813 19.195 204 H LEU 22 H LEU 22 7.140 -17.620 15.114 205 HA LEU 22 HA LEU 22 6.163 -20.230 14.027 206 HB2 LEU 22 HB2 LEU 22 4.928 -17.459 13.869 207 HB3 LEU 22 HB3 LEU 22 4.521 -18.724 12.713 208 HG LEU 22 HG LEU 22 4.091 -18.925 15.720 209 HD11 LEU 22 HD11 LEU 22 2.123 -18.464 13.436 210 HD12 LEU 22 HD12 LEU 22 1.707 -18.669 15.154 211 HD13 LEU 22 HD13 LEU 22 2.632 -17.253 14.632 212 HD21 LEU 22 HD21 LEU 22 4.351 -21.166 14.745 213 HD22 LEU 22 HD22 LEU 22 2.648 -20.878 15.088 214 HD23 LEU 22 HD23 LEU 22 3.241 -20.749 13.417 215 H LYS 23 H LYS 23 6.549 -20.699 11.930 216 HA LYS 23 HA LYS 23 8.435 -18.983 10.407 217 HB2 LYS 23 HB2 LYS 23 9.314 -21.031 11.690 218 HB3 LYS 23 HB3 LYS 23 8.434 -22.026 10.521 219 HG2 LYS 23 HG2 LYS 23 9.713 -20.918 8.687 220 HG3 LYS 23 HG3 LYS 23 10.544 -19.923 9.895 221 HD2 LYS 23 HD2 LYS 23 11.535 -21.956 10.904 222 HD3 LYS 23 HD3 LYS 23 10.666 -22.972 9.731 223 HE2 LYS 23 HE2 LYS 23 11.857 -21.837 7.869 224 HE3 LYS 23 HE3 LYS 23 12.721 -20.823 9.031 225 HZ1 LYS 23 HZ1 LYS 23 12.929 -23.785 8.875 226 HZ2 LYS 23 HZ2 LYS 23 14.060 -22.733 8.351 227 HZ3 LYS 23 HZ3 LYS 23 13.731 -22.846 9.945 228 H ASN 24 H ASN 24 5.893 -18.504 9.933 229 HA ASN 24 HA ASN 24 4.169 -18.439 8.441 230 HB2 ASN 24 HB2 ASN 24 6.107 -17.328 7.380 231 HB3 ASN 24 HB3 ASN 24 6.457 -18.807 6.486 232 HD21 ASN 24 HD21 ASN 24 3.716 -18.354 4.211 233 HD22 ASN 24 HD22 ASN 24 4.669 -19.602 5.034 234 HA PRO 25 HA PRO 25 3.828 -23.044 8.041 235 HB2 PRO 25 HB2 PRO 25 1.534 -23.481 9.454 236 HB3 PRO 25 HB3 PRO 25 3.117 -23.176 10.223 237 HG2 PRO 25 HG2 PRO 25 0.915 -21.153 9.678 238 HG3 PRO 25 HG3 PRO 25 1.778 -21.460 11.220 239 HD2 PRO 25 HD2 PRO 25 2.534 -19.470 9.536 240 HD3 PRO 25 HD3 PRO 25 3.750 -20.432 10.430 241 H ARG 26 H ARG 26 3.612 -22.598 5.794 242 HA ARG 26 HA ARG 26 2.628 -22.609 3.733 243 HB2 ARG 26 HB2 ARG 26 1.276 -24.726 5.363 244 HB3 ARG 26 HB3 ARG 26 0.589 -24.432 3.780 245 HG2 ARG 26 HG2 ARG 26 3.566 -24.874 4.151 246 HG3 ARG 26 HG3 ARG 26 2.413 -26.208 3.934 247 HD2 ARG 26 HD2 ARG 26 1.642 -25.218 1.800 248 HD3 ARG 26 HD3 ARG 26 2.816 -23.902 1.976 249 HE ARG 26 HE ARG 26 4.231 -26.358 2.137 250 HH11 ARG 26 HH11 ARG 26 5.378 -27.189 0.414 251 HH12 ARG 26 HH12 ARG 26 5.000 -26.683 -1.207 252 HH21 ARG 26 HH21 ARG 26 2.473 -24.551 -0.302 253 HH22 ARG 26 HH22 ARG 26 3.402 -25.231 -1.609 254 H VAL 27 H VAL 27 1.870 -20.433 5.117 255 HA VAL 27 HA VAL 27 0.476 -18.702 5.416 256 HB VAL 27 HB VAL 27 -0.444 -19.535 2.693 257 HG11 VAL 27 HG11 VAL 27 -0.888 -16.904 4.205 258 HG12 VAL 27 HG12 VAL 27 -1.198 -17.138 2.470 259 HG13 VAL 27 HG13 VAL 27 -2.159 -18.013 3.661 260 HG21 VAL 27 HG21 VAL 27 1.939 -18.982 2.810 261 HG22 VAL 27 HG22 VAL 27 1.062 -17.712 1.957 262 HG23 VAL 27 HG23 VAL 27 1.561 -17.448 3.641 263 HA PRO 28 HA PRO 28 -3.156 -20.824 7.161 264 HB2 PRO 28 HB2 PRO 28 -3.526 -19.292 9.357 265 HB3 PRO 28 HB3 PRO 28 -2.216 -20.501 9.243 266 HG2 PRO 28 HG2 PRO 28 -2.023 -17.514 8.717 267 HG3 PRO 28 HG3 PRO 28 -0.967 -18.520 9.763 268 HD2 PRO 28 HD2 PRO 28 -0.312 -17.898 7.194 269 HD3 PRO 28 HD3 PRO 28 0.109 -19.491 7.897 270 H THR 29 H THR 29 -5.350 -20.003 7.784 271 HA THR 29 HA THR 29 -6.384 -18.734 5.459 272 HB THR 29 HB THR 29 -8.591 -19.417 6.542 273 HG1 THR 29 HG1 THR 29 -8.392 -20.671 8.401 274 HG21 THR 29 HG21 THR 29 -6.448 -21.581 6.416 275 HG22 THR 29 HG22 THR 29 -8.207 -21.807 6.298 276 HG23 THR 29 HG23 THR 29 -7.343 -20.932 5.024 277 H GLN 30 H GLN 30 -5.052 -16.713 6.886 278 HA GLN 30 HA GLN 30 -7.308 -14.835 7.457 279 HB2 GLN 30 HB2 GLN 30 -4.679 -15.080 8.960 280 HB3 GLN 30 HB3 GLN 30 -5.819 -13.746 9.146 281 HG2 GLN 30 HG2 GLN 30 -7.013 -14.893 10.636 282 HG3 GLN 30 HG3 GLN 30 -7.351 -16.155 9.463 283 HE21 GLN 30 HE21 GLN 30 -4.928 -18.415 10.813 284 HE22 GLN 30 HE22 GLN 30 -5.947 -18.078 9.420 285 H LYS 31 H LYS 31 -6.924 -14.710 5.055 286 HA LYS 31 HA LYS 31 -5.076 -12.438 4.446 287 HB2 LYS 31 HB2 LYS 31 -4.709 -14.893 3.493 288 HB3 LYS 31 HB3 LYS 31 -5.903 -14.418 2.310 289 HG2 LYS 31 HG2 LYS 31 -3.298 -12.898 2.878 290 HG3 LYS 31 HG3 LYS 31 -3.446 -14.216 1.736 291 HD2 LYS 31 HD2 LYS 31 -3.671 -12.564 0.229 292 HD3 LYS 31 HD3 LYS 31 -5.358 -12.729 0.658 293 HE2 LYS 31 HE2 LYS 31 -4.977 -10.413 0.657 294 HE3 LYS 31 HE3 LYS 31 -4.959 -10.828 2.370 295 HZ1 LYS 31 HZ1 LYS 31 -2.540 -10.461 0.667 296 HZ2 LYS 31 HZ2 LYS 31 -3.094 -9.369 1.738 297 HZ3 LYS 31 HZ3 LYS 31 -2.509 -10.802 2.265 298 H THR 32 H THR 32 -7.665 -12.164 5.483 299 HA THR 32 HA THR 32 -9.155 -10.776 3.304 300 HB THR 32 HB THR 32 -9.808 -13.163 3.432 301 HG1 THR 32 HG1 THR 32 -12.006 -12.795 3.442 302 HG21 THR 32 HG21 THR 32 -10.930 -12.493 6.183 303 HG22 THR 32 HG22 THR 32 -11.162 -14.005 5.281 304 HG23 THR 32 HG23 THR 32 -9.548 -13.561 5.848 305 H GLY 33 H GLY 33 -7.718 -10.059 5.985 306 HA2 GLY 33 HA2 GLY 33 -9.674 -9.381 7.927 307 HA3 GLY 33 HA3 GLY 33 -8.024 -8.767 7.857 308 H GLU 34 H GLU 34 -8.185 -7.305 5.418 309 HA GLU 34 HA GLU 34 -10.314 -5.267 5.801 310 HB2 GLU 34 HB2 GLU 34 -8.701 -3.451 6.095 311 HB3 GLU 34 HB3 GLU 34 -8.603 -4.638 7.386 312 HG2 GLU 34 HG2 GLU 34 -6.589 -5.656 6.248 313 HG3 GLU 34 HG3 GLU 34 -6.678 -4.374 5.040 314 H LEU 35 H LEU 35 -8.867 -7.095 3.523 315 HA LEU 35 HA LEU 35 -8.844 -5.034 1.405 316 HB2 LEU 35 HB2 LEU 35 -7.244 -7.516 1.942 317 HB3 LEU 35 HB3 LEU 35 -7.778 -7.269 0.286 318 HG LEU 35 HG LEU 35 -6.791 -5.043 0.238 319 HD11 LEU 35 HD11 LEU 35 -5.653 -5.712 2.978 320 HD12 LEU 35 HD12 LEU 35 -5.104 -4.375 1.945 321 HD13 LEU 35 HD13 LEU 35 -6.749 -4.367 2.582 322 HD21 LEU 35 HD21 LEU 35 -5.577 -7.080 -0.522 323 HD22 LEU 35 HD22 LEU 35 -4.519 -5.766 0.008 324 HD23 LEU 35 HD23 LEU 35 -4.804 -7.167 1.075 325 H SER 36 H SER 36 -10.675 -4.887 0.501 326 HA SER 36 HA SER 36 -12.362 -7.242 -0.185 327 HB2 SER 36 HB2 SER 36 -13.492 -5.366 0.935 328 HB3 SER 36 HB3 SER 36 -13.076 -4.326 -0.436 329 HG SER 36 HG SER 36 -15.174 -5.290 -0.621 330 H GLU 37 H GLU 37 -11.627 -4.319 -1.983 331 HA GLU 37 HA GLU 37 -10.564 -5.873 -4.238 332 HB2 GLU 37 HB2 GLU 37 -12.366 -5.640 -5.723 333 HB3 GLU 37 HB3 GLU 37 -13.051 -6.251 -4.206 334 HG2 GLU 37 HG2 GLU 37 -13.860 -3.957 -3.671 335 HG3 GLU 37 HG3 GLU 37 -13.272 -3.407 -5.247 336 H GLU 38 H GLU 38 -12.013 -2.781 -3.293 337 HA GLU 38 HA GLU 38 -10.450 -1.162 -5.075 338 HB2 GLU 38 HB2 GLU 38 -12.561 -0.485 -3.992 339 HB3 GLU 38 HB3 GLU 38 -11.740 -0.410 -2.429 340 HG2 GLU 38 HG2 GLU 38 -10.318 1.409 -3.201 341 HG3 GLU 38 HG3 GLU 38 -10.901 1.224 -4.859 342 H GLN 39 H GLN 39 -9.685 -2.578 -1.941 343 HA GLN 39 HA GLN 39 -7.644 -0.680 -1.220 344 HB2 GLN 39 HB2 GLN 39 -8.262 -3.476 -0.192 345 HB3 GLN 39 HB3 GLN 39 -7.162 -2.341 0.581 346 HG2 GLN 39 HG2 GLN 39 -9.214 -2.151 1.769 347 HG3 GLN 39 HG3 GLN 39 -9.107 -0.710 0.771 348 HE21 GLN 39 HE21 GLN 39 -12.419 -1.428 -0.250 349 HE22 GLN 39 HE22 GLN 39 -11.363 -0.312 0.631 350 H LYS 40 H LYS 40 -7.412 -3.992 -2.518 351 HA LYS 40 HA LYS 40 -4.549 -3.903 -2.969 352 HB2 LYS 40 HB2 LYS 40 -4.893 -5.971 -4.225 353 HB3 LYS 40 HB3 LYS 40 -5.755 -5.991 -2.690 354 HG2 LYS 40 HG2 LYS 40 -7.818 -5.189 -4.075 355 HG3 LYS 40 HG3 LYS 40 -6.875 -5.643 -5.490 356 HD2 LYS 40 HD2 LYS 40 -8.447 -7.388 -4.896 357 HD3 LYS 40 HD3 LYS 40 -6.809 -7.996 -4.610 358 HE2 LYS 40 HE2 LYS 40 -7.036 -7.777 -2.227 359 HE3 LYS 40 HE3 LYS 40 -8.466 -6.750 -2.367 360 HZ1 LYS 40 HZ1 LYS 40 -8.456 -9.589 -3.235 361 HZ2 LYS 40 HZ2 LYS 40 -8.954 -9.100 -1.756 362 HZ3 LYS 40 HZ3 LYS 40 -9.760 -8.596 -3.068 363 H LYS 41 H LYS 41 -7.305 -2.795 -4.890 364 HA LYS 41 HA LYS 41 -5.750 -2.110 -7.247 365 HB2 LYS 41 HB2 LYS 41 -8.436 -1.084 -6.267 366 HB3 LYS 41 HB3 LYS 41 -7.730 -0.678 -7.826 367 HG2 LYS 41 HG2 LYS 41 -7.865 -2.924 -8.619 368 HG3 LYS 41 HG3 LYS 41 -8.125 -3.544 -6.997 369 HD2 LYS 41 HD2 LYS 41 -10.237 -3.731 -7.763 370 HD3 LYS 41 HD3 LYS 41 -10.352 -2.148 -7.036 371 HE2 LYS 41 HE2 LYS 41 -10.090 -2.829 -9.985 372 HE3 LYS 41 HE3 LYS 41 -11.523 -2.249 -9.124 373 HZ1 LYS 41 HZ1 LYS 41 -9.052 -0.669 -9.598 374 HZ2 LYS 41 HZ2 LYS 41 -10.487 -0.443 -10.324 375 HZ3 LYS 41 HZ3 LYS 41 -10.343 -0.139 -8.731 376 H ILE 42 H ILE 42 -5.501 -0.815 -4.206 377 HA ILE 42 HA ILE 42 -4.260 1.691 -5.289 378 HB ILE 42 HB ILE 42 -5.181 0.933 -2.512 379 HG12 ILE 42 HG12 ILE 42 -6.091 3.434 -3.920 380 HG13 ILE 42 HG13 ILE 42 -6.690 1.931 -4.592 381 HG21 ILE 42 HG21 ILE 42 -3.713 3.460 -3.354 382 HG22 ILE 42 HG22 ILE 42 -4.508 3.188 -1.784 383 HG23 ILE 42 HG23 ILE 42 -3.118 2.209 -2.242 384 HD11 ILE 42 HD11 ILE 42 -7.025 2.798 -1.713 385 HD12 ILE 42 HD12 ILE 42 -8.277 2.660 -2.983 386 HD13 ILE 42 HD13 ILE 42 -7.473 1.209 -2.370 387 H VAL 43 H VAL 43 -3.589 -0.983 -2.911 388 HA VAL 43 HA VAL 43 -0.813 -0.228 -2.793 389 HB VAL 43 HB VAL 43 -2.010 -2.877 -1.902 390 HG11 VAL 43 HG11 VAL 43 0.611 -1.406 -1.306 391 HG12 VAL 43 HG12 VAL 43 0.031 -2.753 -0.330 392 HG13 VAL 43 HG13 VAL 43 0.425 -3.016 -2.028 393 HG21 VAL 43 HG21 VAL 43 -3.152 -1.024 -0.791 394 HG22 VAL 43 HG22 VAL 43 -2.079 -1.829 0.347 395 HG23 VAL 43 HG23 VAL 43 -1.598 -0.282 -0.363 396 H ALA 44 H ALA 44 -2.280 -3.173 -4.318 397 HA ALA 44 HA ALA 44 0.259 -3.990 -5.431 398 HB1 ALA 44 HB1 ALA 44 -2.547 -4.920 -6.131 399 HB2 ALA 44 HB2 ALA 44 -1.019 -5.742 -6.501 400 HB3 ALA 44 HB3 ALA 44 -1.533 -5.566 -4.813 401 H ASP 45 H ASP 45 -2.390 -1.976 -6.640 402 HA ASP 45 HA ASP 45 -1.402 -1.616 -9.316 403 HB2 ASP 45 HB2 ASP 45 -3.592 -0.817 -8.497 404 HB3 ASP 45 HB3 ASP 45 -2.776 0.378 -7.480 405 H TYR 46 H TYR 46 -0.468 0.117 -6.263 406 HA TYR 46 HA TYR 46 1.482 1.796 -7.502 407 HB2 TYR 46 HB2 TYR 46 0.349 1.673 -5.053 408 HB3 TYR 46 HB3 TYR 46 1.864 0.896 -4.666 409 HD1 TYR 46 HD1 TYR 46 0.384 3.750 -4.032 410 HD2 TYR 46 HD2 TYR 46 3.803 2.472 -6.290 411 HE1 TYR 46 HE1 TYR 46 1.454 5.962 -3.645 412 HE2 TYR 46 HE2 TYR 46 4.787 4.737 -6.114 413 HH TYR 46 HH TYR 46 3.171 7.409 -4.374 414 H ILE 47 H ILE 47 1.735 -1.531 -6.210 415 HA ILE 47 HA ILE 47 4.568 -1.818 -6.513 416 HB ILE 47 HB ILE 47 2.366 -3.909 -6.691 417 HG12 ILE 47 HG12 ILE 47 2.100 -3.059 -4.550 418 HG13 ILE 47 HG13 ILE 47 3.166 -4.399 -4.275 419 HG21 ILE 47 HG21 ILE 47 5.289 -4.420 -6.083 420 HG22 ILE 47 HG22 ILE 47 3.974 -5.601 -6.070 421 HG23 ILE 47 HG23 ILE 47 4.450 -4.854 -7.589 422 HD11 ILE 47 HD11 ILE 47 3.924 -1.441 -4.351 423 HD12 ILE 47 HD12 ILE 47 3.878 -2.515 -2.944 424 HD13 ILE 47 HD13 ILE 47 5.099 -2.774 -4.212 425 H SER 48 H SER 48 2.095 -1.684 -8.960 426 HA SER 48 HA SER 48 3.867 -2.662 -11.095 427 HB2 SER 48 HB2 SER 48 1.287 -2.895 -10.920 428 HB3 SER 48 HB3 SER 48 1.244 -1.219 -11.499 429 HG SER 48 HG SER 48 1.149 -2.780 -13.204 430 H GLU 49 H GLU 49 3.557 0.366 -9.443 431 HA GLU 49 HA GLU 49 4.182 2.019 -11.826 432 HB2 GLU 49 HB2 GLU 49 3.649 2.766 -8.928 433 HB3 GLU 49 HB3 GLU 49 3.967 3.908 -10.228 434 HG2 GLU 49 HG2 GLU 49 1.641 1.969 -10.217 435 HG3 GLU 49 HG3 GLU 49 1.564 3.598 -9.569 436 H VAL 50 H VAL 50 5.517 1.535 -8.554 437 HA VAL 50 HA VAL 50 8.117 2.631 -9.554 438 HB VAL 50 HB VAL 50 8.412 3.804 -7.515 439 HG11 VAL 50 HG11 VAL 50 5.529 4.243 -8.301 440 HG12 VAL 50 HG12 VAL 50 6.651 5.391 -7.547 441 HG13 VAL 50 HG13 VAL 50 6.936 4.845 -9.207 442 HG21 VAL 50 HG21 VAL 50 7.595 2.214 -5.874 443 HG22 VAL 50 HG22 VAL 50 6.768 3.759 -5.690 444 HG23 VAL 50 HG23 VAL 50 5.944 2.387 -6.478 445 H GLY 51 H GLY 51 6.854 -0.084 -7.824 446 HA2 GLY 51 HA2 GLY 51 8.462 -2.017 -8.210 447 HA3 GLY 51 HA3 GLY 51 9.617 -1.084 -7.254 448 H LEU 52 H LEU 52 9.134 -0.657 -5.089 449 HA LEU 52 HA LEU 52 6.882 -1.732 -3.649 450 HB2 LEU 52 HB2 LEU 52 8.026 -3.874 -4.135 451 HB3 LEU 52 HB3 LEU 52 9.526 -3.251 -3.459 452 HG LEU 52 HG LEU 52 8.541 -3.219 -1.208 453 HD11 LEU 52 HD11 LEU 52 6.035 -4.363 -2.520 454 HD12 LEU 52 HD12 LEU 52 6.336 -4.220 -0.769 455 HD13 LEU 52 HD13 LEU 52 6.164 -2.767 -1.747 456 HD21 LEU 52 HD21 LEU 52 9.605 -5.266 -2.112 457 HD22 LEU 52 HD22 LEU 52 8.343 -5.630 -0.913 458 HD23 LEU 52 HD23 LEU 52 8.024 -5.855 -2.650 459 H ASN 53 H ASN 53 10.226 -0.641 -3.478 460 HA ASN 53 HA ASN 53 9.780 0.474 -0.752 461 HB2 ASN 53 HB2 ASN 53 12.298 -0.375 -2.221 462 HB3 ASN 53 HB3 ASN 53 12.314 0.478 -0.681 463 HD21 ASN 53 HD21 ASN 53 11.731 -3.465 -0.563 464 HD22 ASN 53 HD22 ASN 53 12.199 -2.645 -2.048 465 H ASN 54 H ASN 54 9.702 1.698 -3.823 466 HA ASN 54 HA ASN 54 10.885 4.319 -3.097 467 HB2 ASN 54 HB2 ASN 54 9.711 3.370 -5.727 468 HB3 ASN 54 HB3 ASN 54 10.645 4.840 -5.463 469 HD21 ASN 54 HD21 ASN 54 12.583 1.417 -6.230 470 HD22 ASN 54 HD22 ASN 54 10.882 1.691 -6.586 471 H LEU 55 H LEU 55 7.781 2.821 -3.169 472 HA LEU 55 HA LEU 55 6.172 5.258 -3.205 473 HB2 LEU 55 HB2 LEU 55 4.330 3.768 -2.719 474 HB3 LEU 55 HB3 LEU 55 5.341 3.111 -3.985 475 HG LEU 55 HG LEU 55 6.460 1.766 -1.950 476 HD11 LEU 55 HD11 LEU 55 3.574 2.203 -1.058 477 HD12 LEU 55 HD12 LEU 55 4.687 0.976 -0.425 478 HD13 LEU 55 HD13 LEU 55 5.032 2.687 -0.164 479 HD21 LEU 55 HD21 LEU 55 5.444 0.782 -3.967 480 HD22 LEU 55 HD22 LEU 55 4.973 -0.100 -2.507 481 HD23 LEU 55 HD23 LEU 55 3.825 1.024 -3.272 482 H ASN 56 H ASN 56 4.758 5.833 -1.284 483 HA ASN 56 HA ASN 56 6.131 5.330 1.310 484 HB2 ASN 56 HB2 ASN 56 5.709 7.526 2.050 485 HB3 ASN 56 HB3 ASN 56 6.458 7.661 0.473 486 HD21 ASN 56 HD21 ASN 56 3.914 10.090 -0.007 487 HD22 ASN 56 HD22 ASN 56 5.613 9.844 0.387 488 H ALA 57 H ALA 57 4.584 5.824 3.142 489 HA ALA 57 HA ALA 57 2.281 4.004 2.869 490 HB1 ALA 57 HB1 ALA 57 3.641 5.427 5.191 491 HB2 ALA 57 HB2 ALA 57 2.322 4.249 5.356 492 HB3 ALA 57 HB3 ALA 57 3.884 3.737 4.682 493 H THR 58 H THR 58 2.891 7.436 3.010 494 HA THR 58 HA THR 58 0.484 8.417 4.119 495 HB THR 58 HB THR 58 2.246 9.752 2.029 496 HG1 THR 58 HG1 THR 58 3.411 10.497 3.817 497 HG21 THR 58 HG21 THR 58 0.474 10.866 4.243 498 HG22 THR 58 HG22 THR 58 1.632 11.824 3.285 499 HG23 THR 58 HG23 THR 58 0.261 11.054 2.486 500 H GLU 59 H GLU 59 1.355 7.958 0.638 501 HA GLU 59 HA GLU 59 -1.219 8.842 -0.326 502 HB2 GLU 59 HB2 GLU 59 0.773 7.006 -1.712 503 HB3 GLU 59 HB3 GLU 59 -0.585 7.854 -2.462 504 HG2 GLU 59 HG2 GLU 59 0.598 10.015 -1.461 505 HG3 GLU 59 HG3 GLU 59 2.022 8.961 -1.432 506 H LEU 60 H LEU 60 0.039 5.522 0.097 507 HA LEU 60 HA LEU 60 -2.282 4.024 -0.386 508 HB2 LEU 60 HB2 LEU 60 0.074 3.703 1.490 509 HB3 LEU 60 HB3 LEU 60 -1.284 2.595 1.622 510 HG LEU 60 HG LEU 60 -1.040 1.856 -0.666 511 HD11 LEU 60 HD11 LEU 60 1.339 3.733 -0.866 512 HD12 LEU 60 HD12 LEU 60 0.924 2.458 -2.028 513 HD13 LEU 60 HD13 LEU 60 -0.175 3.825 -1.796 514 HD21 LEU 60 HD21 LEU 60 0.261 0.743 1.128 515 HD22 LEU 60 HD22 LEU 60 1.140 0.708 -0.412 516 HD23 LEU 60 HD23 LEU 60 1.607 1.870 0.842 517 H SER 61 H SER 61 -1.387 5.419 2.836 518 HA SER 61 HA SER 61 -3.802 4.542 4.082 519 HB2 SER 61 HB2 SER 61 -3.165 6.045 5.943 520 HB3 SER 61 HB3 SER 61 -1.905 4.906 5.453 521 HG SER 61 HG SER 61 -0.815 6.523 4.461 522 H LYS 62 H LYS 62 -3.093 7.484 2.335 523 HA LYS 62 HA LYS 62 -5.526 8.923 3.048 524 HB2 LYS 62 HB2 LYS 62 -3.536 9.164 0.766 525 HB3 LYS 62 HB3 LYS 62 -4.965 10.192 0.874 526 HG2 LYS 62 HG2 LYS 62 -4.251 11.210 2.907 527 HG3 LYS 62 HG3 LYS 62 -3.021 9.994 3.197 528 HD2 LYS 62 HD2 LYS 62 -1.918 12.002 2.434 529 HD3 LYS 62 HD3 LYS 62 -1.746 10.750 1.209 530 HE2 LYS 62 HE2 LYS 62 -2.196 12.792 0.063 531 HE3 LYS 62 HE3 LYS 62 -3.649 11.804 -0.075 532 HZ1 LYS 62 HZ1 LYS 62 -3.264 14.030 1.866 533 HZ2 LYS 62 HZ2 LYS 62 -4.162 14.115 0.511 534 HZ3 LYS 62 HZ3 LYS 62 -4.630 13.141 1.732 535 H ARG 63 H ARG 63 -4.705 6.870 0.217 536 HA ARG 63 HA ARG 63 -7.395 7.148 -0.930 537 HB2 ARG 63 HB2 ARG 63 -4.923 5.533 -1.641 538 HB3 ARG 63 HB3 ARG 63 -6.474 5.265 -2.451 539 HG2 ARG 63 HG2 ARG 63 -6.586 7.621 -3.126 540 HG3 ARG 63 HG3 ARG 63 -5.018 7.939 -2.359 541 HD2 ARG 63 HD2 ARG 63 -3.870 6.487 -3.918 542 HD3 ARG 63 HD3 ARG 63 -5.387 5.792 -4.484 543 HE ARG 63 HE ARG 63 -5.764 7.569 -5.890 544 HH11 ARG 63 HH11 ARG 63 -5.250 9.353 -7.078 545 HH12 ARG 63 HH12 ARG 63 -3.917 10.365 -6.607 546 HH21 ARG 63 HH21 ARG 63 -3.068 8.496 -3.856 547 HH22 ARG 63 HH22 ARG 63 -2.686 9.881 -4.841 548 H LEU 64 H LEU 64 -5.759 4.561 0.857 549 HA LEU 64 HA LEU 64 -8.050 2.750 0.644 550 HB2 LEU 64 HB2 LEU 64 -5.522 2.324 0.556 551 HB3 LEU 64 HB3 LEU 64 -5.544 2.403 2.312 552 HG LEU 64 HG LEU 64 -7.149 0.441 0.637 553 HD11 LEU 64 HD11 LEU 64 -4.388 0.161 1.893 554 HD12 LEU 64 HD12 LEU 64 -5.296 -1.161 1.134 555 HD13 LEU 64 HD13 LEU 64 -4.774 0.216 0.159 556 HD21 LEU 64 HD21 LEU 64 -8.013 0.430 2.905 557 HD22 LEU 64 HD22 LEU 64 -6.987 -0.985 2.736 558 HD23 LEU 64 HD23 LEU 64 -6.368 0.445 3.580 559 H ASN 65 H ASN 65 -6.978 5.172 2.898 560 HA ASN 65 HA ASN 65 -7.837 6.048 4.768 561 HB2 ASN 65 HB2 ASN 65 -9.942 5.989 3.411 562 HB3 ASN 65 HB3 ASN 65 -10.401 4.514 4.263 563 HD21 ASN 65 HD21 ASN 65 -11.030 6.249 7.372 564 HD22 ASN 65 HD22 ASN 65 -10.391 4.724 6.743 565 H ILE 66 H ILE 66 -6.086 4.763 5.554 566 HA ILE 66 HA ILE 66 -6.868 3.028 7.838 567 HB ILE 66 HB ILE 66 -4.643 1.750 7.404 568 HG12 ILE 66 HG12 ILE 66 -5.120 2.761 4.585 569 HG13 ILE 66 HG13 ILE 66 -3.794 3.213 5.678 570 HG21 ILE 66 HG21 ILE 66 -7.066 1.208 5.689 571 HG22 ILE 66 HG22 ILE 66 -5.785 0.047 6.138 572 HG23 ILE 66 HG23 ILE 66 -6.810 0.742 7.390 573 HD11 ILE 66 HD11 ILE 66 -4.234 0.452 4.502 574 HD12 ILE 66 HD12 ILE 66 -3.066 1.671 3.974 575 HD13 ILE 66 HD13 ILE 66 -2.916 0.940 5.596 576 H THR 67 H THR 67 -4.943 2.716 9.262 577 HA THR 67 HA THR 67 -3.708 5.205 10.149 578 HB THR 67 HB THR 67 -3.380 2.265 10.885 579 HG1 THR 67 HG1 THR 67 -4.519 2.941 12.721 580 HG21 THR 67 HG21 THR 67 -2.143 4.715 12.191 581 HG22 THR 67 HG22 THR 67 -2.280 3.113 12.965 582 HG23 THR 67 HG23 THR 67 -1.313 3.290 11.505 583 H VAL 68 H VAL 68 -1.648 5.918 9.612 584 HA VAL 68 HA VAL 68 -0.394 5.065 7.234 585 HB VAL 68 HB VAL 68 1.031 6.460 9.531 586 HG11 VAL 68 HG11 VAL 68 1.434 6.573 6.506 587 HG12 VAL 68 HG12 VAL 68 2.336 7.517 7.710 588 HG13 VAL 68 HG13 VAL 68 2.509 5.763 7.668 589 HG21 VAL 68 HG21 VAL 68 -1.029 7.723 9.102 590 HG22 VAL 68 HG22 VAL 68 0.353 8.597 8.450 591 HG23 VAL 68 HG23 VAL 68 -0.711 7.693 7.353 592 H ASP 69 H ASP 69 0.286 4.097 10.572 593 HA ASP 69 HA ASP 69 2.581 2.524 9.930 594 HB2 ASP 69 HB2 ASP 69 2.018 3.525 12.171 595 HB3 ASP 69 HB3 ASP 69 0.784 2.277 12.366 596 H LYS 70 H LYS 70 -0.833 1.713 9.740 597 HA LYS 70 HA LYS 70 -0.366 -1.173 9.498 598 HB2 LYS 70 HB2 LYS 70 -2.727 0.661 8.996 599 HB3 LYS 70 HB3 LYS 70 -2.676 -0.910 8.199 600 HG2 LYS 70 HG2 LYS 70 -2.379 -2.049 10.357 601 HG3 LYS 70 HG3 LYS 70 -2.467 -0.492 11.207 602 HD2 LYS 70 HD2 LYS 70 -4.776 -0.173 10.540 603 HD3 LYS 70 HD3 LYS 70 -4.673 -1.471 9.348 604 HE2 LYS 70 HE2 LYS 70 -5.935 -2.298 11.199 605 HE3 LYS 70 HE3 LYS 70 -4.394 -3.150 11.129 606 HZ1 LYS 70 HZ1 LYS 70 -5.022 -0.912 12.989 607 HZ2 LYS 70 HZ2 LYS 70 -4.960 -2.488 13.398 608 HZ3 LYS 70 HZ3 LYS 70 -3.597 -1.721 12.943 609 H ALA 71 H ALA 71 -0.393 1.570 7.260 610 HA ALA 71 HA ALA 71 -0.078 -0.127 4.873 611 HB1 ALA 71 HB1 ALA 71 0.554 2.835 5.323 612 HB2 ALA 71 HB2 ALA 71 0.472 2.005 3.758 613 HB3 ALA 71 HB3 ALA 71 -0.984 2.200 4.750 614 H LYS 72 H LYS 72 2.151 1.700 7.003 615 HA LYS 72 HA LYS 72 4.617 1.130 5.718 616 HB2 LYS 72 HB2 LYS 72 3.957 1.528 8.656 617 HB3 LYS 72 HB3 LYS 72 5.605 1.347 8.056 618 HG2 LYS 72 HG2 LYS 72 5.467 3.346 6.744 619 HG3 LYS 72 HG3 LYS 72 3.743 3.509 7.070 620 HD2 LYS 72 HD2 LYS 72 5.177 5.090 8.347 621 HD3 LYS 72 HD3 LYS 72 4.075 4.126 9.331 622 HE2 LYS 72 HE2 LYS 72 5.869 2.632 10.011 623 HE3 LYS 72 HE3 LYS 72 7.009 3.426 8.908 624 HZ1 LYS 72 HZ1 LYS 72 5.722 4.704 11.264 625 HZ2 LYS 72 HZ2 LYS 72 7.277 4.228 11.180 626 HZ3 LYS 72 HZ3 LYS 72 6.758 5.458 10.245 627 H THR 73 H THR 73 2.925 -0.908 8.159 628 HA THR 73 HA THR 73 5.039 -2.963 7.859 629 HB THR 73 HB THR 73 3.936 -2.497 10.046 630 HG1 THR 73 HG1 THR 73 3.907 -4.744 10.512 631 HG21 THR 73 HG21 THR 73 1.683 -4.261 8.989 632 HG22 THR 73 HG22 THR 73 1.873 -3.597 10.625 633 HG23 THR 73 HG23 THR 73 1.536 -2.512 9.272 634 H TYR 74 H TYR 74 1.662 -2.589 6.702 635 HA TYR 74 HA TYR 74 1.394 -5.201 5.683 636 HB2 TYR 74 HB2 TYR 74 -0.486 -3.739 6.014 637 HB3 TYR 74 HB3 TYR 74 0.145 -2.579 4.832 638 HD1 TYR 74 HD1 TYR 74 -0.369 -2.757 2.560 639 HD2 TYR 74 HD2 TYR 74 -1.053 -6.116 5.188 640 HE1 TYR 74 HE1 TYR 74 -1.397 -4.003 0.705 641 HE2 TYR 74 HE2 TYR 74 -2.019 -7.402 3.285 642 HH TYR 74 HH TYR 74 -2.139 -6.066 -0.036 643 H ILE 75 H ILE 75 2.884 -2.355 4.148 644 HA ILE 75 HA ILE 75 3.340 -3.242 1.535 645 HB ILE 75 HB ILE 75 4.983 -1.591 3.475 646 HG12 ILE 75 HG12 ILE 75 3.644 -0.717 0.878 647 HG13 ILE 75 HG13 ILE 75 2.735 -0.813 2.366 648 HG21 ILE 75 HG21 ILE 75 5.657 -2.101 0.551 649 HG22 ILE 75 HG22 ILE 75 6.404 -0.852 1.566 650 HG23 ILE 75 HG23 ILE 75 6.657 -2.540 1.962 651 HD11 ILE 75 HD11 ILE 75 5.174 0.965 1.901 652 HD12 ILE 75 HD12 ILE 75 3.491 1.473 2.081 653 HD13 ILE 75 HD13 ILE 75 4.351 0.771 3.459 654 H LYS 76 H LYS 76 5.332 -4.098 4.428 655 HA LYS 76 HA LYS 76 6.808 -6.100 2.789 656 HB2 LYS 76 HB2 LYS 76 8.162 -6.458 4.813 657 HB3 LYS 76 HB3 LYS 76 8.151 -4.764 4.312 658 HG2 LYS 76 HG2 LYS 76 6.611 -4.173 6.098 659 HG3 LYS 76 HG3 LYS 76 6.395 -5.882 6.540 660 HD2 LYS 76 HD2 LYS 76 8.741 -6.038 7.232 661 HD3 LYS 76 HD3 LYS 76 9.041 -4.390 6.672 662 HE2 LYS 76 HE2 LYS 76 8.823 -4.382 9.073 663 HE3 LYS 76 HE3 LYS 76 7.483 -3.487 8.356 664 HZ1 LYS 76 HZ1 LYS 76 7.260 -6.312 9.268 665 HZ2 LYS 76 HZ2 LYS 76 6.838 -5.029 10.181 666 HZ3 LYS 76 HZ3 LYS 76 6.016 -5.322 8.824 667 H ASN 77 H ASN 77 4.191 -6.118 5.135 668 HA ASN 77 HA ASN 77 4.382 -8.886 5.776 669 HB2 ASN 77 HB2 ASN 77 2.993 -6.926 6.861 670 HB3 ASN 77 HB3 ASN 77 1.746 -7.387 5.693 671 HD21 ASN 77 HD21 ASN 77 2.689 -9.818 8.863 672 HD22 ASN 77 HD22 ASN 77 3.760 -8.503 8.397 673 H SER 78 H SER 78 2.794 -7.265 3.066 674 HA SER 78 HA SER 78 1.611 -9.774 2.076 675 HB2 SER 78 HB2 SER 78 0.498 -7.500 2.112 676 HB3 SER 78 HB3 SER 78 1.534 -7.056 0.745 677 HG SER 78 HG SER 78 -0.577 -7.951 0.204 678 H ASN 79 H ASN 79 4.190 -7.559 1.021 679 HA ASN 79 HA ASN 79 4.685 -9.228 -1.383 680 HB2 ASN 79 HB2 ASN 79 5.939 -6.574 -0.659 681 HB3 ASN 79 HB3 ASN 79 5.968 -7.378 -2.225 682 HD21 ASN 79 HD21 ASN 79 2.777 -5.130 -1.126 683 HD22 ASN 79 HD22 ASN 79 4.153 -5.428 -0.047 684 H ARG 80 H ARG 80 6.246 -8.421 1.607 685 HA ARG 80 HA ARG 80 8.193 -8.779 2.525 686 HB2 ARG 80 HB2 ARG 80 6.771 -10.960 2.597 687 HB3 ARG 80 HB3 ARG 80 7.951 -11.626 1.477 688 HG2 ARG 80 HG2 ARG 80 8.608 -12.319 3.656 689 HG3 ARG 80 HG3 ARG 80 9.753 -11.047 3.218 690 HD2 ARG 80 HD2 ARG 80 8.370 -9.414 4.568 691 HD3 ARG 80 HD3 ARG 80 7.276 -10.726 4.976 692 HE ARG 80 HE ARG 80 8.870 -11.673 6.415 693 HH11 ARG 80 HH11 ARG 80 10.545 -11.515 7.853 694 HH12 ARG 80 HH12 ARG 80 11.723 -10.249 7.687 695 HH21 ARG 80 HH21 ARG 80 10.303 -8.850 4.901 696 HH22 ARG 80 HH22 ARG 80 11.595 -8.777 6.068 697 H MET 81 H MET 81 8.891 -7.420 0.650 698 HA MET 81 HA MET 81 10.529 -6.594 -0.638 699 HB2 MET 81 HB2 MET 81 12.271 -8.823 0.428 700 HB3 MET 81 HB3 MET 81 12.828 -7.415 -0.477 701 HG2 MET 81 HG2 MET 81 11.389 -7.332 2.199 702 HG3 MET 81 HG3 MET 81 13.116 -7.107 1.945 703 HE1 MET 81 HE1 MET 81 12.760 -4.899 3.498 704 HE2 MET 81 HE2 MET 81 11.676 -3.562 3.052 705 HE3 MET 81 HE3 MET 81 10.996 -5.138 3.518 706 H GLY 82 H GLY 82 9.917 -10.023 -1.321 707 HA2 GLY 82 HA2 GLY 82 8.823 -9.593 -3.758 708 HA3 GLY 82 HA3 GLY 82 10.544 -9.687 -4.190 709 H ARG 83 H ARG 83 11.529 -11.494 -2.559 710 HA ARG 83 HA ARG 83 9.814 -13.935 -2.429 711 HB2 ARG 83 HB2 ARG 83 12.697 -13.829 -3.355 712 HB3 ARG 83 HB3 ARG 83 11.904 -15.302 -2.767 713 HG2 ARG 83 HG2 ARG 83 10.181 -15.126 -4.512 714 HG3 ARG 83 HG3 ARG 83 10.914 -13.625 -5.120 715 HD2 ARG 83 HD2 ARG 83 12.981 -14.772 -5.639 716 HD3 ARG 83 HD3 ARG 83 12.384 -16.281 -4.944 717 HE ARG 83 HE ARG 83 11.678 -15.095 -7.556 718 HH11 ARG 83 HH11 ARG 83 10.512 -16.293 -9.015 719 HH12 ARG 83 HH12 ARG 83 9.744 -17.770 -8.513 720 HH21 ARG 83 HH21 ARG 83 10.795 -17.595 -5.256 721 HH22 ARG 83 HH22 ARG 83 9.897 -18.494 -6.449 722 H THR 84 H THR 84 13.072 -13.507 -1.319 723 HA THR 84 HA THR 84 12.226 -13.675 1.545 724 HB THR 84 HB THR 84 13.713 -15.640 1.814 725 HG1 THR 84 HG1 THR 84 14.448 -16.649 -0.092 726 HG21 THR 84 HG21 THR 84 11.771 -16.127 -0.471 727 HG22 THR 84 HG22 THR 84 12.284 -17.267 0.792 728 HG23 THR 84 HG23 THR 84 11.256 -15.873 1.206 729 H ASN 85 H ASN 85 13.695 -11.594 -0.061 730 HA ASN 85 HA ASN 85 15.475 -10.199 0.014 731 HB2 ASN 85 HB2 ASN 85 14.587 -9.873 2.340 732 HB3 ASN 85 HB3 ASN 85 15.736 -11.071 2.927 733 HD21 ASN 85 HD21 ASN 85 17.154 -7.380 1.805 734 HD22 ASN 85 HD22 ASN 85 15.666 -7.956 1.075 735 H ASN 86 H ASN 86 15.842 -12.588 -1.134 736 HA ASN 86 HA ASN 86 18.328 -13.827 -0.396 737 HB2 ASN 86 HB2 ASN 86 16.113 -14.694 -1.640 738 HB3 ASN 86 HB3 ASN 86 16.923 -14.120 -3.096 739 HD21 ASN 86 HD21 ASN 86 18.612 -17.133 -0.845 740 HD22 ASN 86 HD22 ASN 86 17.632 -15.841 -0.124 741 H PHE 87 H PHE 87 17.689 -11.070 -2.242 742 HA PHE 87 HA PHE 87 19.418 -11.891 -4.460 743 HB2 PHE 87 HB2 PHE 87 17.781 -10.607 -5.777 744 HB3 PHE 87 HB3 PHE 87 17.006 -11.784 -4.720 745 HD1 PHE 87 HD1 PHE 87 17.627 -8.158 -5.232 746 HD2 PHE 87 HD2 PHE 87 15.514 -11.141 -2.945 747 HE1 PHE 87 HE1 PHE 87 16.199 -6.381 -4.234 748 HE2 PHE 87 HE2 PHE 87 14.080 -9.356 -1.950 749 HZ PHE 87 HZ PHE 87 14.432 -6.980 -2.589 750 H LYS 88 H LYS 88 20.175 -10.094 -2.046 751 HA LYS 88 HA LYS 88 20.594 -7.414 -3.154 752 HB2 LYS 88 HB2 LYS 88 21.215 -6.864 -0.852 753 HB3 LYS 88 HB3 LYS 88 19.717 -7.784 -0.915 754 HG2 LYS 88 HG2 LYS 88 21.684 -9.784 -0.611 755 HG3 LYS 88 HG3 LYS 88 22.308 -8.451 0.360 756 HD2 LYS 88 HD2 LYS 88 20.214 -8.381 1.654 757 HD3 LYS 88 HD3 LYS 88 19.491 -9.590 0.575 758 HE2 LYS 88 HE2 LYS 88 21.347 -11.189 1.243 759 HE3 LYS 88 HE3 LYS 88 21.854 -10.002 2.457 760 HZ1 LYS 88 HZ1 LYS 88 19.215 -11.354 2.294 761 HZ2 LYS 88 HZ2 LYS 88 20.349 -11.601 3.460 762 HZ3 LYS 88 HZ3 LYS 88 19.528 -10.175 3.357 763 H THR 89 H THR 89 22.422 -10.119 -3.369 764 HA THR 89 HA THR 89 25.090 -8.765 -3.438 765 HB THR 89 HB THR 89 24.231 -11.204 -1.822 766 HG1 THR 89 HG1 THR 89 24.973 -9.921 -0.102 767 HG21 THR 89 HG21 THR 89 27.003 -10.046 -2.238 768 HG22 THR 89 HG22 THR 89 26.560 -11.230 -0.976 769 HG23 THR 89 HG23 THR 89 26.428 -11.676 -2.681 770 H ILE 90 H ILE 90 23.261 -11.804 -4.043 771 HA ILE 90 HA ILE 90 25.143 -12.791 -6.045 772 HB ILE 90 HB ILE 90 23.533 -14.579 -6.315 773 HG12 ILE 90 HG12 ILE 90 21.849 -13.306 -4.130 774 HG13 ILE 90 HG13 ILE 90 21.461 -13.163 -5.842 775 HG21 ILE 90 HG21 ILE 90 24.118 -14.039 -3.374 776 HG22 ILE 90 HG22 ILE 90 23.910 -15.616 -4.158 777 HG23 ILE 90 HG23 ILE 90 25.307 -14.619 -4.560 778 HD11 ILE 90 HD11 ILE 90 21.616 -15.751 -4.258 779 HD12 ILE 90 HD12 ILE 90 20.168 -14.972 -4.926 780 HD13 ILE 90 HD13 ILE 90 21.391 -15.653 -6.021 781 H LYS 91 H LYS 91 24.105 -13.578 -8.155 782 HA LYS 91 HA LYS 91 23.488 -13.095 -10.274 783 HB2 LYS 91 HB2 LYS 91 21.514 -11.064 -9.198 784 HB3 LYS 91 HB3 LYS 91 21.475 -11.833 -10.764 785 HG2 LYS 91 HG2 LYS 91 21.018 -13.308 -8.127 786 HG3 LYS 91 HG3 LYS 91 19.772 -12.589 -9.119 787 HD2 LYS 91 HD2 LYS 91 19.679 -14.818 -9.712 788 HD3 LYS 91 HD3 LYS 91 20.571 -14.084 -11.046 789 HE2 LYS 91 HE2 LYS 91 22.707 -14.895 -10.027 790 HE3 LYS 91 HE3 LYS 91 21.794 -15.581 -8.677 791 HZ1 LYS 91 HZ1 LYS 91 21.522 -16.411 -11.520 792 HZ2 LYS 91 HZ2 LYS 91 22.289 -17.262 -10.360 793 HZ3 LYS 91 HZ3 LYS 91 20.674 -17.046 -10.277 794 H MET 92 H MET 92 24.674 -10.482 -8.403 795 HA MET 92 HA MET 92 25.486 -8.998 -10.878 796 HB2 MET 92 HB2 MET 92 25.461 -6.980 -9.393 797 HB3 MET 92 HB3 MET 92 23.886 -7.699 -9.688 798 HG2 MET 92 HG2 MET 92 23.600 -8.394 -7.535 799 HG3 MET 92 HG3 MET 92 25.315 -8.657 -7.240 800 HE1 MET 92 HE1 MET 92 27.025 -6.439 -7.321 801 HE2 MET 92 HE2 MET 92 26.716 -5.508 -5.837 802 HE3 MET 92 HE3 MET 92 26.705 -7.286 -5.790 803 H PHE 93 H PHE 93 26.853 -11.001 -8.675 804 HA PHE 93 HA PHE 93 29.431 -9.482 -8.485 805 HB2 PHE 93 HB2 PHE 93 27.823 -9.448 -6.514 806 HB3 PHE 93 HB3 PHE 93 28.116 -11.173 -6.335 807 HD1 PHE 93 HD1 PHE 93 30.095 -11.932 -5.177 808 HD2 PHE 93 HD2 PHE 93 29.651 -7.791 -6.268 809 HE1 PHE 93 HE1 PHE 93 32.035 -11.343 -3.723 810 HE2 PHE 93 HE2 PHE 93 31.593 -7.196 -4.819 811 HZ PHE 93 HZ PHE 93 32.781 -8.975 -3.547 812 H GLU 94 H GLU 94 28.081 -12.411 -9.550 813 HA GLU 94 HA GLU 94 30.505 -14.045 -8.926 814 HB2 GLU 94 HB2 GLU 94 27.680 -14.841 -9.701 815 HB3 GLU 94 HB3 GLU 94 29.031 -15.961 -9.464 816 HG2 GLU 94 HG2 GLU 94 29.246 -15.260 -7.115 817 HG3 GLU 94 HG3 GLU 94 27.940 -14.088 -7.314 818 H ASP 95 H ASP 95 31.924 -13.407 -10.516 819 HA ASP 95 HA ASP 95 31.443 -14.467 -13.215 820 HB2 ASP 95 HB2 ASP 95 30.628 -12.072 -13.226 821 HB3 ASP 95 HB3 ASP 95 32.257 -11.564 -12.776 822 H ASP 96 H ASP 96 33.450 -14.525 -14.508 823 HA ASP 96 HA ASP 96 35.745 -15.338 -12.864 824 HB2 ASP 96 HB2 ASP 96 35.171 -15.399 -15.841 825 HB3 ASP 96 HB3 ASP 96 36.756 -15.786 -15.179 826 H VAL 97 H VAL 97 37.663 -14.400 -12.653 827 HA VAL 97 HA VAL 97 38.323 -11.865 -14.113 828 HB VAL 97 HB VAL 97 38.782 -12.339 -11.142 829 HG11 VAL 97 HG11 VAL 97 39.340 -9.907 -12.900 830 HG12 VAL 97 HG12 VAL 97 39.495 -9.959 -11.130 831 HG13 VAL 97 HG13 VAL 97 40.559 -10.949 -12.127 832 HG21 VAL 97 HG21 VAL 97 36.410 -11.845 -11.536 833 HG22 VAL 97 HG22 VAL 97 37.202 -10.447 -10.812 834 HG23 VAL 97 HG23 VAL 97 36.844 -10.454 -12.554 835 H SER 98 H SER 98 39.625 -14.513 -12.090 836 HA SER 98 HA SER 98 42.139 -14.512 -13.708 837 HB2 SER 98 HB2 SER 98 41.821 -15.209 -10.771 838 HB3 SER 98 HB3 SER 98 43.329 -15.220 -11.706 839 HG SER 98 HG SER 98 43.079 -13.279 -10.514 840 H SER 99 H SER 99 39.812 -15.991 -14.428 841 HA SER 99 HA SER 99 38.962 -18.062 -14.887 842 HB2 SER 99 HB2 SER 99 41.900 -18.243 -15.533 843 HB3 SER 99 HB3 SER 99 40.664 -19.360 -16.170 844 HG SER 99 HG SER 99 41.094 -17.600 -17.601 845 H ALA 100 H ALA 100 38.713 -18.285 -12.367 846 HA ALA 100 HA ALA 100 40.327 -20.209 -10.983 847 HB1 ALA 100 HB1 ALA 100 37.520 -19.169 -10.418 848 HB2 ALA 100 HB2 ALA 100 38.544 -20.074 -9.283 849 HB3 ALA 100 HB3 ALA 100 39.049 -18.467 -9.839 850 H SER 101 H SER 101 40.552 -22.173 -11.849 851 HA SER 101 HA SER 101 38.316 -24.073 -11.947 852 HB2 SER 101 HB2 SER 101 38.320 -22.892 -14.188 853 HB3 SER 101 HB3 SER 101 39.959 -23.511 -14.455 854 HG SER 101 HG SER 101 38.265 -24.839 -15.360 855 H ALA 102 H ALA 102 39.211 -26.273 -12.668 856 HA ALA 102 HA ALA 102 41.590 -26.904 -11.082 857 HB1 ALA 102 HB1 ALA 102 39.652 -28.685 -12.595 858 HB2 ALA 102 HB2 ALA 102 40.852 -29.211 -11.391 859 HB3 ALA 102 HB3 ALA 102 39.493 -28.188 -10.891 860 H GLN 103 H GLN 103 42.151 -25.394 -13.363 861 HA GLN 103 HA GLN 103 43.393 -25.065 -15.162 862 HB2 GLN 103 HB2 GLN 103 44.806 -27.376 -13.874 863 HB3 GLN 103 HB3 GLN 103 45.456 -26.634 -15.338 864 HG2 GLN 103 HG2 GLN 103 45.506 -24.427 -14.222 865 HG3 GLN 103 HG3 GLN 103 44.837 -25.143 -12.751 866 HE21 GLN 103 HE21 GLN 103 47.950 -26.624 -11.748 867 HE22 GLN 103 HE22 GLN 103 46.210 -26.663 -11.507 868 HA PRO 104 HA PRO 104 41.909 -27.111 -18.698 869 HB2 PRO 104 HB2 PRO 104 43.526 -26.265 -20.712 870 HB3 PRO 104 HB3 PRO 104 42.495 -25.155 -19.766 871 HG2 PRO 104 HG2 PRO 104 45.444 -25.750 -19.336 872 HG3 PRO 104 HG3 PRO 104 44.644 -24.150 -19.464 873 HD2 PRO 104 HD2 PRO 104 45.190 -25.298 -17.062 874 HD3 PRO 104 HD3 PRO 104 43.706 -24.338 -17.319 875 H ASN 105 H ASN 105 42.280 -29.219 -17.845 876 HA ASN 105 HA ASN 105 44.405 -30.804 -19.229 877 HB2 ASN 105 HB2 ASN 105 43.408 -30.979 -16.354 878 HB3 ASN 105 HB3 ASN 105 44.428 -32.202 -17.110 879 HD21 ASN 105 HD21 ASN 105 47.390 -30.231 -17.032 880 HD22 ASN 105 HD22 ASN 105 46.612 -31.596 -17.820 881 H LEU 106 H LEU 106 41.795 -30.347 -20.251 882 HA LEU 106 HA LEU 106 40.929 -33.176 -20.550 883 HB2 LEU 106 HB2 LEU 106 39.486 -31.703 -18.939 884 HB3 LEU 106 HB3 LEU 106 38.837 -30.994 -20.404 885 HG LEU 106 HG LEU 106 38.802 -33.940 -19.586 886 HD11 LEU 106 HD11 LEU 106 36.549 -31.902 -19.821 887 HD12 LEU 106 HD12 LEU 106 36.383 -33.605 -19.336 888 HD13 LEU 106 HD13 LEU 106 37.278 -32.478 -18.305 889 HD21 LEU 106 HD21 LEU 106 38.846 -33.867 -22.031 890 HD22 LEU 106 HD22 LEU 106 37.234 -34.311 -21.469 891 HD23 LEU 106 HD23 LEU 106 37.541 -32.656 -22.043 892 HA PRO 107 HA PRO 107 41.756 -31.041 -24.621 893 HB2 PRO 107 HB2 PRO 107 43.531 -32.822 -25.677 894 HB3 PRO 107 HB3 PRO 107 44.007 -31.528 -24.535 895 HG2 PRO 107 HG2 PRO 107 43.417 -34.440 -23.907 896 HG3 PRO 107 HG3 PRO 107 44.824 -33.457 -23.388 897 HD2 PRO 107 HD2 PRO 107 42.656 -33.834 -21.780 898 HD3 PRO 107 HD3 PRO 107 43.547 -32.284 -21.805 Start of MODEL 28 1 H1 GLY -5 H1 GLY -5 58.638 -49.601 10.946 2 H2 GLY -5 H2 GLY -5 59.656 -49.939 9.710 3 H3 GLY -5 H3 GLY -5 58.899 -51.158 10.505 4 HA2 GLY -5 HA2 GLY -5 57.853 -50.806 8.372 5 HA3 GLY -5 HA3 GLY -5 56.751 -50.440 9.709 6 H SER -4 H SER -4 55.871 -49.333 7.596 7 HA SER -4 HA SER -4 56.431 -46.436 7.823 8 HB2 SER -4 HB2 SER -4 56.546 -46.147 5.396 9 HB3 SER -4 HB3 SER -4 57.862 -47.175 5.980 10 HG SER -4 HG SER -4 56.896 -48.063 4.115 11 H HIS -3 H HIS -3 54.771 -45.109 6.750 12 HA HIS -3 HA HIS -3 52.082 -46.399 6.641 13 HB2 HIS -3 HB2 HIS -3 52.816 -45.360 8.901 14 HB3 HIS -3 HB3 HIS -3 52.604 -43.803 8.118 15 HD2 HIS -3 HD2 HIS -3 49.787 -45.512 6.639 16 HE1 HIS -3 HE1 HIS -3 48.314 -44.692 10.557 17 HE2 HIS -3 HE2 HIS -3 47.673 -45.403 8.201 18 H MET -2 H MET -2 53.662 -45.628 4.430 19 HA MET -2 HA MET -2 52.632 -43.063 3.402 20 HB2 MET -2 HB2 MET -2 54.532 -45.094 2.173 21 HB3 MET -2 HB3 MET -2 54.096 -43.524 1.477 22 HG2 MET -2 HG2 MET -2 54.989 -42.396 3.522 23 HG3 MET -2 HG3 MET -2 55.476 -43.968 4.151 24 HE1 MET -2 HE1 MET -2 56.248 -41.027 1.767 25 HE2 MET -2 HE2 MET -2 57.494 -41.671 0.678 26 HE3 MET -2 HE3 MET -2 55.815 -42.229 0.528 27 H ALA -1 H ALA -1 50.398 -43.953 3.678 28 HA ALA -1 HA ALA -1 49.378 -45.093 1.137 29 HB1 ALA -1 HB1 ALA -1 48.744 -46.207 3.895 30 HB2 ALA -1 HB2 ALA -1 47.955 -46.664 2.366 31 HB3 ALA -1 HB3 ALA -1 49.679 -47.012 2.611 32 H SER 0 H SER 0 48.670 -43.098 0.657 33 HA SER 0 HA SER 0 46.334 -41.992 2.172 34 HB2 SER 0 HB2 SER 0 48.681 -40.940 2.584 35 HB3 SER 0 HB3 SER 0 48.457 -40.193 0.995 36 HG SER 0 HG SER 0 47.695 -38.871 2.719 37 H MET 1 H MET 1 46.706 -43.448 -0.526 38 HA MET 1 HA MET 1 45.105 -41.540 -2.192 39 HB2 MET 1 HB2 MET 1 47.315 -43.382 -3.179 40 HB3 MET 1 HB3 MET 1 46.279 -42.371 -4.196 41 HG2 MET 1 HG2 MET 1 47.140 -40.347 -3.035 42 HG3 MET 1 HG3 MET 1 48.239 -41.372 -2.104 43 HE1 MET 1 HE1 MET 1 50.276 -39.856 -2.837 44 HE2 MET 1 HE2 MET 1 50.654 -39.457 -4.527 45 HE3 MET 1 HE3 MET 1 49.169 -38.830 -3.780 46 H ASP 2 H ASP 2 45.586 -44.789 -1.287 47 HA ASP 2 HA ASP 2 43.112 -45.688 -2.740 48 HB2 ASP 2 HB2 ASP 2 45.482 -47.227 -1.620 49 HB3 ASP 2 HB3 ASP 2 44.012 -47.991 -2.221 50 H GLN 3 H GLN 3 44.526 -45.259 0.433 51 HA GLN 3 HA GLN 3 42.332 -46.642 1.850 52 HB2 GLN 3 HB2 GLN 3 44.732 -46.833 2.522 53 HB3 GLN 3 HB3 GLN 3 44.749 -45.098 2.846 54 HG2 GLN 3 HG2 GLN 3 42.845 -45.553 4.545 55 HG3 GLN 3 HG3 GLN 3 43.183 -47.271 4.306 56 HE21 GLN 3 HE21 GLN 3 46.042 -44.871 6.111 57 HE22 GLN 3 HE22 GLN 3 44.891 -44.163 4.992 58 H LEU 4 H LEU 4 43.563 -43.309 1.392 59 HA LEU 4 HA LEU 4 41.158 -42.174 2.730 60 HB2 LEU 4 HB2 LEU 4 43.898 -41.039 2.114 61 HB3 LEU 4 HB3 LEU 4 42.506 -39.993 2.331 62 HG LEU 4 HG LEU 4 42.109 -40.929 4.593 63 HD11 LEU 4 HD11 LEU 4 44.762 -42.341 4.116 64 HD12 LEU 4 HD12 LEU 4 43.993 -42.127 5.710 65 HD13 LEU 4 HD13 LEU 4 43.178 -43.095 4.480 66 HD21 LEU 4 HD21 LEU 4 43.387 -38.848 4.249 67 HD22 LEU 4 HD22 LEU 4 43.977 -39.744 5.656 68 HD23 LEU 4 HD23 LEU 4 44.891 -39.787 4.131 69 H ASP 5 H ASP 5 39.611 -41.168 1.508 70 HA ASP 5 HA ASP 5 40.229 -39.995 -1.108 71 HB2 ASP 5 HB2 ASP 5 39.825 -42.370 -1.706 72 HB3 ASP 5 HB3 ASP 5 38.252 -42.308 -0.918 73 H GLU 6 H GLU 6 37.414 -41.026 0.903 74 HA GLU 6 HA GLU 6 35.975 -38.583 0.104 75 HB2 GLU 6 HB2 GLU 6 35.279 -41.010 -0.390 76 HB3 GLU 6 HB3 GLU 6 34.826 -41.116 1.315 77 HG2 GLU 6 HG2 GLU 6 33.219 -39.293 1.011 78 HG3 GLU 6 HG3 GLU 6 33.844 -38.979 -0.610 79 H ILE 7 H ILE 7 37.918 -38.594 2.352 80 HA ILE 7 HA ILE 7 36.369 -38.663 4.818 81 HB ILE 7 HB ILE 7 39.301 -38.004 4.498 82 HG12 ILE 7 HG12 ILE 7 38.941 -40.097 3.323 83 HG13 ILE 7 HG13 ILE 7 39.831 -40.344 4.813 84 HG21 ILE 7 HG21 ILE 7 37.672 -39.111 6.832 85 HG22 ILE 7 HG22 ILE 7 39.446 -39.006 6.793 86 HG23 ILE 7 HG23 ILE 7 38.475 -37.536 6.748 87 HD11 ILE 7 HD11 ILE 7 36.867 -40.929 4.427 88 HD12 ILE 7 HD12 ILE 7 38.181 -42.120 4.420 89 HD13 ILE 7 HD13 ILE 7 37.808 -41.233 5.907 90 H ILE 8 H ILE 8 35.057 -36.919 3.753 91 HA ILE 8 HA ILE 8 35.798 -34.234 4.852 92 HB ILE 8 HB ILE 8 34.481 -34.635 2.139 93 HG12 ILE 8 HG12 ILE 8 37.400 -33.954 2.717 94 HG13 ILE 8 HG13 ILE 8 36.802 -35.439 1.972 95 HG21 ILE 8 HG21 ILE 8 35.699 -32.147 3.432 96 HG22 ILE 8 HG22 ILE 8 34.843 -32.221 1.875 97 HG23 ILE 8 HG23 ILE 8 33.962 -32.496 3.362 98 HD11 ILE 8 HD11 ILE 8 36.750 -32.675 0.734 99 HD12 ILE 8 HD12 ILE 8 37.674 -34.094 0.229 100 HD13 ILE 8 HD13 ILE 8 35.909 -34.096 0.057 101 H GLU 9 H GLU 9 33.185 -36.387 3.675 102 HA GLU 9 HA GLU 9 31.266 -35.159 5.599 103 HB2 GLU 9 HB2 GLU 9 30.737 -35.718 2.650 104 HB3 GLU 9 HB3 GLU 9 29.502 -35.315 3.848 105 HG2 GLU 9 HG2 GLU 9 30.680 -33.146 4.294 106 HG3 GLU 9 HG3 GLU 9 31.794 -33.514 2.973 107 H GLN 10 H GLN 10 29.265 -36.520 5.821 108 HA GLN 10 HA GLN 10 29.822 -39.443 5.688 109 HB2 GLN 10 HB2 GLN 10 30.485 -38.390 7.880 110 HB3 GLN 10 HB3 GLN 10 28.794 -37.976 8.149 111 HG2 GLN 10 HG2 GLN 10 28.191 -40.367 8.179 112 HG3 GLN 10 HG3 GLN 10 29.834 -40.815 7.701 113 HE21 GLN 10 HE21 GLN 10 31.184 -40.202 11.018 114 HE22 GLN 10 HE22 GLN 10 31.628 -40.148 9.317 115 H ILE 11 H ILE 11 27.813 -40.746 6.181 116 HA ILE 11 HA ILE 11 25.487 -39.582 4.752 117 HB ILE 11 HB ILE 11 25.151 -41.854 3.804 118 HG12 ILE 11 HG12 ILE 11 28.040 -42.398 4.661 119 HG13 ILE 11 HG13 ILE 11 26.629 -43.166 5.384 120 HG21 ILE 11 HG21 ILE 11 27.773 -40.484 3.060 121 HG22 ILE 11 HG22 ILE 11 26.730 -41.441 1.986 122 HG23 ILE 11 HG23 ILE 11 26.159 -39.896 2.610 123 HD11 ILE 11 HD11 ILE 11 27.560 -43.490 2.513 124 HD12 ILE 11 HD12 ILE 11 27.588 -44.689 3.812 125 HD13 ILE 11 HD13 ILE 11 26.032 -44.137 3.163 126 H GLN 12 H GLN 12 23.937 -39.288 6.000 127 HA GLN 12 HA GLN 12 22.865 -41.389 7.797 128 HB2 GLN 12 HB2 GLN 12 22.682 -39.839 9.693 129 HB3 GLN 12 HB3 GLN 12 24.333 -40.199 9.261 130 HG2 GLN 12 HG2 GLN 12 22.915 -37.638 8.397 131 HG3 GLN 12 HG3 GLN 12 23.833 -37.786 9.891 132 HE21 GLN 12 HE21 GLN 12 25.863 -36.988 6.530 133 HE22 GLN 12 HE22 GLN 12 24.162 -36.594 6.812 134 H LYS 13 H LYS 13 21.871 -40.455 5.306 135 HA LYS 13 HA LYS 13 20.011 -39.813 4.194 136 HB2 LYS 13 HB2 LYS 13 18.610 -40.418 6.819 137 HB3 LYS 13 HB3 LYS 13 17.815 -40.200 5.263 138 HG2 LYS 13 HG2 LYS 13 19.053 -42.119 4.320 139 HG3 LYS 13 HG3 LYS 13 19.836 -42.390 5.891 140 HD2 LYS 13 HD2 LYS 13 17.642 -42.764 6.951 141 HD3 LYS 13 HD3 LYS 13 16.820 -42.432 5.410 142 HE2 LYS 13 HE2 LYS 13 17.975 -44.359 4.369 143 HE3 LYS 13 HE3 LYS 13 18.813 -44.694 5.890 144 HZ1 LYS 13 HZ1 LYS 13 15.863 -44.785 5.520 145 HZ2 LYS 13 HZ2 LYS 13 16.835 -46.088 5.630 146 HZ3 LYS 13 HZ3 LYS 13 16.644 -45.109 6.920 147 H GLU 14 H GLU 14 21.297 -37.638 6.145 148 HA GLU 14 HA GLU 14 19.767 -35.503 4.908 149 HB2 GLU 14 HB2 GLU 14 19.316 -34.237 6.903 150 HB3 GLU 14 HB3 GLU 14 18.543 -35.797 7.001 151 HG2 GLU 14 HG2 GLU 14 19.322 -35.473 9.151 152 HG3 GLU 14 HG3 GLU 14 20.487 -36.589 8.465 153 H ALA 15 H ALA 15 20.941 -33.618 4.701 154 HA ALA 15 HA ALA 15 23.689 -33.387 5.721 155 HB1 ALA 15 HB1 ALA 15 23.161 -33.741 2.736 156 HB2 ALA 15 HB2 ALA 15 24.711 -33.273 3.476 157 HB3 ALA 15 HB3 ALA 15 24.020 -34.865 3.803 158 H ILE 16 H ILE 16 22.242 -31.913 2.848 159 HA ILE 16 HA ILE 16 21.965 -29.312 4.271 160 HB ILE 16 HB ILE 16 23.327 -29.994 1.676 161 HG12 ILE 16 HG12 ILE 16 24.904 -28.064 2.858 162 HG13 ILE 16 HG13 ILE 16 24.182 -28.778 4.286 163 HG21 ILE 16 HG21 ILE 16 22.460 -27.175 2.433 164 HG22 ILE 16 HG22 ILE 16 23.563 -27.593 1.103 165 HG23 ILE 16 HG23 ILE 16 21.892 -28.123 1.032 166 HD11 ILE 16 HD11 ILE 16 25.721 -30.266 2.103 167 HD12 ILE 16 HD12 ILE 16 26.357 -29.789 3.689 168 HD13 ILE 16 HD13 ILE 16 25.077 -31.001 3.587 169 H ASN 17 H ASN 17 20.398 -31.520 2.474 170 HA ASN 17 HA ASN 17 18.894 -29.809 0.814 171 HB2 ASN 17 HB2 ASN 17 18.244 -32.661 1.697 172 HB3 ASN 17 HB3 ASN 17 17.511 -31.841 0.321 173 HD21 ASN 17 HD21 ASN 17 20.969 -33.735 -0.276 174 HD22 ASN 17 HD22 ASN 17 19.954 -33.993 1.133 175 H SER 18 H SER 18 18.355 -30.501 4.115 176 HA SER 18 HA SER 18 15.531 -29.576 4.099 177 HB2 SER 18 HB2 SER 18 17.300 -30.383 6.431 178 HB3 SER 18 HB3 SER 18 15.565 -30.020 6.492 179 HG SER 18 HG SER 18 15.961 -32.275 6.339 180 H ASN 19 H ASN 19 18.713 -28.443 5.386 181 HA ASN 19 HA ASN 19 17.468 -26.047 6.461 182 HB2 ASN 19 HB2 ASN 19 19.605 -25.509 7.377 183 HB3 ASN 19 HB3 ASN 19 19.318 -27.222 7.621 184 HD21 ASN 19 HD21 ASN 19 22.321 -28.070 5.978 185 HD22 ASN 19 HD22 ASN 19 21.009 -28.578 7.025 186 H VAL 20 H VAL 20 18.768 -26.765 3.398 187 HA VAL 20 HA VAL 20 19.377 -24.030 2.664 188 HB VAL 20 HB VAL 20 20.368 -26.078 1.644 189 HG11 VAL 20 HG11 VAL 20 17.876 -26.166 -0.095 190 HG12 VAL 20 HG12 VAL 20 19.300 -27.216 -0.178 191 HG13 VAL 20 HG13 VAL 20 18.215 -27.318 1.217 192 HG21 VAL 20 HG21 VAL 20 20.666 -23.842 0.661 193 HG22 VAL 20 HG22 VAL 20 20.673 -25.134 -0.549 194 HG23 VAL 20 HG23 VAL 20 19.240 -24.107 -0.366 195 H VAL 21 H VAL 21 16.403 -25.681 3.034 196 HA VAL 21 HA VAL 21 14.912 -23.616 1.463 197 HB VAL 21 HB VAL 21 13.835 -26.374 2.120 198 HG11 VAL 21 HG11 VAL 21 13.040 -24.258 0.055 199 HG12 VAL 21 HG12 VAL 21 12.234 -25.818 0.328 200 HG13 VAL 21 HG13 VAL 21 12.179 -24.572 1.574 201 HG21 VAL 21 HG21 VAL 21 15.713 -26.799 0.665 202 HG22 VAL 21 HG22 VAL 21 14.241 -26.912 -0.289 203 HG23 VAL 21 HG23 VAL 21 15.254 -25.455 -0.412 204 H LEU 22 H LEU 22 15.433 -22.391 3.467 205 HA LEU 22 HA LEU 22 13.368 -22.805 5.579 206 HB2 LEU 22 HB2 LEU 22 16.114 -23.134 5.825 207 HB3 LEU 22 HB3 LEU 22 15.888 -21.501 6.415 208 HG LEU 22 HG LEU 22 14.486 -24.029 7.417 209 HD11 LEU 22 HD11 LEU 22 16.616 -22.286 8.722 210 HD12 LEU 22 HD12 LEU 22 15.846 -23.719 9.440 211 HD13 LEU 22 HD13 LEU 22 16.878 -23.893 8.010 212 HD21 LEU 22 HD21 LEU 22 13.010 -22.087 7.753 213 HD22 LEU 22 HD22 LEU 22 13.662 -22.650 9.298 214 HD23 LEU 22 HD23 LEU 22 14.338 -21.196 8.528 215 H LYS 23 H LYS 23 13.351 -21.140 3.245 216 HA LYS 23 HA LYS 23 13.307 -18.341 4.196 217 HB2 LYS 23 HB2 LYS 23 14.711 -19.163 2.246 218 HB3 LYS 23 HB3 LYS 23 13.215 -19.395 1.335 219 HG2 LYS 23 HG2 LYS 23 12.735 -17.021 1.434 220 HG3 LYS 23 HG3 LYS 23 14.031 -16.762 2.623 221 HD2 LYS 23 HD2 LYS 23 15.729 -17.406 0.971 222 HD3 LYS 23 HD3 LYS 23 14.492 -17.716 -0.248 223 HE2 LYS 23 HE2 LYS 23 14.875 -14.999 1.092 224 HE3 LYS 23 HE3 LYS 23 15.782 -15.481 -0.342 225 HZ1 LYS 23 HZ1 LYS 23 12.822 -15.344 -0.225 226 HZ2 LYS 23 HZ2 LYS 23 13.790 -14.226 -0.935 227 HZ3 LYS 23 HZ3 LYS 23 13.709 -15.740 -1.543 228 H ASN 24 H ASN 24 11.370 -19.700 5.289 229 HA ASN 24 HA ASN 24 9.175 -20.113 5.617 230 HB2 ASN 24 HB2 ASN 24 9.591 -17.667 5.912 231 HB3 ASN 24 HB3 ASN 24 8.897 -17.392 4.318 232 HD21 ASN 24 HD21 ASN 24 5.538 -17.934 5.441 233 HD22 ASN 24 HD22 ASN 24 6.615 -17.984 4.031 234 HA PRO 25 HA PRO 25 8.367 -21.337 1.202 235 HB2 PRO 25 HB2 PRO 25 9.021 -23.956 1.141 236 HB3 PRO 25 HB3 PRO 25 10.277 -22.701 1.340 237 HG2 PRO 25 HG2 PRO 25 8.868 -24.246 3.563 238 HG3 PRO 25 HG3 PRO 25 10.633 -24.140 3.270 239 HD2 PRO 25 HD2 PRO 25 9.374 -22.453 4.995 240 HD3 PRO 25 HD3 PRO 25 10.719 -21.905 3.952 241 H ARG 26 H ARG 26 6.343 -20.897 2.992 242 HA ARG 26 HA ARG 26 4.353 -23.083 2.452 243 HB2 ARG 26 HB2 ARG 26 3.721 -23.249 4.725 244 HB3 ARG 26 HB3 ARG 26 5.482 -23.377 4.650 245 HG2 ARG 26 HG2 ARG 26 5.646 -20.956 5.341 246 HG3 ARG 26 HG3 ARG 26 3.879 -20.923 5.487 247 HD2 ARG 26 HD2 ARG 26 4.055 -22.810 7.163 248 HD3 ARG 26 HD3 ARG 26 5.806 -22.642 7.086 249 HE ARG 26 HE ARG 26 5.702 -20.578 8.214 250 HH11 ARG 26 HH11 ARG 26 4.782 -19.159 9.639 251 HH12 ARG 26 HH12 ARG 26 3.066 -19.181 9.913 252 HH21 ARG 26 HH21 ARG 26 2.426 -21.744 7.728 253 HH22 ARG 26 HH22 ARG 26 1.764 -20.610 8.871 254 H VAL 27 H VAL 27 4.819 -19.709 2.749 255 HA VAL 27 HA VAL 27 3.393 -17.878 2.776 256 HB VAL 27 HB VAL 27 2.656 -19.306 0.218 257 HG11 VAL 27 HG11 VAL 27 2.885 -16.329 0.919 258 HG12 VAL 27 HG12 VAL 27 2.549 -16.991 -0.694 259 HG13 VAL 27 HG13 VAL 27 1.366 -17.186 0.596 260 HG21 VAL 27 HG21 VAL 27 5.088 -19.325 0.457 261 HG22 VAL 27 HG22 VAL 27 4.630 -18.105 -0.723 262 HG23 VAL 27 HG23 VAL 27 5.091 -17.605 0.918 263 HA PRO 28 HA PRO 28 -0.612 -19.593 4.308 264 HB2 PRO 28 HB2 PRO 28 -0.880 -18.086 6.560 265 HB3 PRO 28 HB3 PRO 28 0.118 -19.571 6.482 266 HG2 PRO 28 HG2 PRO 28 1.041 -16.695 6.209 267 HG3 PRO 28 HG3 PRO 28 1.752 -17.985 7.227 268 HD2 PRO 28 HD2 PRO 28 2.751 -17.332 4.776 269 HD3 PRO 28 HD3 PRO 28 2.749 -19.021 5.362 270 H THR 29 H THR 29 -2.650 -18.454 4.882 271 HA THR 29 HA THR 29 -3.107 -16.337 2.875 272 HB THR 29 HB THR 29 -5.374 -17.519 2.802 273 HG1 THR 29 HG1 THR 29 -5.441 -19.581 3.664 274 HG21 THR 29 HG21 THR 29 -2.948 -19.226 2.111 275 HG22 THR 29 HG22 THR 29 -4.583 -19.381 1.432 276 HG23 THR 29 HG23 THR 29 -3.625 -17.931 1.098 277 H GLN 30 H GLN 30 -2.445 -15.101 5.063 278 HA GLN 30 HA GLN 30 -4.777 -14.529 6.654 279 HB2 GLN 30 HB2 GLN 30 -3.365 -12.990 7.920 280 HB3 GLN 30 HB3 GLN 30 -2.598 -14.551 7.722 281 HG2 GLN 30 HG2 GLN 30 -1.928 -12.465 5.654 282 HG3 GLN 30 HG3 GLN 30 -1.348 -12.162 7.290 283 HE21 GLN 30 HE21 GLN 30 0.699 -14.737 5.012 284 HE22 GLN 30 HE22 GLN 30 -0.478 -13.613 4.369 285 H LYS 31 H LYS 31 -5.271 -13.948 3.970 286 HA LYS 31 HA LYS 31 -5.552 -11.023 3.677 287 HB2 LYS 31 HB2 LYS 31 -5.889 -13.490 1.998 288 HB3 LYS 31 HB3 LYS 31 -6.769 -12.054 1.482 289 HG2 LYS 31 HG2 LYS 31 -3.819 -11.764 2.087 290 HG3 LYS 31 HG3 LYS 31 -4.315 -12.584 0.612 291 HD2 LYS 31 HD2 LYS 31 -3.936 -10.244 0.100 292 HD3 LYS 31 HD3 LYS 31 -5.625 -10.666 -0.122 293 HE2 LYS 31 HE2 LYS 31 -5.712 -8.563 0.904 294 HE3 LYS 31 HE3 LYS 31 -6.072 -9.689 2.210 295 HZ1 LYS 31 HZ1 LYS 31 -3.497 -8.291 1.683 296 HZ2 LYS 31 HZ2 LYS 31 -4.457 -8.112 2.986 297 HZ3 LYS 31 HZ3 LYS 31 -3.618 -9.503 2.784 298 H THR 32 H THR 32 -6.752 -11.124 5.763 299 HA THR 32 HA THR 32 -9.693 -11.202 5.269 300 HB THR 32 HB THR 32 -8.852 -13.414 6.068 301 HG1 THR 32 HG1 THR 32 -10.480 -13.689 7.555 302 HG21 THR 32 HG21 THR 32 -8.356 -12.004 8.720 303 HG22 THR 32 HG22 THR 32 -8.240 -13.745 8.390 304 HG23 THR 32 HG23 THR 32 -7.098 -12.628 7.631 305 H GLY 33 H GLY 33 -7.499 -9.081 5.963 306 HA2 GLY 33 HA2 GLY 33 -8.407 -8.035 8.571 307 HA3 GLY 33 HA3 GLY 33 -7.098 -7.422 7.572 308 H GLU 34 H GLU 34 -7.567 -6.085 5.812 309 HA GLU 34 HA GLU 34 -10.205 -4.671 5.837 310 HB2 GLU 34 HB2 GLU 34 -7.513 -3.354 6.383 311 HB3 GLU 34 HB3 GLU 34 -9.043 -2.503 6.128 312 HG2 GLU 34 HG2 GLU 34 -10.009 -3.724 8.099 313 HG3 GLU 34 HG3 GLU 34 -8.399 -4.370 8.435 314 H LEU 35 H LEU 35 -9.020 -6.355 3.747 315 HA LEU 35 HA LEU 35 -9.091 -4.390 1.553 316 HB2 LEU 35 HB2 LEU 35 -7.009 -6.596 1.805 317 HB3 LEU 35 HB3 LEU 35 -7.460 -5.820 0.296 318 HG LEU 35 HG LEU 35 -6.931 -3.577 1.698 319 HD11 LEU 35 HD11 LEU 35 -4.992 -5.636 2.841 320 HD12 LEU 35 HD12 LEU 35 -4.896 -3.876 3.041 321 HD13 LEU 35 HD13 LEU 35 -6.237 -4.770 3.767 322 HD21 LEU 35 HD21 LEU 35 -5.951 -4.190 -0.463 323 HD22 LEU 35 HD22 LEU 35 -4.688 -3.624 0.641 324 HD23 LEU 35 HD23 LEU 35 -4.890 -5.366 0.324 325 H SER 36 H SER 36 -10.443 -4.827 0.165 326 HA SER 36 HA SER 36 -11.700 -7.523 -0.237 327 HB2 SER 36 HB2 SER 36 -13.200 -5.872 0.760 328 HB3 SER 36 HB3 SER 36 -12.925 -4.789 -0.614 329 HG SER 36 HG SER 36 -14.832 -6.114 -0.820 330 H GLU 37 H GLU 37 -11.699 -4.699 -2.329 331 HA GLU 37 HA GLU 37 -10.118 -6.166 -4.338 332 HB2 GLU 37 HB2 GLU 37 -12.835 -6.630 -4.195 333 HB3 GLU 37 HB3 GLU 37 -12.793 -5.262 -5.328 334 HG2 GLU 37 HG2 GLU 37 -10.987 -6.538 -6.594 335 HG3 GLU 37 HG3 GLU 37 -11.269 -7.885 -5.480 336 H GLU 38 H GLU 38 -12.051 -3.278 -3.574 337 HA GLU 38 HA GLU 38 -10.795 -1.576 -5.545 338 HB2 GLU 38 HB2 GLU 38 -12.992 -1.154 -4.635 339 HB3 GLU 38 HB3 GLU 38 -12.377 -0.975 -3.009 340 HG2 GLU 38 HG2 GLU 38 -11.235 0.819 -5.158 341 HG3 GLU 38 HG3 GLU 38 -12.914 1.055 -4.709 342 H GLN 39 H GLN 39 -9.911 -2.631 -2.295 343 HA GLN 39 HA GLN 39 -7.908 -0.580 -1.867 344 HB2 GLN 39 HB2 GLN 39 -8.354 -3.265 -0.527 345 HB3 GLN 39 HB3 GLN 39 -7.153 -2.068 -0.048 346 HG2 GLN 39 HG2 GLN 39 -8.923 -1.621 1.405 347 HG3 GLN 39 HG3 GLN 39 -9.082 -0.376 0.176 348 HE21 GLN 39 HE21 GLN 39 -12.420 -1.395 -0.503 349 HE22 GLN 39 HE22 GLN 39 -11.172 -0.185 -0.793 350 H LYS 40 H LYS 40 -7.790 -3.787 -3.390 351 HA LYS 40 HA LYS 40 -4.885 -3.755 -3.781 352 HB2 LYS 40 HB2 LYS 40 -7.207 -5.283 -5.002 353 HB3 LYS 40 HB3 LYS 40 -5.573 -5.471 -5.652 354 HG2 LYS 40 HG2 LYS 40 -4.718 -6.476 -3.799 355 HG3 LYS 40 HG3 LYS 40 -5.817 -5.686 -2.680 356 HD2 LYS 40 HD2 LYS 40 -7.425 -7.359 -4.418 357 HD3 LYS 40 HD3 LYS 40 -6.050 -8.320 -3.833 358 HE2 LYS 40 HE2 LYS 40 -6.569 -7.569 -1.505 359 HE3 LYS 40 HE3 LYS 40 -7.957 -6.658 -2.129 360 HZ1 LYS 40 HZ1 LYS 40 -7.693 -9.605 -2.502 361 HZ2 LYS 40 HZ2 LYS 40 -8.481 -8.948 -1.224 362 HZ3 LYS 40 HZ3 LYS 40 -9.038 -8.675 -2.715 363 H LYS 41 H LYS 41 -7.631 -2.683 -5.663 364 HA LYS 41 HA LYS 41 -6.093 -1.635 -7.882 365 HB2 LYS 41 HB2 LYS 41 -8.796 -0.668 -6.869 366 HB3 LYS 41 HB3 LYS 41 -8.092 -0.282 -8.433 367 HG2 LYS 41 HG2 LYS 41 -8.197 -2.609 -9.143 368 HG3 LYS 41 HG3 LYS 41 -8.764 -3.111 -7.549 369 HD2 LYS 41 HD2 LYS 41 -10.746 -1.505 -7.891 370 HD3 LYS 41 HD3 LYS 41 -10.262 -1.417 -9.584 371 HE2 LYS 41 HE2 LYS 41 -10.942 -3.974 -8.045 372 HE3 LYS 41 HE3 LYS 41 -12.078 -3.087 -9.063 373 HZ1 LYS 41 HZ1 LYS 41 -9.580 -4.369 -10.035 374 HZ2 LYS 41 HZ2 LYS 41 -11.095 -4.923 -10.277 375 HZ3 LYS 41 HZ3 LYS 41 -10.626 -3.524 -10.969 376 H ILE 42 H ILE 42 -5.829 -0.675 -4.752 377 HA ILE 42 HA ILE 42 -4.608 1.940 -5.543 378 HB ILE 42 HB ILE 42 -5.696 0.965 -2.897 379 HG12 ILE 42 HG12 ILE 42 -6.502 3.597 -4.102 380 HG13 ILE 42 HG13 ILE 42 -7.081 2.170 -4.937 381 HG21 ILE 42 HG21 ILE 42 -4.160 3.546 -3.389 382 HG22 ILE 42 HG22 ILE 42 -5.032 3.110 -1.903 383 HG23 ILE 42 HG23 ILE 42 -3.628 2.178 -2.386 384 HD11 ILE 42 HD11 ILE 42 -7.536 2.724 -1.990 385 HD12 ILE 42 HD12 ILE 42 -8.730 2.829 -3.311 386 HD13 ILE 42 HD13 ILE 42 -8.036 1.265 -2.874 387 H VAL 43 H VAL 43 -4.085 -0.914 -3.358 388 HA VAL 43 HA VAL 43 -1.312 -0.240 -2.950 389 HB VAL 43 HB VAL 43 -2.760 -2.848 -2.359 390 HG11 VAL 43 HG11 VAL 43 -0.054 -1.786 -1.411 391 HG12 VAL 43 HG12 VAL 43 -0.879 -3.202 -0.736 392 HG13 VAL 43 HG13 VAL 43 -0.327 -3.234 -2.403 393 HG21 VAL 43 HG21 VAL 43 -3.705 -0.912 -1.139 394 HG22 VAL 43 HG22 VAL 43 -2.830 -1.980 -0.044 395 HG23 VAL 43 HG23 VAL 43 -2.076 -0.469 -0.588 396 H ALA 44 H ALA 44 -2.710 -3.042 -4.780 397 HA ALA 44 HA ALA 44 -0.125 -3.832 -5.802 398 HB1 ALA 44 HB1 ALA 44 -2.919 -4.554 -6.759 399 HB2 ALA 44 HB2 ALA 44 -1.396 -5.403 -7.134 400 HB3 ALA 44 HB3 ALA 44 -2.001 -5.387 -5.468 401 H ASP 45 H ASP 45 -2.694 -1.731 -6.948 402 HA ASP 45 HA ASP 45 -1.585 -1.076 -9.527 403 HB2 ASP 45 HB2 ASP 45 -3.916 -0.617 -8.676 404 HB3 ASP 45 HB3 ASP 45 -3.243 0.674 -7.678 405 H TYR 46 H TYR 46 -0.343 -0.321 -6.409 406 HA TYR 46 HA TYR 46 1.455 1.781 -7.486 407 HB2 TYR 46 HB2 TYR 46 0.225 1.641 -5.085 408 HB3 TYR 46 HB3 TYR 46 1.683 0.764 -4.675 409 HD1 TYR 46 HD1 TYR 46 0.526 3.543 -3.709 410 HD2 TYR 46 HD2 TYR 46 3.610 2.401 -6.469 411 HE1 TYR 46 HE1 TYR 46 1.664 5.727 -3.333 412 HE2 TYR 46 HE2 TYR 46 4.667 4.603 -6.247 413 HH TYR 46 HH TYR 46 3.322 7.200 -4.189 414 H ILE 47 H ILE 47 1.475 -1.584 -6.259 415 HA ILE 47 HA ILE 47 4.303 -1.980 -6.397 416 HB ILE 47 HB ILE 47 2.044 -4.002 -6.661 417 HG12 ILE 47 HG12 ILE 47 1.640 -3.067 -4.572 418 HG13 ILE 47 HG13 ILE 47 2.645 -4.427 -4.169 419 HG21 ILE 47 HG21 ILE 47 4.911 -4.532 -5.817 420 HG22 ILE 47 HG22 ILE 47 3.576 -5.701 -5.855 421 HG23 ILE 47 HG23 ILE 47 4.172 -5.017 -7.362 422 HD11 ILE 47 HD11 ILE 47 3.490 -1.493 -4.293 423 HD12 ILE 47 HD12 ILE 47 3.313 -2.511 -2.858 424 HD13 ILE 47 HD13 ILE 47 4.619 -2.847 -4.016 425 H SER 48 H SER 48 1.892 -2.061 -8.977 426 HA SER 48 HA SER 48 3.641 -3.079 -11.046 427 HB2 SER 48 HB2 SER 48 1.998 -1.800 -12.533 428 HB3 SER 48 HB3 SER 48 1.322 -3.097 -11.517 429 HG SER 48 HG SER 48 0.114 -1.105 -11.513 430 H GLU 49 H GLU 49 3.640 0.019 -9.399 431 HA GLU 49 HA GLU 49 4.345 1.447 -11.879 432 HB2 GLU 49 HB2 GLU 49 2.327 1.941 -10.396 433 HB3 GLU 49 HB3 GLU 49 3.470 2.529 -9.187 434 HG2 GLU 49 HG2 GLU 49 2.706 4.418 -10.330 435 HG3 GLU 49 HG3 GLU 49 4.338 4.139 -10.938 436 H VAL 50 H VAL 50 5.558 1.132 -8.523 437 HA VAL 50 HA VAL 50 8.130 2.377 -9.426 438 HB VAL 50 HB VAL 50 8.351 3.559 -7.368 439 HG11 VAL 50 HG11 VAL 50 5.525 4.021 -8.347 440 HG12 VAL 50 HG12 VAL 50 6.596 5.165 -7.510 441 HG13 VAL 50 HG13 VAL 50 6.999 4.616 -9.143 442 HG21 VAL 50 HG21 VAL 50 7.422 1.991 -5.768 443 HG22 VAL 50 HG22 VAL 50 6.617 3.555 -5.634 444 HG23 VAL 50 HG23 VAL 50 5.803 2.193 -6.452 445 H GLY 51 H GLY 51 6.812 -0.358 -7.800 446 HA2 GLY 51 HA2 GLY 51 8.510 -2.249 -8.066 447 HA3 GLY 51 HA3 GLY 51 9.530 -1.296 -6.980 448 H LEU 52 H LEU 52 8.921 -1.001 -4.910 449 HA LEU 52 HA LEU 52 6.538 -1.945 -3.643 450 HB2 LEU 52 HB2 LEU 52 7.340 -3.834 -2.391 451 HB3 LEU 52 HB3 LEU 52 7.507 -4.161 -4.088 452 HG LEU 52 HG LEU 52 10.038 -3.179 -3.473 453 HD11 LEU 52 HD11 LEU 52 9.239 -4.984 -1.153 454 HD12 LEU 52 HD12 LEU 52 10.800 -4.201 -1.432 455 HD13 LEU 52 HD13 LEU 52 9.381 -3.229 -0.994 456 HD21 LEU 52 HD21 LEU 52 9.575 -5.170 -4.807 457 HD22 LEU 52 HD22 LEU 52 10.774 -5.520 -3.549 458 HD23 LEU 52 HD23 LEU 52 9.092 -6.066 -3.351 459 H ASN 53 H ASN 53 9.845 -0.985 -3.338 460 HA ASN 53 HA ASN 53 9.526 -0.021 -0.564 461 HB2 ASN 53 HB2 ASN 53 11.931 -0.178 -0.473 462 HB3 ASN 53 HB3 ASN 53 11.309 -1.662 -1.179 463 HD21 ASN 53 HD21 ASN 53 13.891 0.579 -3.310 464 HD22 ASN 53 HD22 ASN 53 13.567 0.860 -1.607 465 H ASN 54 H ASN 54 9.584 1.373 -3.686 466 HA ASN 54 HA ASN 54 10.821 3.907 -2.820 467 HB2 ASN 54 HB2 ASN 54 9.706 3.089 -5.525 468 HB3 ASN 54 HB3 ASN 54 10.718 4.491 -5.186 469 HD21 ASN 54 HD21 ASN 54 12.466 0.943 -5.886 470 HD22 ASN 54 HD22 ASN 54 10.823 1.353 -6.362 471 H LEU 55 H LEU 55 7.632 2.633 -3.179 472 HA LEU 55 HA LEU 55 6.141 5.125 -3.117 473 HB2 LEU 55 HB2 LEU 55 4.249 3.660 -2.588 474 HB3 LEU 55 HB3 LEU 55 5.191 3.081 -3.941 475 HG LEU 55 HG LEU 55 6.364 1.535 -2.120 476 HD11 LEU 55 HD11 LEU 55 3.593 2.021 -0.942 477 HD12 LEU 55 HD12 LEU 55 4.709 0.713 -0.498 478 HD13 LEU 55 HD13 LEU 55 5.141 2.391 -0.151 479 HD21 LEU 55 HD21 LEU 55 5.121 0.758 -4.102 480 HD22 LEU 55 HD22 LEU 55 4.750 -0.209 -2.667 481 HD23 LEU 55 HD23 LEU 55 3.589 1.011 -3.236 482 H ASN 56 H ASN 56 4.741 5.732 -1.195 483 HA ASN 56 HA ASN 56 6.105 5.164 1.390 484 HB2 ASN 56 HB2 ASN 56 5.823 7.358 2.140 485 HB3 ASN 56 HB3 ASN 56 6.502 7.487 0.531 486 HD21 ASN 56 HD21 ASN 56 4.037 10.014 0.178 487 HD22 ASN 56 HD22 ASN 56 5.749 9.686 0.429 488 H ALA 57 H ALA 57 4.636 5.673 3.241 489 HA ALA 57 HA ALA 57 2.311 3.893 3.040 490 HB1 ALA 57 HB1 ALA 57 3.763 5.328 5.300 491 HB2 ALA 57 HB2 ALA 57 2.463 4.137 5.532 492 HB3 ALA 57 HB3 ALA 57 3.998 3.647 4.777 493 H THR 58 H THR 58 2.891 7.322 3.109 494 HA THR 58 HA THR 58 0.467 8.260 4.299 495 HB THR 58 HB THR 58 2.275 9.675 2.309 496 HG1 THR 58 HG1 THR 58 3.336 10.402 4.173 497 HG21 THR 58 HG21 THR 58 0.399 10.713 4.477 498 HG22 THR 58 HG22 THR 58 1.551 11.710 3.551 499 HG23 THR 58 HG23 THR 58 0.218 10.904 2.717 500 H GLU 59 H GLU 59 1.403 7.861 0.835 501 HA GLU 59 HA GLU 59 -1.135 8.745 -0.199 502 HB2 GLU 59 HB2 GLU 59 0.895 6.900 -1.508 503 HB3 GLU 59 HB3 GLU 59 -0.455 7.723 -2.306 504 HG2 GLU 59 HG2 GLU 59 0.622 9.920 -1.351 505 HG3 GLU 59 HG3 GLU 59 2.068 8.919 -1.142 506 H LEU 60 H LEU 60 0.064 5.386 0.332 507 HA LEU 60 HA LEU 60 -2.337 3.995 -0.164 508 HB2 LEU 60 HB2 LEU 60 0.017 3.536 1.674 509 HB3 LEU 60 HB3 LEU 60 -1.439 2.596 1.949 510 HG LEU 60 HG LEU 60 -1.410 1.851 -0.446 511 HD11 LEU 60 HD11 LEU 60 1.386 3.060 -0.414 512 HD12 LEU 60 HD12 LEU 60 0.728 1.996 -1.673 513 HD13 LEU 60 HD13 LEU 60 0.026 3.602 -1.419 514 HD21 LEU 60 HD21 LEU 60 -0.605 0.415 1.354 515 HD22 LEU 60 HD22 LEU 60 0.445 0.223 -0.062 516 HD23 LEU 60 HD23 LEU 60 0.982 1.205 1.318 517 H SER 61 H SER 61 -1.407 5.364 3.067 518 HA SER 61 HA SER 61 -3.874 4.649 4.272 519 HB2 SER 61 HB2 SER 61 -3.204 6.199 6.105 520 HB3 SER 61 HB3 SER 61 -2.018 4.954 5.689 521 HG SER 61 HG SER 61 -0.785 6.446 4.677 522 H LYS 62 H LYS 62 -3.140 7.362 2.288 523 HA LYS 62 HA LYS 62 -5.449 9.030 3.018 524 HB2 LYS 62 HB2 LYS 62 -3.429 9.028 0.753 525 HB3 LYS 62 HB3 LYS 62 -4.861 10.047 0.671 526 HG2 LYS 62 HG2 LYS 62 -4.264 11.304 2.577 527 HG3 LYS 62 HG3 LYS 62 -2.996 10.173 3.064 528 HD2 LYS 62 HD2 LYS 62 -1.625 10.721 1.143 529 HD3 LYS 62 HD3 LYS 62 -2.907 11.694 0.413 530 HE2 LYS 62 HE2 LYS 62 -1.599 12.347 3.093 531 HE3 LYS 62 HE3 LYS 62 -1.035 12.985 1.545 532 HZ1 LYS 62 HZ1 LYS 62 -3.739 13.462 2.682 533 HZ2 LYS 62 HZ2 LYS 62 -2.527 14.550 2.615 534 HZ3 LYS 62 HZ3 LYS 62 -3.217 14.022 1.236 535 H ARG 63 H ARG 63 -4.754 6.798 0.299 536 HA ARG 63 HA ARG 63 -7.474 7.048 -0.801 537 HB2 ARG 63 HB2 ARG 63 -5.029 5.378 -1.449 538 HB3 ARG 63 HB3 ARG 63 -6.603 4.956 -2.117 539 HG2 ARG 63 HG2 ARG 63 -5.457 6.210 -3.749 540 HG3 ARG 63 HG3 ARG 63 -6.812 7.175 -3.163 541 HD2 ARG 63 HD2 ARG 63 -5.284 8.586 -1.849 542 HD3 ARG 63 HD3 ARG 63 -3.940 7.502 -2.214 543 HE ARG 63 HE ARG 63 -3.683 8.417 -4.302 544 HH11 ARG 63 HH11 ARG 63 -3.962 9.863 -5.943 545 HH12 ARG 63 HH12 ARG 63 -5.360 10.895 -5.971 546 HH21 ARG 63 HH21 ARG 63 -6.724 9.668 -3.074 547 HH22 ARG 63 HH22 ARG 63 -6.885 10.793 -4.394 548 H LEU 64 H LEU 64 -5.812 4.613 1.176 549 HA LEU 64 HA LEU 64 -8.096 2.791 1.222 550 HB2 LEU 64 HB2 LEU 64 -5.545 2.879 2.861 551 HB3 LEU 64 HB3 LEU 64 -6.667 1.526 2.816 552 HG LEU 64 HG LEU 64 -5.136 2.515 0.366 553 HD11 LEU 64 HD11 LEU 64 -4.508 0.172 2.204 554 HD12 LEU 64 HD12 LEU 64 -3.620 0.674 0.747 555 HD13 LEU 64 HD13 LEU 64 -3.624 1.714 2.169 556 HD21 LEU 64 HD21 LEU 64 -7.170 1.221 -0.155 557 HD22 LEU 64 HD22 LEU 64 -5.709 0.293 -0.529 558 HD23 LEU 64 HD23 LEU 64 -6.628 -0.062 0.952 559 H ASN 65 H ASN 65 -7.041 5.459 3.228 560 HA ASN 65 HA ASN 65 -7.836 6.436 5.074 561 HB2 ASN 65 HB2 ASN 65 -9.962 6.374 3.707 562 HB3 ASN 65 HB3 ASN 65 -10.479 4.999 4.682 563 HD21 ASN 65 HD21 ASN 65 -10.968 7.036 7.643 564 HD22 ASN 65 HD22 ASN 65 -10.395 5.436 7.151 565 H ILE 66 H ILE 66 -6.136 4.897 5.737 566 HA ILE 66 HA ILE 66 -6.932 3.406 8.198 567 HB ILE 66 HB ILE 66 -4.910 1.934 7.824 568 HG12 ILE 66 HG12 ILE 66 -5.057 3.034 5.000 569 HG13 ILE 66 HG13 ILE 66 -3.765 3.350 6.163 570 HG21 ILE 66 HG21 ILE 66 -7.064 1.598 5.718 571 HG22 ILE 66 HG22 ILE 66 -6.045 0.340 6.467 572 HG23 ILE 66 HG23 ILE 66 -7.243 1.190 7.442 573 HD11 ILE 66 HD11 ILE 66 -4.416 0.666 4.892 574 HD12 ILE 66 HD12 ILE 66 -3.087 1.752 4.486 575 HD13 ILE 66 HD13 ILE 66 -3.122 0.970 6.087 576 H THR 67 H THR 67 -4.761 3.152 9.550 577 HA THR 67 HA THR 67 -3.484 5.808 9.817 578 HB THR 67 HB THR 67 -4.031 4.655 11.871 579 HG1 THR 67 HG1 THR 67 -2.039 4.982 12.792 580 HG21 THR 67 HG21 THR 67 -1.929 2.580 11.126 581 HG22 THR 67 HG22 THR 67 -2.834 2.688 12.644 582 HG23 THR 67 HG23 THR 67 -3.679 2.269 11.145 583 H VAL 68 H VAL 68 -1.315 6.202 9.468 584 HA VAL 68 HA VAL 68 -0.007 5.111 7.194 585 HB VAL 68 HB VAL 68 1.315 6.458 9.588 586 HG11 VAL 68 HG11 VAL 68 2.055 6.468 6.630 587 HG12 VAL 68 HG12 VAL 68 2.919 7.318 7.926 588 HG13 VAL 68 HG13 VAL 68 2.907 5.554 7.900 589 HG21 VAL 68 HG21 VAL 68 -0.548 7.906 8.882 590 HG22 VAL 68 HG22 VAL 68 0.986 8.612 8.382 591 HG23 VAL 68 HG23 VAL 68 -0.028 7.778 7.187 592 H ASP 69 H ASP 69 0.169 4.249 10.616 593 HA ASP 69 HA ASP 69 2.455 2.561 10.376 594 HB2 ASP 69 HB2 ASP 69 0.294 2.844 12.503 595 HB3 ASP 69 HB3 ASP 69 1.675 1.765 12.692 596 H LYS 70 H LYS 70 -0.910 1.820 9.714 597 HA LYS 70 HA LYS 70 -0.327 -1.093 9.636 598 HB2 LYS 70 HB2 LYS 70 -2.756 0.605 8.890 599 HB3 LYS 70 HB3 LYS 70 -2.607 -1.088 8.411 600 HG2 LYS 70 HG2 LYS 70 -2.336 -1.761 10.784 601 HG3 LYS 70 HG3 LYS 70 -2.588 -0.076 11.282 602 HD2 LYS 70 HD2 LYS 70 -4.857 -0.101 10.284 603 HD3 LYS 70 HD3 LYS 70 -4.559 -1.707 9.617 604 HE2 LYS 70 HE2 LYS 70 -5.932 -2.031 11.510 605 HE3 LYS 70 HE3 LYS 70 -4.324 -2.626 11.924 606 HZ1 LYS 70 HZ1 LYS 70 -5.447 0.005 12.744 607 HZ2 LYS 70 HZ2 LYS 70 -5.283 -1.292 13.714 608 HZ3 LYS 70 HZ3 LYS 70 -3.953 -0.538 13.150 609 H ALA 71 H ALA 71 -0.357 1.659 7.436 610 HA ALA 71 HA ALA 71 -0.259 0.008 5.009 611 HB1 ALA 71 HB1 ALA 71 0.572 2.916 5.508 612 HB2 ALA 71 HB2 ALA 71 0.377 2.146 3.920 613 HB3 ALA 71 HB3 ALA 71 -1.022 2.386 4.983 614 H LYS 72 H LYS 72 2.214 1.697 6.979 615 HA LYS 72 HA LYS 72 4.404 0.895 5.344 616 HB2 LYS 72 HB2 LYS 72 5.821 1.893 6.858 617 HB3 LYS 72 HB3 LYS 72 4.319 2.796 7.018 618 HG2 LYS 72 HG2 LYS 72 3.797 1.363 9.061 619 HG3 LYS 72 HG3 LYS 72 5.431 0.690 8.916 620 HD2 LYS 72 HD2 LYS 72 6.339 3.064 9.037 621 HD3 LYS 72 HD3 LYS 72 4.687 3.618 9.321 622 HE2 LYS 72 HE2 LYS 72 5.670 3.493 11.462 623 HE3 LYS 72 HE3 LYS 72 4.601 2.095 11.353 624 HZ1 LYS 72 HZ1 LYS 72 7.551 2.034 10.951 625 HZ2 LYS 72 HZ2 LYS 72 6.772 1.518 12.285 626 HZ3 LYS 72 HZ3 LYS 72 6.573 0.723 10.877 627 H THR 73 H THR 73 2.901 -0.933 7.995 628 HA THR 73 HA THR 73 5.051 -2.974 7.742 629 HB THR 73 HB THR 73 4.136 -2.317 9.977 630 HG1 THR 73 HG1 THR 73 4.251 -4.464 10.657 631 HG21 THR 73 HG21 THR 73 1.818 -4.161 9.244 632 HG22 THR 73 HG22 THR 73 2.125 -3.365 10.800 633 HG23 THR 73 HG23 THR 73 1.682 -2.395 9.389 634 H TYR 74 H TYR 74 1.637 -2.555 6.786 635 HA TYR 74 HA TYR 74 1.197 -5.220 5.932 636 HB2 TYR 74 HB2 TYR 74 -0.618 -3.670 6.239 637 HB3 TYR 74 HB3 TYR 74 0.044 -2.573 5.014 638 HD1 TYR 74 HD1 TYR 74 -0.809 -2.668 2.860 639 HD2 TYR 74 HD2 TYR 74 -0.964 -6.183 5.363 640 HE1 TYR 74 HE1 TYR 74 -1.988 -3.879 1.078 641 HE2 TYR 74 HE2 TYR 74 -2.019 -7.451 3.518 642 HH TYR 74 HH TYR 74 -2.733 -5.971 0.337 643 H ILE 75 H ILE 75 2.644 -2.452 4.189 644 HA ILE 75 HA ILE 75 3.028 -3.560 1.637 645 HB ILE 75 HB ILE 75 4.728 -1.694 3.320 646 HG12 ILE 75 HG12 ILE 75 3.230 -1.007 0.768 647 HG13 ILE 75 HG13 ILE 75 2.377 -1.052 2.299 648 HG21 ILE 75 HG21 ILE 75 5.148 -2.531 0.415 649 HG22 ILE 75 HG22 ILE 75 5.927 -1.124 1.156 650 HG23 ILE 75 HG23 ILE 75 6.304 -2.720 1.771 651 HD11 ILE 75 HD11 ILE 75 4.852 0.679 1.817 652 HD12 ILE 75 HD12 ILE 75 3.182 1.244 1.719 653 HD13 ILE 75 HD13 ILE 75 3.833 0.665 3.254 654 H LYS 76 H LYS 76 5.547 -3.753 4.257 655 HA LYS 76 HA LYS 76 7.023 -5.773 2.903 656 HB2 LYS 76 HB2 LYS 76 8.309 -6.045 4.915 657 HB3 LYS 76 HB3 LYS 76 8.039 -4.333 4.595 658 HG2 LYS 76 HG2 LYS 76 6.368 -4.194 6.346 659 HG3 LYS 76 HG3 LYS 76 6.385 -5.952 6.585 660 HD2 LYS 76 HD2 LYS 76 8.758 -5.822 7.307 661 HD3 LYS 76 HD3 LYS 76 8.686 -4.049 7.165 662 HE2 LYS 76 HE2 LYS 76 6.863 -3.975 8.833 663 HE3 LYS 76 HE3 LYS 76 6.825 -5.736 8.910 664 HZ1 LYS 76 HZ1 LYS 76 9.139 -4.058 9.729 665 HZ2 LYS 76 HZ2 LYS 76 8.102 -4.802 10.747 666 HZ3 LYS 76 HZ3 LYS 76 9.091 -5.690 9.802 667 H ASN 77 H ASN 77 4.286 -6.201 5.088 668 HA ASN 77 HA ASN 77 4.658 -9.061 5.401 669 HB2 ASN 77 HB2 ASN 77 2.367 -7.147 5.874 670 HB3 ASN 77 HB3 ASN 77 2.065 -8.877 5.859 671 HD21 ASN 77 HD21 ASN 77 4.133 -7.309 9.006 672 HD22 ASN 77 HD22 ASN 77 3.880 -6.326 7.571 673 H SER 78 H SER 78 3.358 -7.163 2.747 674 HA SER 78 HA SER 78 2.409 -9.556 1.298 675 HB2 SER 78 HB2 SER 78 1.376 -7.283 1.022 676 HB3 SER 78 HB3 SER 78 2.892 -6.750 0.258 677 HG SER 78 HG SER 78 1.311 -7.477 -1.271 678 H ASN 79 H ASN 79 5.052 -7.194 0.954 679 HA ASN 79 HA ASN 79 6.510 -9.087 -0.845 680 HB2 ASN 79 HB2 ASN 79 7.469 -6.964 -1.834 681 HB3 ASN 79 HB3 ASN 79 5.789 -7.359 -2.166 682 HD21 ASN 79 HD21 ASN 79 6.506 -4.110 0.240 683 HD22 ASN 79 HD22 ASN 79 7.601 -5.497 0.341 684 H ARG 80 H ARG 80 7.630 -10.159 0.647 685 HA ARG 80 HA ARG 80 9.938 -8.752 1.956 686 HB2 ARG 80 HB2 ARG 80 9.857 -10.503 3.710 687 HB3 ARG 80 HB3 ARG 80 8.470 -9.459 3.697 688 HG2 ARG 80 HG2 ARG 80 8.278 -12.059 2.165 689 HG3 ARG 80 HG3 ARG 80 8.282 -12.126 3.926 690 HD2 ARG 80 HD2 ARG 80 6.313 -10.748 4.104 691 HD3 ARG 80 HD3 ARG 80 6.357 -10.332 2.402 692 HE ARG 80 HE ARG 80 5.330 -12.300 1.837 693 HH11 ARG 80 HH11 ARG 80 4.186 -14.150 2.178 694 HH12 ARG 80 HH12 ARG 80 4.194 -14.910 3.744 695 HH21 ARG 80 HH21 ARG 80 6.290 -12.621 5.195 696 HH22 ARG 80 HH22 ARG 80 5.358 -14.074 5.413 697 H MET 81 H MET 81 9.577 -10.446 -0.704 698 HA MET 81 HA MET 81 11.211 -12.783 -0.196 699 HB2 MET 81 HB2 MET 81 10.083 -11.610 -2.761 700 HB3 MET 81 HB3 MET 81 10.945 -13.153 -2.664 701 HG2 MET 81 HG2 MET 81 9.313 -14.002 -1.030 702 HG3 MET 81 HG3 MET 81 8.400 -12.498 -1.120 703 HE1 MET 81 HE1 MET 81 8.152 -11.700 -4.131 704 HE2 MET 81 HE2 MET 81 6.692 -12.603 -4.584 705 HE3 MET 81 HE3 MET 81 6.786 -11.817 -2.994 706 H GLY 82 H GLY 82 12.077 -9.586 -1.296 707 HA2 GLY 82 HA2 GLY 82 14.376 -8.833 -1.137 708 HA3 GLY 82 HA3 GLY 82 14.931 -10.431 -1.633 709 H ARG 83 H ARG 83 13.627 -7.395 -2.673 710 HA ARG 83 HA ARG 83 12.785 -6.588 -4.683 711 HB2 ARG 83 HB2 ARG 83 15.583 -7.335 -5.562 712 HB3 ARG 83 HB3 ARG 83 14.487 -6.155 -6.293 713 HG2 ARG 83 HG2 ARG 83 14.539 -5.180 -3.745 714 HG3 ARG 83 HG3 ARG 83 16.123 -5.961 -3.774 715 HD2 ARG 83 HD2 ARG 83 15.058 -3.801 -5.641 716 HD3 ARG 83 HD3 ARG 83 16.287 -3.589 -4.407 717 HE ARG 83 HE ARG 83 16.598 -4.732 -7.095 718 HH11 ARG 83 HH11 ARG 83 18.636 -4.950 -7.919 719 HH12 ARG 83 HH12 ARG 83 20.012 -4.941 -6.854 720 HH21 ARG 83 HH21 ARG 83 18.201 -4.437 -3.991 721 HH22 ARG 83 HH22 ARG 83 19.782 -4.640 -4.693 722 H THR 84 H THR 84 11.380 -8.541 -4.718 723 HA THR 84 HA THR 84 10.241 -10.160 -5.839 724 HB THR 84 HB THR 84 9.896 -9.653 -8.274 725 HG1 THR 84 HG1 THR 84 10.707 -7.699 -9.019 726 HG21 THR 84 HG21 THR 84 9.684 -7.284 -6.376 727 HG22 THR 84 HG22 THR 84 8.728 -7.550 -7.851 728 HG23 THR 84 HG23 THR 84 8.529 -8.635 -6.465 729 H ASN 85 H ASN 85 13.135 -10.797 -5.444 730 HA ASN 85 HA ASN 85 14.811 -12.072 -6.106 731 HB2 ASN 85 HB2 ASN 85 12.821 -13.679 -5.471 732 HB3 ASN 85 HB3 ASN 85 12.877 -14.137 -7.169 733 HD21 ASN 85 HD21 ASN 85 16.203 -15.630 -6.769 734 HD22 ASN 85 HD22 ASN 85 15.316 -14.599 -7.901 735 H ASN 86 H ASN 86 14.116 -10.087 -8.015 736 HA ASN 86 HA ASN 86 14.800 -11.351 -10.605 737 HB2 ASN 86 HB2 ASN 86 13.574 -9.811 -11.651 738 HB3 ASN 86 HB3 ASN 86 12.773 -9.684 -10.092 739 HD21 ASN 86 HD21 ASN 86 14.304 -6.450 -9.424 740 HD22 ASN 86 HD22 ASN 86 13.805 -7.921 -8.592 741 H PHE 87 H PHE 87 16.475 -9.817 -8.170 742 HA PHE 87 HA PHE 87 18.209 -8.051 -9.577 743 HB2 PHE 87 HB2 PHE 87 19.289 -7.817 -7.421 744 HB3 PHE 87 HB3 PHE 87 17.543 -7.850 -7.226 745 HD1 PHE 87 HD1 PHE 87 16.412 -9.701 -6.061 746 HD2 PHE 87 HD2 PHE 87 20.692 -9.674 -6.603 747 HE1 PHE 87 HE1 PHE 87 16.627 -11.596 -4.475 748 HE2 PHE 87 HE2 PHE 87 20.899 -11.579 -5.023 749 HZ PHE 87 HZ PHE 87 18.867 -12.545 -3.958 750 H LYS 88 H LYS 88 18.261 -10.950 -10.502 751 HA LYS 88 HA LYS 88 20.908 -12.019 -9.756 752 HB2 LYS 88 HB2 LYS 88 19.991 -14.110 -10.665 753 HB3 LYS 88 HB3 LYS 88 18.889 -13.356 -9.517 754 HG2 LYS 88 HG2 LYS 88 17.856 -12.280 -11.784 755 HG3 LYS 88 HG3 LYS 88 18.609 -13.692 -12.513 756 HD2 LYS 88 HD2 LYS 88 17.245 -15.190 -11.222 757 HD3 LYS 88 HD3 LYS 88 16.781 -13.902 -10.093 758 HE2 LYS 88 HE2 LYS 88 15.642 -12.696 -11.987 759 HE3 LYS 88 HE3 LYS 88 15.965 -14.095 -13.024 760 HZ1 LYS 88 HZ1 LYS 88 14.356 -14.117 -10.520 761 HZ2 LYS 88 HZ2 LYS 88 13.747 -14.218 -12.039 762 HZ3 LYS 88 HZ3 LYS 88 14.649 -15.443 -11.447 763 H THR 89 H THR 89 19.900 -10.066 -12.185 764 HA THR 89 HA THR 89 21.896 -10.963 -14.208 765 HB THR 89 HB THR 89 18.905 -10.536 -14.637 766 HG1 THR 89 HG1 THR 89 19.015 -12.680 -15.362 767 HG21 THR 89 HG21 THR 89 21.121 -11.039 -16.650 768 HG22 THR 89 HG22 THR 89 19.374 -11.173 -16.994 769 HG23 THR 89 HG23 THR 89 20.061 -9.609 -16.538 770 H ILE 90 H ILE 90 19.432 -8.501 -13.268 771 HA ILE 90 HA ILE 90 20.558 -6.339 -14.782 772 HB ILE 90 HB ILE 90 19.116 -4.946 -13.379 773 HG12 ILE 90 HG12 ILE 90 18.124 -7.484 -12.023 774 HG13 ILE 90 HG13 ILE 90 19.321 -6.420 -11.281 775 HG21 ILE 90 HG21 ILE 90 17.682 -7.401 -14.477 776 HG22 ILE 90 HG22 ILE 90 17.024 -5.764 -14.307 777 HG23 ILE 90 HG23 ILE 90 18.325 -6.068 -15.459 778 HD11 ILE 90 HD11 ILE 90 16.507 -5.607 -12.089 779 HD12 ILE 90 HD12 ILE 90 17.113 -5.867 -10.443 780 HD13 ILE 90 HD13 ILE 90 17.745 -4.521 -11.418 781 H LYS 91 H LYS 91 21.326 -4.335 -13.711 782 HA LYS 91 HA LYS 91 22.938 -3.143 -12.643 783 HB2 LYS 91 HB2 LYS 91 22.936 -5.243 -10.461 784 HB3 LYS 91 HB3 LYS 91 23.519 -3.600 -10.330 785 HG2 LYS 91 HG2 LYS 91 20.582 -4.368 -10.704 786 HG3 LYS 91 HG3 LYS 91 21.383 -4.094 -9.175 787 HD2 LYS 91 HD2 LYS 91 20.293 -2.093 -9.550 788 HD3 LYS 91 HD3 LYS 91 21.961 -1.733 -10.004 789 HE2 LYS 91 HE2 LYS 91 21.342 -2.007 -12.408 790 HE3 LYS 91 HE3 LYS 91 19.691 -2.429 -11.932 791 HZ1 LYS 91 HZ1 LYS 91 21.002 0.188 -11.405 792 HZ2 LYS 91 HZ2 LYS 91 19.868 -0.084 -12.545 793 HZ3 LYS 91 HZ3 LYS 91 19.477 -0.199 -10.966 794 H MET 92 H MET 92 23.703 -6.307 -13.679 795 HA MET 92 HA MET 92 26.579 -5.552 -13.832 796 HB2 MET 92 HB2 MET 92 27.255 -7.741 -12.961 797 HB3 MET 92 HB3 MET 92 26.317 -6.828 -11.785 798 HG2 MET 92 HG2 MET 92 24.281 -8.145 -12.455 799 HG3 MET 92 HG3 MET 92 25.307 -9.141 -13.488 800 HE1 MET 92 HE1 MET 92 23.985 -11.082 -12.052 801 HE2 MET 92 HE2 MET 92 24.117 -11.235 -10.285 802 HE3 MET 92 HE3 MET 92 23.259 -9.849 -10.996 803 H PHE 93 H PHE 93 24.321 -5.797 -15.812 804 HA PHE 93 HA PHE 93 25.756 -7.331 -17.876 805 HB2 PHE 93 HB2 PHE 93 24.221 -8.922 -16.538 806 HB3 PHE 93 HB3 PHE 93 22.869 -8.050 -17.248 807 HD1 PHE 93 HD1 PHE 93 22.231 -8.444 -19.553 808 HD2 PHE 93 HD2 PHE 93 25.805 -10.195 -17.919 809 HE1 PHE 93 HE1 PHE 93 22.404 -9.937 -21.545 810 HE2 PHE 93 HE2 PHE 93 25.985 -11.697 -19.908 811 HZ PHE 93 HZ PHE 93 24.282 -11.563 -21.720 812 H GLU 94 H GLU 94 22.810 -5.470 -17.046 813 HA GLU 94 HA GLU 94 22.400 -4.496 -19.775 814 HB2 GLU 94 HB2 GLU 94 21.132 -3.738 -17.113 815 HB3 GLU 94 HB3 GLU 94 20.610 -3.131 -18.681 816 HG2 GLU 94 HG2 GLU 94 20.551 -6.057 -17.815 817 HG3 GLU 94 HG3 GLU 94 19.180 -4.960 -17.834 818 H ASP 95 H ASP 95 22.297 -2.219 -20.320 819 HA ASP 95 HA ASP 95 24.073 -0.363 -18.815 820 HB2 ASP 95 HB2 ASP 95 24.250 -1.051 -21.775 821 HB3 ASP 95 HB3 ASP 95 24.928 0.416 -21.085 822 H ASP 96 H ASP 96 23.779 1.890 -19.457 823 HA ASP 96 HA ASP 96 21.072 2.550 -20.538 824 HB2 ASP 96 HB2 ASP 96 21.253 2.712 -18.022 825 HB3 ASP 96 HB3 ASP 96 22.463 3.976 -18.245 826 H VAL 97 H VAL 97 20.899 4.662 -21.572 827 HA VAL 97 HA VAL 97 23.269 5.203 -23.223 828 HB VAL 97 HB VAL 97 20.442 6.325 -23.346 829 HG11 VAL 97 HG11 VAL 97 22.684 6.384 -25.412 830 HG12 VAL 97 HG12 VAL 97 20.995 6.844 -25.723 831 HG13 VAL 97 HG13 VAL 97 21.960 7.785 -24.592 832 HG21 VAL 97 HG21 VAL 97 20.420 3.886 -23.717 833 HG22 VAL 97 HG22 VAL 97 20.131 4.731 -25.233 834 HG23 VAL 97 HG23 VAL 97 21.733 4.038 -24.903 835 H SER 98 H SER 98 21.815 6.600 -20.418 836 HA SER 98 HA SER 98 21.894 8.530 -19.385 837 HB2 SER 98 HB2 SER 98 24.428 8.132 -19.587 838 HB3 SER 98 HB3 SER 98 24.407 9.432 -20.793 839 HG SER 98 HG SER 98 24.808 10.195 -18.648 840 H SER 99 H SER 99 20.405 8.217 -21.736 841 HA SER 99 HA SER 99 19.680 11.007 -22.160 842 HB2 SER 99 HB2 SER 99 21.153 10.425 -24.110 843 HB3 SER 99 HB3 SER 99 19.993 9.153 -24.548 844 HG SER 99 HG SER 99 19.620 11.160 -25.653 845 H ALA 100 H ALA 100 17.512 11.312 -22.387 846 HA ALA 100 HA ALA 100 15.596 9.116 -22.665 847 HB1 ALA 100 HB1 ALA 100 15.909 10.630 -20.027 848 HB2 ALA 100 HB2 ALA 100 14.640 9.442 -20.404 849 HB3 ALA 100 HB3 ALA 100 16.334 8.926 -20.295 850 H SER 101 H SER 101 13.278 10.057 -22.242 851 HA SER 101 HA SER 101 13.066 12.824 -23.382 852 HB2 SER 101 HB2 SER 101 11.475 10.345 -24.150 853 HB3 SER 101 HB3 SER 101 11.191 11.989 -24.752 854 HG SER 101 HG SER 101 12.470 10.752 -26.199 855 H ALA 102 H ALA 102 10.630 13.551 -23.210 856 HA ALA 102 HA ALA 102 9.907 13.677 -20.474 857 HB1 ALA 102 HB1 ALA 102 8.230 14.259 -22.955 858 HB2 ALA 102 HB2 ALA 102 7.894 14.843 -21.312 859 HB3 ALA 102 HB3 ALA 102 9.343 15.402 -22.166 860 H GLN 103 H GLN 103 9.244 11.250 -22.686 861 HA GLN 103 HA GLN 103 7.937 9.662 -20.579 862 HB2 GLN 103 HB2 GLN 103 6.874 9.999 -23.401 863 HB3 GLN 103 HB3 GLN 103 6.446 8.616 -22.390 864 HG2 GLN 103 HG2 GLN 103 5.831 11.525 -21.713 865 HG3 GLN 103 HG3 GLN 103 4.716 10.388 -22.450 866 HE21 GLN 103 HE21 GLN 103 5.402 10.140 -18.416 867 HE22 GLN 103 HE22 GLN 103 6.416 11.182 -19.425 868 HA PRO 104 HA PRO 104 11.285 7.176 -22.483 869 HB2 PRO 104 HB2 PRO 104 12.135 5.886 -20.245 870 HB3 PRO 104 HB3 PRO 104 12.617 7.565 -20.639 871 HG2 PRO 104 HG2 PRO 104 10.449 6.646 -18.735 872 HG3 PRO 104 HG3 PRO 104 11.687 7.912 -18.484 873 HD2 PRO 104 HD2 PRO 104 9.100 8.426 -19.288 874 HD3 PRO 104 HD3 PRO 104 10.484 9.467 -19.746 875 H ASN 105 H ASN 105 10.571 5.521 -23.586 876 HA ASN 105 HA ASN 105 8.763 3.469 -22.392 877 HB2 ASN 105 HB2 ASN 105 7.529 5.299 -23.619 878 HB3 ASN 105 HB3 ASN 105 8.360 4.814 -25.097 879 HD21 ASN 105 HD21 ASN 105 5.494 2.300 -23.498 880 HD22 ASN 105 HD22 ASN 105 6.406 3.341 -22.417 881 H LEU 106 H LEU 106 11.466 3.106 -22.592 882 HA LEU 106 HA LEU 106 11.806 1.102 -24.788 883 HB2 LEU 106 HB2 LEU 106 13.081 3.305 -24.902 884 HB3 LEU 106 HB3 LEU 106 14.032 2.736 -23.541 885 HG LEU 106 HG LEU 106 13.749 1.371 -26.263 886 HD11 LEU 106 HD11 LEU 106 16.071 2.925 -25.048 887 HD12 LEU 106 HD12 LEU 106 16.061 2.122 -26.635 888 HD13 LEU 106 HD13 LEU 106 14.992 3.501 -26.338 889 HD21 LEU 106 HD21 LEU 106 14.285 -0.346 -24.619 890 HD22 LEU 106 HD22 LEU 106 15.727 0.015 -25.563 891 HD23 LEU 106 HD23 LEU 106 15.567 0.673 -23.919 892 HA PRO 107 HA PRO 107 11.967 -1.155 -20.766 893 HB2 PRO 107 HB2 PRO 107 10.738 -3.465 -21.531 894 HB3 PRO 107 HB3 PRO 107 9.847 -1.958 -21.159 895 HG2 PRO 107 HG2 PRO 107 10.671 -3.011 -23.884 896 HG3 PRO 107 HG3 PRO 107 9.069 -2.394 -23.373 897 HD2 PRO 107 HD2 PRO 107 10.886 -0.838 -24.687 898 HD3 PRO 107 HD3 PRO 107 9.801 -0.162 -23.435 Start of MODEL 29 1 H1 GLY -5 H1 GLY -5 -6.342 8.645 25.690 2 H2 GLY -5 H2 GLY -5 -7.907 9.060 25.939 3 H3 GLY -5 H3 GLY -5 -6.877 8.951 27.207 4 HA2 GLY -5 HA2 GLY -5 -7.275 11.259 26.691 5 HA3 GLY -5 HA3 GLY -5 -5.583 10.816 26.403 6 H SER -4 H SER -4 -4.868 11.816 24.607 7 HA SER -4 HA SER -4 -6.514 12.835 22.515 8 HB2 SER -4 HB2 SER -4 -3.520 12.300 22.500 9 HB3 SER -4 HB3 SER -4 -4.401 13.381 21.408 10 HG SER -4 HG SER -4 -3.437 14.512 23.172 11 H HIS -3 H HIS -3 -6.427 12.383 20.246 12 HA HIS -3 HA HIS -3 -5.679 9.623 19.414 13 HB2 HIS -3 HB2 HIS -3 -7.657 9.505 18.007 14 HB3 HIS -3 HB3 HIS -3 -8.110 9.696 19.695 15 HD2 HIS -3 HD2 HIS -3 -8.328 11.462 16.299 16 HE1 HIS -3 HE1 HIS -3 -10.478 13.918 19.040 17 HE2 HIS -3 HE2 HIS -3 -9.924 13.535 16.584 18 H MET -2 H MET -2 -4.862 9.397 17.373 19 HA MET -2 HA MET -2 -4.292 11.823 15.776 20 HB2 MET -2 HB2 MET -2 -2.495 11.078 17.517 21 HB3 MET -2 HB3 MET -2 -2.151 9.756 16.394 22 HG2 MET -2 HG2 MET -2 -1.767 11.432 14.606 23 HG3 MET -2 HG3 MET -2 -2.165 12.726 15.735 24 HE1 MET -2 HE1 MET -2 -0.648 12.188 18.410 25 HE2 MET -2 HE2 MET -2 0.910 12.965 18.069 26 HE3 MET -2 HE3 MET -2 -0.595 13.721 17.508 27 H ALA -1 H ALA -1 -6.260 9.993 15.215 28 HA ALA -1 HA ALA -1 -5.330 8.787 12.626 29 HB1 ALA -1 HB1 ALA -1 -7.373 7.615 14.556 30 HB2 ALA -1 HB2 ALA -1 -6.949 6.977 12.949 31 HB3 ALA -1 HB3 ALA -1 -5.737 7.002 14.241 32 H SER 0 H SER 0 -8.382 9.699 14.289 33 HA SER 0 HA SER 0 -10.212 10.814 13.650 34 HB2 SER 0 HB2 SER 0 -8.212 12.520 13.556 35 HB3 SER 0 HB3 SER 0 -8.627 12.602 11.838 36 HG SER 0 HG SER 0 -9.788 14.146 13.066 37 H MET 1 H MET 1 -9.351 8.599 11.767 38 HA MET 1 HA MET 1 -11.472 9.021 9.757 39 HB2 MET 1 HB2 MET 1 -8.629 8.264 8.934 40 HB3 MET 1 HB3 MET 1 -10.039 8.269 7.875 41 HG2 MET 1 HG2 MET 1 -10.292 10.748 8.384 42 HG3 MET 1 HG3 MET 1 -8.714 10.657 9.169 43 HE1 MET 1 HE1 MET 1 -10.668 11.178 5.922 44 HE2 MET 1 HE2 MET 1 -9.633 10.496 4.650 45 HE3 MET 1 HE3 MET 1 -10.447 9.420 5.805 46 H ASP 2 H ASP 2 -9.722 6.909 11.707 47 HA ASP 2 HA ASP 2 -11.169 4.512 10.632 48 HB2 ASP 2 HB2 ASP 2 -8.656 4.539 10.556 49 HB3 ASP 2 HB3 ASP 2 -8.643 4.629 12.316 50 H GLN 3 H GLN 3 -11.721 6.738 12.872 51 HA GLN 3 HA GLN 3 -12.785 4.957 14.995 52 HB2 GLN 3 HB2 GLN 3 -10.320 5.367 15.340 53 HB3 GLN 3 HB3 GLN 3 -10.652 7.083 15.427 54 HG2 GLN 3 HG2 GLN 3 -12.373 5.859 17.370 55 HG3 GLN 3 HG3 GLN 3 -10.853 4.987 17.473 56 HE21 GLN 3 HE21 GLN 3 -10.820 9.065 18.261 57 HE22 GLN 3 HE22 GLN 3 -11.981 8.391 17.106 58 H LEU 4 H LEU 4 -14.295 6.518 13.206 59 HA LEU 4 HA LEU 4 -15.341 8.783 14.879 60 HB2 LEU 4 HB2 LEU 4 -15.128 8.359 11.902 61 HB3 LEU 4 HB3 LEU 4 -16.483 9.277 12.540 62 HG LEU 4 HG LEU 4 -15.043 10.920 13.563 63 HD11 LEU 4 HD11 LEU 4 -12.710 9.292 12.484 64 HD12 LEU 4 HD12 LEU 4 -12.600 10.966 13.088 65 HD13 LEU 4 HD13 LEU 4 -13.058 9.676 14.190 66 HD21 LEU 4 HD21 LEU 4 -15.689 11.168 11.178 67 HD22 LEU 4 HD22 LEU 4 -14.118 11.912 11.520 68 HD23 LEU 4 HD23 LEU 4 -14.193 10.341 10.693 69 H ASP 5 H ASP 5 -17.256 8.543 15.794 70 HA ASP 5 HA ASP 5 -19.347 6.767 14.712 71 HB2 ASP 5 HB2 ASP 5 -17.649 5.340 15.985 72 HB3 ASP 5 HB3 ASP 5 -18.108 6.213 17.440 73 H GLU 6 H GLU 6 -18.948 9.694 15.699 74 HA GLU 6 HA GLU 6 -21.130 9.821 17.751 75 HB2 GLU 6 HB2 GLU 6 -19.924 11.634 18.809 76 HB3 GLU 6 HB3 GLU 6 -18.950 10.174 18.731 77 HG2 GLU 6 HG2 GLU 6 -17.663 11.083 16.828 78 HG3 GLU 6 HG3 GLU 6 -18.675 12.526 16.804 79 H ILE 7 H ILE 7 -21.228 10.206 14.733 80 HA ILE 7 HA ILE 7 -21.746 13.104 14.438 81 HB ILE 7 HB ILE 7 -21.353 10.930 12.385 82 HG12 ILE 7 HG12 ILE 7 -19.523 13.187 13.361 83 HG13 ILE 7 HG13 ILE 7 -19.356 11.499 13.841 84 HG21 ILE 7 HG21 ILE 7 -21.549 13.971 12.059 85 HG22 ILE 7 HG22 ILE 7 -21.187 12.804 10.769 86 HG23 ILE 7 HG23 ILE 7 -22.772 12.799 11.518 87 HD11 ILE 7 HD11 ILE 7 -18.963 12.586 11.058 88 HD12 ILE 7 HD12 ILE 7 -17.755 11.917 12.174 89 HD13 ILE 7 HD13 ILE 7 -18.996 10.849 11.486 90 H ILE 8 H ILE 8 -23.772 13.534 15.195 91 HA ILE 8 HA ILE 8 -26.119 12.250 13.891 92 HB ILE 8 HB ILE 8 -26.109 12.724 16.883 93 HG12 ILE 8 HG12 ILE 8 -25.385 10.099 15.515 94 HG13 ILE 8 HG13 ILE 8 -24.315 11.090 16.514 95 HG21 ILE 8 HG21 ILE 8 -27.773 10.856 15.119 96 HG22 ILE 8 HG22 ILE 8 -28.075 11.277 16.820 97 HG23 ILE 8 HG23 ILE 8 -28.290 12.488 15.570 98 HD11 ILE 8 HD11 ILE 8 -26.740 9.552 17.482 99 HD12 ILE 8 HD12 ILE 8 -25.035 9.266 17.849 100 HD13 ILE 8 HD13 ILE 8 -25.830 10.727 18.469 101 H GLU 9 H GLU 9 -25.397 14.511 12.876 102 HA GLU 9 HA GLU 9 -27.266 16.589 13.943 103 HB2 GLU 9 HB2 GLU 9 -24.374 17.074 13.130 104 HB3 GLU 9 HB3 GLU 9 -25.578 18.333 13.450 105 HG2 GLU 9 HG2 GLU 9 -25.859 17.435 15.772 106 HG3 GLU 9 HG3 GLU 9 -24.517 16.325 15.468 107 H GLN 10 H GLN 10 -28.184 15.019 12.021 108 HA GLN 10 HA GLN 10 -28.196 16.707 9.566 109 HB2 GLN 10 HB2 GLN 10 -26.441 15.064 9.202 110 HB3 GLN 10 HB3 GLN 10 -27.506 13.739 9.703 111 HG2 GLN 10 HG2 GLN 10 -28.971 14.127 7.796 112 HG3 GLN 10 HG3 GLN 10 -28.042 15.562 7.331 113 HE21 GLN 10 HE21 GLN 10 -26.540 11.822 6.449 114 HE22 GLN 10 HE22 GLN 10 -27.828 11.969 7.636 115 H ILE 11 H ILE 11 -30.201 16.950 8.693 116 HA ILE 11 HA ILE 11 -32.286 14.966 8.865 117 HB ILE 11 HB ILE 11 -33.940 16.531 9.725 118 HG12 ILE 11 HG12 ILE 11 -32.702 18.388 11.349 119 HG13 ILE 11 HG13 ILE 11 -31.685 18.478 9.923 120 HG21 ILE 11 HG21 ILE 11 -31.754 16.090 11.769 121 HG22 ILE 11 HG22 ILE 11 -33.501 16.206 12.060 122 HG23 ILE 11 HG23 ILE 11 -32.840 14.826 11.157 123 HD11 ILE 11 HD11 ILE 11 -34.713 18.850 10.034 124 HD12 ILE 11 HD12 ILE 11 -33.494 20.121 9.822 125 HD13 ILE 11 HD13 ILE 11 -33.751 18.922 8.541 126 H GLN 12 H GLN 12 -33.719 15.170 7.278 127 HA GLN 12 HA GLN 12 -33.527 17.398 5.279 128 HB2 GLN 12 HB2 GLN 12 -33.737 14.419 4.672 129 HB3 GLN 12 HB3 GLN 12 -33.852 15.707 3.488 130 HG2 GLN 12 HG2 GLN 12 -31.715 14.881 3.229 131 HG3 GLN 12 HG3 GLN 12 -31.540 16.444 4.026 132 HE21 GLN 12 HE21 GLN 12 -30.757 13.060 6.292 133 HE22 GLN 12 HE22 GLN 12 -32.066 12.993 5.123 134 H LYS 13 H LYS 13 -35.605 17.034 7.409 135 HA LYS 13 HA LYS 13 -37.896 16.883 7.738 136 HB2 LYS 13 HB2 LYS 13 -37.826 18.142 4.970 137 HB3 LYS 13 HB3 LYS 13 -39.314 17.917 5.862 138 HG2 LYS 13 HG2 LYS 13 -36.976 19.523 6.956 139 HG3 LYS 13 HG3 LYS 13 -38.295 20.198 5.990 140 HD2 LYS 13 HD2 LYS 13 -39.925 19.226 7.695 141 HD3 LYS 13 HD3 LYS 13 -38.540 18.905 8.742 142 HE2 LYS 13 HE2 LYS 13 -39.330 21.632 7.607 143 HE3 LYS 13 HE3 LYS 13 -39.772 21.050 9.212 144 HZ1 LYS 13 HZ1 LYS 13 -36.985 21.494 8.283 145 HZ2 LYS 13 HZ2 LYS 13 -37.809 22.451 9.314 146 HZ3 LYS 13 HZ3 LYS 13 -37.404 20.939 9.767 147 H GLU 14 H GLU 14 -37.232 14.522 7.628 148 HA GLU 14 HA GLU 14 -37.794 12.821 5.474 149 HB2 GLU 14 HB2 GLU 14 -37.548 12.412 8.460 150 HB3 GLU 14 HB3 GLU 14 -38.017 11.065 7.395 151 HG2 GLU 14 HG2 GLU 14 -36.101 11.335 6.017 152 HG3 GLU 14 HG3 GLU 14 -35.626 12.831 6.823 153 H ALA 15 H ALA 15 -39.519 12.754 4.432 154 HA ALA 15 HA ALA 15 -42.038 13.336 5.624 155 HB1 ALA 15 HB1 ALA 15 -41.276 12.904 2.712 156 HB2 ALA 15 HB2 ALA 15 -42.752 13.704 3.293 157 HB3 ALA 15 HB3 ALA 15 -41.170 14.454 3.586 158 H ILE 16 H ILE 16 -41.524 10.907 6.606 159 HA ILE 16 HA ILE 16 -41.832 8.692 6.691 160 HB ILE 16 HB ILE 16 -44.457 9.194 5.327 161 HG12 ILE 16 HG12 ILE 16 -43.868 9.712 8.275 162 HG13 ILE 16 HG13 ILE 16 -44.175 10.954 7.062 163 HG21 ILE 16 HG21 ILE 16 -43.865 7.307 7.658 164 HG22 ILE 16 HG22 ILE 16 -45.350 7.373 6.686 165 HG23 ILE 16 HG23 ILE 16 -43.864 6.784 5.975 166 HD11 ILE 16 HD11 ILE 16 -46.200 8.947 8.083 167 HD12 ILE 16 HD12 ILE 16 -46.175 10.700 8.303 168 HD13 ILE 16 HD13 ILE 16 -46.461 10.024 6.687 169 H ASN 17 H ASN 17 -40.254 9.411 4.717 170 HA ASN 17 HA ASN 17 -40.768 7.548 2.439 171 HB2 ASN 17 HB2 ASN 17 -39.219 8.945 1.174 172 HB3 ASN 17 HB3 ASN 17 -40.528 9.905 1.848 173 HD21 ASN 17 HD21 ASN 17 -38.021 12.170 2.818 174 HD22 ASN 17 HD22 ASN 17 -39.534 11.887 1.961 175 H SER 18 H SER 18 -39.033 7.805 5.272 176 HA SER 18 HA SER 18 -36.743 6.103 4.364 177 HB2 SER 18 HB2 SER 18 -35.629 6.973 6.407 178 HB3 SER 18 HB3 SER 18 -36.079 8.232 5.244 179 HG SER 18 HG SER 18 -36.590 8.759 7.425 180 H ASN 19 H ASN 19 -38.877 6.469 7.205 181 HA ASN 19 HA ASN 19 -38.173 4.015 8.436 182 HB2 ASN 19 HB2 ASN 19 -40.081 4.499 9.918 183 HB3 ASN 19 HB3 ASN 19 -39.077 5.921 9.663 184 HD21 ASN 19 HD21 ASN 19 -42.615 7.000 9.440 185 HD22 ASN 19 HD22 ASN 19 -41.630 6.225 10.676 186 H VAL 20 H VAL 20 -40.462 4.605 5.956 187 HA VAL 20 HA VAL 20 -41.730 1.925 6.156 188 HB VAL 20 HB VAL 20 -42.183 4.283 4.298 189 HG11 VAL 20 HG11 VAL 20 -43.676 1.626 4.371 190 HG12 VAL 20 HG12 VAL 20 -44.236 3.091 3.535 191 HG13 VAL 20 HG13 VAL 20 -42.761 2.296 2.999 192 HG21 VAL 20 HG21 VAL 20 -43.012 4.561 6.626 193 HG22 VAL 20 HG22 VAL 20 -44.353 4.409 5.487 194 HG23 VAL 20 HG23 VAL 20 -43.891 3.025 6.499 195 H VAL 21 H VAL 21 -39.109 3.423 4.416 196 HA VAL 21 HA VAL 21 -38.944 1.123 2.513 197 HB VAL 21 HB VAL 21 -37.933 3.914 1.917 198 HG11 VAL 21 HG11 VAL 21 -38.611 1.520 0.137 199 HG12 VAL 21 HG12 VAL 21 -37.994 3.094 -0.411 200 HG13 VAL 21 HG13 VAL 21 -36.968 2.044 0.565 201 HG21 VAL 21 HG21 VAL 21 -40.358 4.139 2.156 202 HG22 VAL 21 HG22 VAL 21 -39.932 4.160 0.448 203 HG23 VAL 21 HG23 VAL 21 -40.620 2.684 1.163 204 H LEU 22 H LEU 22 -37.884 0.304 4.588 205 HA LEU 22 HA LEU 22 -34.959 0.504 4.207 206 HB2 LEU 22 HB2 LEU 22 -35.890 2.041 6.135 207 HB3 LEU 22 HB3 LEU 22 -36.132 0.529 6.997 208 HG LEU 22 HG LEU 22 -33.628 0.075 6.632 209 HD11 LEU 22 HD11 LEU 22 -33.670 3.034 5.879 210 HD12 LEU 22 HD12 LEU 22 -32.214 2.070 6.204 211 HD13 LEU 22 HD13 LEU 22 -33.217 1.705 4.796 212 HD21 LEU 22 HD21 LEU 22 -34.530 0.851 8.782 213 HD22 LEU 22 HD22 LEU 22 -32.961 1.606 8.463 214 HD23 LEU 22 HD23 LEU 22 -34.460 2.537 8.228 215 H LYS 23 H LYS 23 -33.926 -1.391 4.382 216 HA LYS 23 HA LYS 23 -35.212 -3.767 5.584 217 HB2 LYS 23 HB2 LYS 23 -35.546 -3.350 3.005 218 HB3 LYS 23 HB3 LYS 23 -33.867 -3.890 2.859 219 HG2 LYS 23 HG2 LYS 23 -34.475 -5.989 4.028 220 HG3 LYS 23 HG3 LYS 23 -36.120 -5.371 4.265 221 HD2 LYS 23 HD2 LYS 23 -36.483 -5.345 1.819 222 HD3 LYS 23 HD3 LYS 23 -34.824 -5.932 1.556 223 HE2 LYS 23 HE2 LYS 23 -35.341 -7.997 2.812 224 HE3 LYS 23 HE3 LYS 23 -36.973 -7.409 3.145 225 HZ1 LYS 23 HZ1 LYS 23 -35.902 -7.983 0.433 226 HZ2 LYS 23 HZ2 LYS 23 -36.944 -8.932 1.253 227 HZ3 LYS 23 HZ3 LYS 23 -37.416 -7.454 0.753 228 H ASN 24 H ASN 24 -33.179 -2.194 6.704 229 HA ASN 24 HA ASN 24 -31.068 -2.123 7.543 230 HB2 ASN 24 HB2 ASN 24 -32.379 -3.943 8.744 231 HB3 ASN 24 HB3 ASN 24 -31.428 -5.118 7.830 232 HD21 ASN 24 HD21 ASN 24 -28.425 -4.470 9.682 233 HD22 ASN 24 HD22 ASN 24 -29.047 -5.003 8.113 234 HA PRO 25 HA PRO 25 -28.958 -3.592 3.666 235 HB2 PRO 25 HB2 PRO 25 -28.279 -1.260 2.466 236 HB3 PRO 25 HB3 PRO 25 -29.963 -1.849 2.516 237 HG2 PRO 25 HG2 PRO 25 -28.654 0.125 4.429 238 HG3 PRO 25 HG3 PRO 25 -30.166 0.348 3.488 239 HD2 PRO 25 HD2 PRO 25 -30.197 -0.534 6.066 240 HD3 PRO 25 HD3 PRO 25 -31.353 -1.152 4.847 241 H ARG 26 H ARG 26 -27.782 -3.867 6.051 242 HA ARG 26 HA ARG 26 -24.925 -3.076 5.717 243 HB2 ARG 26 HB2 ARG 26 -26.830 -2.367 7.916 244 HB3 ARG 26 HB3 ARG 26 -25.225 -2.840 8.457 245 HG2 ARG 26 HG2 ARG 26 -25.611 -0.817 6.240 246 HG3 ARG 26 HG3 ARG 26 -25.611 -0.347 7.946 247 HD2 ARG 26 HD2 ARG 26 -23.346 -1.057 8.271 248 HD3 ARG 26 HD3 ARG 26 -23.332 -1.983 6.781 249 HE ARG 26 HE ARG 26 -22.836 -0.117 5.549 250 HH11 ARG 26 HH11 ARG 26 -22.147 1.943 5.190 251 HH12 ARG 26 HH12 ARG 26 -22.327 3.156 6.422 252 HH21 ARG 26 HH21 ARG 26 -23.776 1.059 8.719 253 HH22 ARG 26 HH22 ARG 26 -23.227 2.675 8.370 254 H VAL 27 H VAL 27 -26.329 -5.537 5.195 255 HA VAL 27 HA VAL 27 -24.744 -7.403 6.943 256 HB VAL 27 HB VAL 27 -27.256 -8.130 5.412 257 HG11 VAL 27 HG11 VAL 27 -25.686 -9.561 7.616 258 HG12 VAL 27 HG12 VAL 27 -27.196 -10.130 6.871 259 HG13 VAL 27 HG13 VAL 27 -25.723 -10.039 5.905 260 HG21 VAL 27 HG21 VAL 27 -27.904 -6.574 7.166 261 HG22 VAL 27 HG22 VAL 27 -28.344 -8.208 7.652 262 HG23 VAL 27 HG23 VAL 27 -26.905 -7.438 8.359 263 HA PRO 28 HA PRO 28 -22.817 -7.980 2.772 264 HB2 PRO 28 HB2 PRO 28 -20.229 -7.512 3.377 265 HB3 PRO 28 HB3 PRO 28 -21.382 -6.156 3.150 266 HG2 PRO 28 HG2 PRO 28 -20.485 -7.428 5.764 267 HG3 PRO 28 HG3 PRO 28 -20.531 -5.686 5.344 268 HD2 PRO 28 HD2 PRO 28 -22.550 -6.943 6.720 269 HD3 PRO 28 HD3 PRO 28 -22.853 -5.589 5.586 270 H THR 29 H THR 29 -21.326 -9.644 2.071 271 HA THR 29 HA THR 29 -21.062 -11.935 3.888 272 HB THR 29 HB THR 29 -20.183 -13.013 1.728 273 HG1 THR 29 HG1 THR 29 -20.758 -11.921 -0.166 274 HG21 THR 29 HG21 THR 29 -23.015 -11.884 1.688 275 HG22 THR 29 HG22 THR 29 -22.428 -13.300 0.784 276 HG23 THR 29 HG23 THR 29 -22.493 -13.347 2.552 277 H GLN 30 H GLN 30 -19.735 -10.289 5.095 278 HA GLN 30 HA GLN 30 -17.782 -9.708 6.020 279 HB2 GLN 30 HB2 GLN 30 -17.379 -12.587 5.212 280 HB3 GLN 30 HB3 GLN 30 -16.100 -11.741 6.067 281 HG2 GLN 30 HG2 GLN 30 -17.571 -13.014 7.578 282 HG3 GLN 30 HG3 GLN 30 -17.447 -11.294 7.961 283 HE21 GLN 30 HE21 GLN 30 -21.090 -12.730 6.662 284 HE22 GLN 30 HE22 GLN 30 -19.640 -13.641 6.245 285 H LYS 31 H LYS 31 -17.990 -8.683 3.439 286 HA LYS 31 HA LYS 31 -15.336 -8.865 2.181 287 HB2 LYS 31 HB2 LYS 31 -17.870 -8.939 1.154 288 HB3 LYS 31 HB3 LYS 31 -17.559 -7.226 1.002 289 HG2 LYS 31 HG2 LYS 31 -16.732 -7.913 -1.018 290 HG3 LYS 31 HG3 LYS 31 -15.247 -8.113 -0.094 291 HD2 LYS 31 HD2 LYS 31 -17.287 -10.266 -0.822 292 HD3 LYS 31 HD3 LYS 31 -15.683 -10.059 -1.531 293 HE2 LYS 31 HE2 LYS 31 -14.634 -10.592 0.650 294 HE3 LYS 31 HE3 LYS 31 -16.237 -10.762 1.388 295 HZ1 LYS 31 HZ1 LYS 31 -15.213 -12.464 -0.819 296 HZ2 LYS 31 HZ2 LYS 31 -15.320 -12.913 0.746 297 HZ3 LYS 31 HZ3 LYS 31 -16.677 -12.613 -0.104 298 H THR 32 H THR 32 -15.271 -7.563 4.617 299 HA THR 32 HA THR 32 -14.503 -4.771 3.922 300 HB THR 32 HB THR 32 -16.925 -4.868 4.389 301 HG1 THR 32 HG1 THR 32 -16.944 -3.124 5.767 302 HG21 THR 32 HG21 THR 32 -16.152 -5.574 7.246 303 HG22 THR 32 HG22 THR 32 -17.773 -5.149 6.656 304 HG23 THR 32 HG23 THR 32 -16.996 -6.635 6.095 305 H GLY 33 H GLY 33 -13.060 -7.271 4.947 306 HA2 GLY 33 HA2 GLY 33 -12.215 -6.747 7.668 307 HA3 GLY 33 HA3 GLY 33 -11.481 -7.869 6.523 308 H GLU 34 H GLU 34 -10.215 -6.790 4.717 309 HA GLU 34 HA GLU 34 -8.842 -4.247 5.466 310 HB2 GLU 34 HB2 GLU 34 -7.510 -6.929 5.014 311 HB3 GLU 34 HB3 GLU 34 -6.654 -5.420 4.741 312 HG2 GLU 34 HG2 GLU 34 -7.968 -6.084 7.407 313 HG3 GLU 34 HG3 GLU 34 -6.338 -6.583 7.000 314 H LEU 35 H LEU 35 -8.617 -6.804 2.951 315 HA LEU 35 HA LEU 35 -8.793 -4.769 0.818 316 HB2 LEU 35 HB2 LEU 35 -7.121 -7.249 1.241 317 HB3 LEU 35 HB3 LEU 35 -7.707 -6.921 -0.382 318 HG LEU 35 HG LEU 35 -6.673 -4.747 -0.410 319 HD11 LEU 35 HD11 LEU 35 -5.538 -5.431 2.327 320 HD12 LEU 35 HD12 LEU 35 -4.954 -4.112 1.293 321 HD13 LEU 35 HD13 LEU 35 -6.605 -4.065 1.917 322 HD21 LEU 35 HD21 LEU 35 -5.479 -6.766 -1.200 323 HD22 LEU 35 HD22 LEU 35 -4.385 -5.500 -0.628 324 HD23 LEU 35 HD23 LEU 35 -4.720 -6.917 0.399 325 H SER 36 H SER 36 -10.679 -4.742 -0.010 326 HA SER 36 HA SER 36 -12.193 -7.258 -0.567 327 HB2 SER 36 HB2 SER 36 -14.152 -6.008 -0.935 328 HB3 SER 36 HB3 SER 36 -13.451 -5.548 0.624 329 HG SER 36 HG SER 36 -14.161 -3.732 -0.542 330 H GLU 37 H GLU 37 -11.846 -4.291 -2.336 331 HA GLU 37 HA GLU 37 -10.837 -5.598 -4.800 332 HB2 GLU 37 HB2 GLU 37 -13.631 -5.439 -4.078 333 HB3 GLU 37 HB3 GLU 37 -13.388 -4.229 -5.334 334 HG2 GLU 37 HG2 GLU 37 -12.543 -7.148 -5.524 335 HG3 GLU 37 HG3 GLU 37 -14.089 -6.533 -6.099 336 H GLU 38 H GLU 38 -12.027 -2.667 -3.181 337 HA GLU 38 HA GLU 38 -10.820 -0.920 -5.194 338 HB2 GLU 38 HB2 GLU 38 -12.854 -0.387 -3.824 339 HB3 GLU 38 HB3 GLU 38 -11.816 -0.244 -2.399 340 HG2 GLU 38 HG2 GLU 38 -10.605 1.620 -3.421 341 HG3 GLU 38 HG3 GLU 38 -11.431 1.366 -4.962 342 H GLN 39 H GLN 39 -9.773 -2.379 -2.108 343 HA GLN 39 HA GLN 39 -7.663 -0.447 -1.649 344 HB2 GLN 39 HB2 GLN 39 -8.160 -3.182 -0.456 345 HB3 GLN 39 HB3 GLN 39 -6.952 -2.041 0.114 346 HG2 GLN 39 HG2 GLN 39 -8.755 -1.663 1.561 347 HG3 GLN 39 HG3 GLN 39 -8.901 -0.353 0.400 348 HE21 GLN 39 HE21 GLN 39 -12.320 -1.426 0.568 349 HE22 GLN 39 HE22 GLN 39 -11.149 -0.319 1.296 350 H LYS 40 H LYS 40 -7.646 -3.712 -3.061 351 HA LYS 40 HA LYS 40 -4.784 -3.758 -3.525 352 HB2 LYS 40 HB2 LYS 40 -5.231 -5.741 -4.862 353 HB3 LYS 40 HB3 LYS 40 -6.103 -5.780 -3.333 354 HG2 LYS 40 HG2 LYS 40 -8.129 -4.822 -4.708 355 HG3 LYS 40 HG3 LYS 40 -7.172 -5.254 -6.125 356 HD2 LYS 40 HD2 LYS 40 -8.807 -6.989 -5.594 357 HD3 LYS 40 HD3 LYS 40 -7.172 -7.627 -5.378 358 HE2 LYS 40 HE2 LYS 40 -7.368 -7.411 -2.927 359 HE3 LYS 40 HE3 LYS 40 -8.921 -6.593 -3.083 360 HZ1 LYS 40 HZ1 LYS 40 -8.433 -9.387 -3.979 361 HZ2 LYS 40 HZ2 LYS 40 -9.149 -8.974 -2.566 362 HZ3 LYS 40 HZ3 LYS 40 -9.878 -8.602 -3.964 363 H LYS 41 H LYS 41 -7.497 -2.451 -5.398 364 HA LYS 41 HA LYS 41 -5.892 -1.678 -7.686 365 HB2 LYS 41 HB2 LYS 41 -8.497 -0.525 -6.635 366 HB3 LYS 41 HB3 LYS 41 -7.753 -0.080 -8.171 367 HG2 LYS 41 HG2 LYS 41 -7.923 -2.361 -9.002 368 HG3 LYS 41 HG3 LYS 41 -8.531 -2.919 -7.439 369 HD2 LYS 41 HD2 LYS 41 -10.488 -1.320 -7.722 370 HD3 LYS 41 HD3 LYS 41 -9.937 -1.044 -9.391 371 HE2 LYS 41 HE2 LYS 41 -10.142 -3.470 -9.866 372 HE3 LYS 41 HE3 LYS 41 -10.528 -3.772 -8.166 373 HZ1 LYS 41 HZ1 LYS 41 -12.251 -2.463 -10.169 374 HZ2 LYS 41 HZ2 LYS 41 -12.565 -3.751 -9.173 375 HZ3 LYS 41 HZ3 LYS 41 -12.506 -2.253 -8.560 376 H ILE 42 H ILE 42 -5.663 -0.511 -4.537 377 HA ILE 42 HA ILE 42 -4.293 1.988 -5.454 378 HB ILE 42 HB ILE 42 -5.255 1.031 -2.755 379 HG12 ILE 42 HG12 ILE 42 -6.045 3.668 -3.972 380 HG13 ILE 42 HG13 ILE 42 -6.699 2.245 -4.752 381 HG21 ILE 42 HG21 ILE 42 -3.694 3.579 -3.323 382 HG22 ILE 42 HG22 ILE 42 -4.522 3.175 -1.801 383 HG23 ILE 42 HG23 ILE 42 -3.155 2.205 -2.331 384 HD11 ILE 42 HD11 ILE 42 -6.985 2.793 -1.784 385 HD12 ILE 42 HD12 ILE 42 -8.238 3.022 -3.041 386 HD13 ILE 42 HD13 ILE 42 -7.617 1.405 -2.687 387 H VAL 43 H VAL 43 -3.675 -1.081 -3.684 388 HA VAL 43 HA VAL 43 -0.840 -0.364 -3.390 389 HB VAL 43 HB VAL 43 -2.236 -2.921 -2.548 390 HG11 VAL 43 HG11 VAL 43 0.440 -1.674 -1.737 391 HG12 VAL 43 HG12 VAL 43 -0.275 -3.139 -1.036 392 HG13 VAL 43 HG13 VAL 43 0.239 -3.146 -2.711 393 HG21 VAL 43 HG21 VAL 43 -3.227 -0.943 -1.442 394 HG22 VAL 43 HG22 VAL 43 -2.276 -1.874 -0.301 395 HG23 VAL 43 HG23 VAL 43 -1.608 -0.380 -0.986 396 H ALA 44 H ALA 44 -2.550 -3.090 -5.094 397 HA ALA 44 HA ALA 44 -0.085 -4.157 -6.152 398 HB1 ALA 44 HB1 ALA 44 -2.938 -4.514 -7.167 399 HB2 ALA 44 HB2 ALA 44 -1.541 -5.541 -7.531 400 HB3 ALA 44 HB3 ALA 44 -2.177 -5.477 -5.875 401 H ASP 45 H ASP 45 -2.497 -1.849 -7.388 402 HA ASP 45 HA ASP 45 -1.324 -1.259 -9.910 403 HB2 ASP 45 HB2 ASP 45 -3.540 -0.495 -9.071 404 HB3 ASP 45 HB3 ASP 45 -2.719 0.626 -7.976 405 H TYR 46 H TYR 46 -0.296 -0.123 -6.662 406 HA TYR 46 HA TYR 46 1.596 1.822 -7.708 407 HB2 TYR 46 HB2 TYR 46 0.379 1.544 -5.334 408 HB3 TYR 46 HB3 TYR 46 1.850 0.695 -4.930 409 HD1 TYR 46 HD1 TYR 46 0.624 3.327 -3.800 410 HD2 TYR 46 HD2 TYR 46 3.698 2.565 -6.717 411 HE1 TYR 46 HE1 TYR 46 1.623 5.554 -3.324 412 HE2 TYR 46 HE2 TYR 46 4.621 4.793 -6.367 413 HH TYR 46 HH TYR 46 3.127 7.198 -4.217 414 H ILE 47 H ILE 47 1.791 -1.543 -6.534 415 HA ILE 47 HA ILE 47 4.630 -1.869 -6.854 416 HB ILE 47 HB ILE 47 2.232 -3.639 -6.548 417 HG12 ILE 47 HG12 ILE 47 3.323 -4.442 -4.599 418 HG13 ILE 47 HG13 ILE 47 4.896 -3.842 -5.109 419 HG21 ILE 47 HG21 ILE 47 4.944 -4.727 -7.341 420 HG22 ILE 47 HG22 ILE 47 3.601 -5.683 -6.683 421 HG23 ILE 47 HG23 ILE 47 3.422 -4.894 -8.258 422 HD11 ILE 47 HD11 ILE 47 2.588 -2.069 -4.230 423 HD12 ILE 47 HD12 ILE 47 3.992 -2.535 -3.254 424 HD13 ILE 47 HD13 ILE 47 4.220 -1.540 -4.700 425 H SER 48 H SER 48 2.036 -1.860 -9.220 426 HA SER 48 HA SER 48 3.761 -2.648 -11.454 427 HB2 SER 48 HB2 SER 48 1.016 -1.351 -11.387 428 HB3 SER 48 HB3 SER 48 1.847 -1.897 -12.848 429 HG SER 48 HG SER 48 0.397 -3.487 -12.035 430 H GLU 49 H GLU 49 3.497 0.328 -9.693 431 HA GLU 49 HA GLU 49 4.105 1.987 -12.085 432 HB2 GLU 49 HB2 GLU 49 2.142 2.475 -10.589 433 HB3 GLU 49 HB3 GLU 49 3.275 2.768 -9.271 434 HG2 GLU 49 HG2 GLU 49 2.620 4.868 -10.148 435 HG3 GLU 49 HG3 GLU 49 4.297 4.620 -10.612 436 H VAL 50 H VAL 50 5.400 1.218 -8.828 437 HA VAL 50 HA VAL 50 7.955 2.591 -9.588 438 HB VAL 50 HB VAL 50 6.192 3.726 -7.984 439 HG11 VAL 50 HG11 VAL 50 7.670 2.036 -5.955 440 HG12 VAL 50 HG12 VAL 50 6.538 3.371 -5.667 441 HG13 VAL 50 HG13 VAL 50 5.965 1.872 -6.423 442 HG21 VAL 50 HG21 VAL 50 8.157 4.823 -8.605 443 HG22 VAL 50 HG22 VAL 50 8.081 4.886 -6.838 444 HG23 VAL 50 HG23 VAL 50 9.186 3.747 -7.662 445 H GLY 51 H GLY 51 6.619 -0.272 -8.216 446 HA2 GLY 51 HA2 GLY 51 8.261 -2.155 -8.666 447 HA3 GLY 51 HA3 GLY 51 9.364 -1.311 -7.573 448 H LEU 52 H LEU 52 8.675 -0.955 -5.428 449 HA LEU 52 HA LEU 52 6.469 -2.175 -4.099 450 HB2 LEU 52 HB2 LEU 52 7.533 -4.307 -4.645 451 HB3 LEU 52 HB3 LEU 52 9.094 -3.732 -4.077 452 HG LEU 52 HG LEU 52 8.336 -3.791 -1.764 453 HD11 LEU 52 HD11 LEU 52 5.657 -4.819 -2.811 454 HD12 LEU 52 HD12 LEU 52 6.158 -4.655 -1.107 455 HD13 LEU 52 HD13 LEU 52 5.918 -3.221 -2.081 456 HD21 LEU 52 HD21 LEU 52 9.203 -5.841 -2.885 457 HD22 LEU 52 HD22 LEU 52 8.081 -6.207 -1.562 458 HD23 LEU 52 HD23 LEU 52 7.544 -6.331 -3.252 459 H ASN 53 H ASN 53 9.802 -1.073 -3.949 460 HA ASN 53 HA ASN 53 9.550 -0.368 -1.087 461 HB2 ASN 53 HB2 ASN 53 11.917 -0.649 -0.968 462 HB3 ASN 53 HB3 ASN 53 11.231 -2.030 -1.815 463 HD21 ASN 53 HD21 ASN 53 13.115 -1.439 -4.751 464 HD22 ASN 53 HD22 ASN 53 11.947 -2.468 -3.941 465 H ASN 54 H ASN 54 9.338 1.371 -3.965 466 HA ASN 54 HA ASN 54 10.692 3.769 -2.850 467 HB2 ASN 54 HB2 ASN 54 9.525 3.225 -5.579 468 HB3 ASN 54 HB3 ASN 54 10.461 4.647 -5.133 469 HD21 ASN 54 HD21 ASN 54 12.384 1.357 -6.367 470 HD22 ASN 54 HD22 ASN 54 10.666 1.619 -6.625 471 H LEU 55 H LEU 55 7.462 2.520 -3.415 472 HA LEU 55 HA LEU 55 5.960 4.946 -3.183 473 HB2 LEU 55 HB2 LEU 55 4.088 3.479 -2.727 474 HB3 LEU 55 HB3 LEU 55 5.068 2.849 -4.028 475 HG LEU 55 HG LEU 55 6.166 1.492 -1.885 476 HD11 LEU 55 HD11 LEU 55 3.164 1.707 -1.386 477 HD12 LEU 55 HD12 LEU 55 4.297 0.603 -0.581 478 HD13 LEU 55 HD13 LEU 55 4.434 2.350 -0.323 479 HD21 LEU 55 HD21 LEU 55 5.475 0.509 -4.046 480 HD22 LEU 55 HD22 LEU 55 4.874 -0.425 -2.674 481 HD23 LEU 55 HD23 LEU 55 3.772 0.646 -3.563 482 H ASN 56 H ASN 56 4.610 5.641 -1.307 483 HA ASN 56 HA ASN 56 5.994 5.162 1.283 484 HB2 ASN 56 HB2 ASN 56 5.756 7.395 1.897 485 HB3 ASN 56 HB3 ASN 56 6.376 7.422 0.261 486 HD21 ASN 56 HD21 ASN 56 3.941 9.991 -0.072 487 HD22 ASN 56 HD22 ASN 56 5.647 9.654 0.187 488 H ALA 57 H ALA 57 4.554 5.859 3.124 489 HA ALA 57 HA ALA 57 2.209 4.078 3.087 490 HB1 ALA 57 HB1 ALA 57 3.772 5.539 5.252 491 HB2 ALA 57 HB2 ALA 57 2.441 4.410 5.562 492 HB3 ALA 57 HB3 ALA 57 3.928 3.829 4.788 493 H THR 58 H THR 58 2.852 7.487 2.923 494 HA THR 58 HA THR 58 0.504 8.551 4.151 495 HB THR 58 HB THR 58 2.178 9.775 1.927 496 HG1 THR 58 HG1 THR 58 3.396 10.631 3.627 497 HG21 THR 58 HG21 THR 58 0.484 11.007 4.142 498 HG22 THR 58 HG22 THR 58 1.584 11.912 3.074 499 HG23 THR 58 HG23 THR 58 0.184 11.084 2.390 500 H GLU 59 H GLU 59 1.251 7.918 0.671 501 HA GLU 59 HA GLU 59 -1.368 8.710 -0.240 502 HB2 GLU 59 HB2 GLU 59 0.559 6.806 -1.626 503 HB3 GLU 59 HB3 GLU 59 -0.806 7.669 -2.347 504 HG2 GLU 59 HG2 GLU 59 0.440 9.830 -1.462 505 HG3 GLU 59 HG3 GLU 59 1.847 8.754 -1.395 506 H LEU 60 H LEU 60 -0.053 5.421 0.337 507 HA LEU 60 HA LEU 60 -2.418 3.932 0.066 508 HB2 LEU 60 HB2 LEU 60 0.094 3.641 1.704 509 HB3 LEU 60 HB3 LEU 60 -1.281 2.634 2.137 510 HG LEU 60 HG LEU 60 -1.434 1.731 -0.123 511 HD11 LEU 60 HD11 LEU 60 1.091 3.330 -0.710 512 HD12 LEU 60 HD12 LEU 60 0.422 2.043 -1.736 513 HD13 LEU 60 HD13 LEU 60 -0.496 3.533 -1.490 514 HD21 LEU 60 HD21 LEU 60 -0.059 0.601 1.593 515 HD22 LEU 60 HD22 LEU 60 0.620 0.361 -0.026 516 HD23 LEU 60 HD23 LEU 60 1.357 1.543 1.073 517 H SER 61 H SER 61 -1.388 5.529 3.175 518 HA SER 61 HA SER 61 -3.732 4.717 4.565 519 HB2 SER 61 HB2 SER 61 -3.147 6.530 6.202 520 HB3 SER 61 HB3 SER 61 -1.897 5.317 5.897 521 HG SER 61 HG SER 61 -0.795 6.766 4.671 522 H LYS 62 H LYS 62 -3.232 7.428 2.456 523 HA LYS 62 HA LYS 62 -5.670 8.892 3.185 524 HB2 LYS 62 HB2 LYS 62 -3.718 9.080 0.859 525 HB3 LYS 62 HB3 LYS 62 -5.147 10.107 0.988 526 HG2 LYS 62 HG2 LYS 62 -4.374 11.177 2.966 527 HG3 LYS 62 HG3 LYS 62 -3.137 9.966 3.259 528 HD2 LYS 62 HD2 LYS 62 -2.072 11.957 2.439 529 HD3 LYS 62 HD3 LYS 62 -1.911 10.698 1.202 530 HE2 LYS 62 HE2 LYS 62 -3.799 11.697 -0.065 531 HE3 LYS 62 HE3 LYS 62 -4.053 12.887 1.217 532 HZ1 LYS 62 HZ1 LYS 62 -1.602 12.696 -0.454 533 HZ2 LYS 62 HZ2 LYS 62 -2.765 13.829 -0.604 534 HZ3 LYS 62 HZ3 LYS 62 -1.843 13.791 0.738 535 H ARG 63 H ARG 63 -4.809 6.700 0.500 536 HA ARG 63 HA ARG 63 -7.530 6.855 -0.648 537 HB2 ARG 63 HB2 ARG 63 -4.934 5.467 -1.396 538 HB3 ARG 63 HB3 ARG 63 -6.434 5.110 -2.241 539 HG2 ARG 63 HG2 ARG 63 -5.379 7.950 -2.010 540 HG3 ARG 63 HG3 ARG 63 -4.904 6.843 -3.306 541 HD2 ARG 63 HD2 ARG 63 -7.269 6.533 -3.951 542 HD3 ARG 63 HD3 ARG 63 -7.786 7.652 -2.696 543 HE ARG 63 HE ARG 63 -6.369 8.285 -5.228 544 HH11 ARG 63 HH11 ARG 63 -6.449 10.360 -5.988 545 HH12 ARG 63 HH12 ARG 63 -7.053 11.639 -4.975 546 HH21 ARG 63 HH21 ARG 63 -7.727 9.626 -2.284 547 HH22 ARG 63 HH22 ARG 63 -7.764 11.241 -2.937 548 H LEU 64 H LEU 64 -5.668 4.396 1.092 549 HA LEU 64 HA LEU 64 -7.787 2.385 0.851 550 HB2 LEU 64 HB2 LEU 64 -5.147 2.259 0.864 551 HB3 LEU 64 HB3 LEU 64 -5.345 2.136 2.606 552 HG LEU 64 HG LEU 64 -6.666 0.272 0.609 553 HD11 LEU 64 HD11 LEU 64 -3.968 -0.037 1.986 554 HD12 LEU 64 HD12 LEU 64 -4.769 -1.260 0.973 555 HD13 LEU 64 HD13 LEU 64 -4.239 0.267 0.258 556 HD21 LEU 64 HD21 LEU 64 -7.589 0.025 2.884 557 HD22 LEU 64 HD22 LEU 64 -6.564 -1.362 2.522 558 HD23 LEU 64 HD23 LEU 64 -5.950 -0.069 3.558 559 H ASN 65 H ASN 65 -6.951 4.899 3.087 560 HA ASN 65 HA ASN 65 -7.855 5.683 4.976 561 HB2 ASN 65 HB2 ASN 65 -9.958 5.442 3.620 562 HB3 ASN 65 HB3 ASN 65 -10.286 3.934 4.475 563 HD21 ASN 65 HD21 ASN 65 -11.037 5.642 7.598 564 HD22 ASN 65 HD22 ASN 65 -10.228 4.189 6.987 565 H ILE 66 H ILE 66 -6.002 4.487 5.703 566 HA ILE 66 HA ILE 66 -6.598 2.728 8.020 567 HB ILE 66 HB ILE 66 -4.425 1.516 7.547 568 HG12 ILE 66 HG12 ILE 66 -4.733 2.756 4.781 569 HG13 ILE 66 HG13 ILE 66 -3.440 3.073 5.950 570 HG21 ILE 66 HG21 ILE 66 -6.619 1.063 5.495 571 HG22 ILE 66 HG22 ILE 66 -5.452 -0.136 6.105 572 HG23 ILE 66 HG23 ILE 66 -6.677 0.533 7.186 573 HD11 ILE 66 HD11 ILE 66 -3.921 0.446 4.502 574 HD12 ILE 66 HD12 ILE 66 -2.699 1.662 4.133 575 HD13 ILE 66 HD13 ILE 66 -2.627 0.772 5.680 576 H THR 67 H THR 67 -4.805 2.844 9.648 577 HA THR 67 HA THR 67 -3.657 5.533 9.864 578 HB THR 67 HB THR 67 -4.283 4.354 11.895 579 HG1 THR 67 HG1 THR 67 -2.412 4.888 12.977 580 HG21 THR 67 HG21 THR 67 -1.918 2.501 11.373 581 HG22 THR 67 HG22 THR 67 -2.951 2.538 12.811 582 HG23 THR 67 HG23 THR 67 -3.627 2.016 11.264 583 H VAL 68 H VAL 68 -1.436 6.054 9.774 584 HA VAL 68 HA VAL 68 -0.098 5.090 7.461 585 HB VAL 68 HB VAL 68 1.233 6.542 9.779 586 HG11 VAL 68 HG11 VAL 68 1.758 6.596 6.771 587 HG12 VAL 68 HG12 VAL 68 2.642 7.520 8.004 588 HG13 VAL 68 HG13 VAL 68 2.760 5.760 7.976 589 HG21 VAL 68 HG21 VAL 68 -0.785 7.831 9.216 590 HG22 VAL 68 HG22 VAL 68 0.643 8.658 8.600 591 HG23 VAL 68 HG23 VAL 68 -0.386 7.736 7.487 592 H ASP 69 H ASP 69 0.249 4.142 10.858 593 HA ASP 69 HA ASP 69 2.565 2.517 10.472 594 HB2 ASP 69 HB2 ASP 69 1.801 3.444 12.654 595 HB3 ASP 69 HB3 ASP 69 0.417 2.348 12.621 596 H LYS 70 H LYS 70 -0.863 1.721 10.008 597 HA LYS 70 HA LYS 70 -0.321 -1.147 9.671 598 HB2 LYS 70 HB2 LYS 70 -2.739 0.577 9.027 599 HB3 LYS 70 HB3 LYS 70 -2.564 -1.061 8.393 600 HG2 LYS 70 HG2 LYS 70 -2.079 -1.737 10.887 601 HG3 LYS 70 HG3 LYS 70 -2.879 -0.218 11.277 602 HD2 LYS 70 HD2 LYS 70 -4.017 -2.571 9.693 603 HD3 LYS 70 HD3 LYS 70 -4.430 -2.120 11.349 604 HE2 LYS 70 HE2 LYS 70 -5.389 0.024 10.515 605 HE3 LYS 70 HE3 LYS 70 -5.010 -0.464 8.852 606 HZ1 LYS 70 HZ1 LYS 70 -6.826 -1.962 10.667 607 HZ2 LYS 70 HZ2 LYS 70 -7.325 -0.979 9.468 608 HZ3 LYS 70 HZ3 LYS 70 -6.532 -2.358 9.109 609 H ALA 71 H ALA 71 -0.248 1.692 7.585 610 HA ALA 71 HA ALA 71 0.038 0.138 5.113 611 HB1 ALA 71 HB1 ALA 71 0.722 3.045 5.747 612 HB2 ALA 71 HB2 ALA 71 0.635 2.320 4.129 613 HB3 ALA 71 HB3 ALA 71 -0.820 2.478 5.133 614 H LYS 72 H LYS 72 2.309 1.853 7.266 615 HA LYS 72 HA LYS 72 4.766 1.194 5.992 616 HB2 LYS 72 HB2 LYS 72 4.027 1.786 8.877 617 HB3 LYS 72 HB3 LYS 72 5.702 1.511 8.373 618 HG2 LYS 72 HG2 LYS 72 5.670 3.440 6.918 619 HG3 LYS 72 HG3 LYS 72 3.939 3.649 7.179 620 HD2 LYS 72 HD2 LYS 72 5.157 5.291 8.494 621 HD3 LYS 72 HD3 LYS 72 4.246 4.184 9.513 622 HE2 LYS 72 HE2 LYS 72 6.335 4.560 10.578 623 HE3 LYS 72 HE3 LYS 72 6.346 2.903 9.982 624 HZ1 LYS 72 HZ1 LYS 72 7.667 5.220 8.652 625 HZ2 LYS 72 HZ2 LYS 72 8.436 4.059 9.494 626 HZ3 LYS 72 HZ3 LYS 72 7.703 3.686 8.086 627 H THR 73 H THR 73 2.895 -0.817 8.278 628 HA THR 73 HA THR 73 5.025 -2.889 8.134 629 HB THR 73 HB THR 73 3.851 -2.354 10.278 630 HG1 THR 73 HG1 THR 73 3.939 -4.519 10.849 631 HG21 THR 73 HG21 THR 73 1.651 -4.174 9.207 632 HG22 THR 73 HG22 THR 73 1.778 -3.441 10.818 633 HG23 THR 73 HG23 THR 73 1.481 -2.418 9.409 634 H TYR 74 H TYR 74 1.630 -2.580 6.943 635 HA TYR 74 HA TYR 74 1.420 -5.186 5.917 636 HB2 TYR 74 HB2 TYR 74 -0.496 -3.783 6.134 637 HB3 TYR 74 HB3 TYR 74 0.211 -2.544 5.090 638 HD1 TYR 74 HD1 TYR 74 -0.896 -6.154 4.958 639 HD2 TYR 74 HD2 TYR 74 -0.339 -2.413 2.873 640 HE1 TYR 74 HE1 TYR 74 -1.816 -7.171 2.881 641 HE2 TYR 74 HE2 TYR 74 -1.286 -3.413 0.840 642 HH TYR 74 HH TYR 74 -2.254 -6.864 0.649 643 H ILE 75 H ILE 75 2.880 -2.331 4.338 644 HA ILE 75 HA ILE 75 3.406 -3.279 1.759 645 HB ILE 75 HB ILE 75 4.954 -1.508 3.674 646 HG12 ILE 75 HG12 ILE 75 3.546 -0.827 1.053 647 HG13 ILE 75 HG13 ILE 75 2.715 -0.821 2.592 648 HG21 ILE 75 HG21 ILE 75 5.730 -2.099 0.785 649 HG22 ILE 75 HG22 ILE 75 6.387 -0.773 1.768 650 HG23 ILE 75 HG23 ILE 75 6.701 -2.424 2.247 651 HD11 ILE 75 HD11 ILE 75 5.046 0.985 1.816 652 HD12 ILE 75 HD12 ILE 75 3.372 1.448 2.130 653 HD13 ILE 75 HD13 ILE 75 4.382 0.870 3.462 654 H LYS 76 H LYS 76 5.382 -3.932 4.687 655 HA LYS 76 HA LYS 76 7.045 -5.867 3.151 656 HB2 LYS 76 HB2 LYS 76 8.438 -5.941 5.203 657 HB3 LYS 76 HB3 LYS 76 8.321 -4.343 4.457 658 HG2 LYS 76 HG2 LYS 76 6.776 -3.577 6.170 659 HG3 LYS 76 HG3 LYS 76 6.686 -5.204 6.882 660 HD2 LYS 76 HD2 LYS 76 9.017 -5.141 7.511 661 HD3 LYS 76 HD3 LYS 76 9.279 -3.604 6.679 662 HE2 LYS 76 HE2 LYS 76 7.247 -3.912 8.933 663 HE3 LYS 76 HE3 LYS 76 8.954 -3.599 9.256 664 HZ1 LYS 76 HZ1 LYS 76 7.214 -1.807 7.625 665 HZ2 LYS 76 HZ2 LYS 76 7.713 -1.529 9.159 666 HZ3 LYS 76 HZ3 LYS 76 8.800 -1.565 7.949 667 H ASN 77 H ASN 77 4.478 -5.970 5.551 668 HA ASN 77 HA ASN 77 4.995 -8.696 6.301 669 HB2 ASN 77 HB2 ASN 77 3.626 -6.865 7.528 670 HB3 ASN 77 HB3 ASN 77 2.300 -7.272 6.432 671 HD21 ASN 77 HD21 ASN 77 3.457 -9.853 9.414 672 HD22 ASN 77 HD22 ASN 77 4.507 -8.530 8.916 673 H SER 78 H SER 78 3.098 -7.273 3.681 674 HA SER 78 HA SER 78 1.978 -9.833 2.810 675 HB2 SER 78 HB2 SER 78 0.792 -7.673 2.612 676 HB3 SER 78 HB3 SER 78 2.001 -7.123 1.441 677 HG SER 78 HG SER 78 0.135 -8.013 0.427 678 H ASN 79 H ASN 79 4.648 -7.756 1.732 679 HA ASN 79 HA ASN 79 5.234 -9.649 -0.514 680 HB2 ASN 79 HB2 ASN 79 6.106 -6.768 -0.247 681 HB3 ASN 79 HB3 ASN 79 6.121 -7.772 -1.694 682 HD21 ASN 79 HD21 ASN 79 2.792 -5.713 -0.668 683 HD22 ASN 79 HD22 ASN 79 4.254 -5.690 0.328 684 H ARG 80 H ARG 80 6.736 -8.192 2.265 685 HA ARG 80 HA ARG 80 8.782 -8.004 3.082 686 HB2 ARG 80 HB2 ARG 80 7.897 -10.416 3.499 687 HB3 ARG 80 HB3 ARG 80 9.140 -10.920 2.364 688 HG2 ARG 80 HG2 ARG 80 10.425 -11.058 4.255 689 HG3 ARG 80 HG3 ARG 80 10.669 -9.338 3.991 690 HD2 ARG 80 HD2 ARG 80 10.117 -9.545 6.279 691 HD3 ARG 80 HD3 ARG 80 8.678 -8.901 5.499 692 HE ARG 80 HE ARG 80 7.524 -10.863 6.001 693 HH11 ARG 80 HH11 ARG 80 7.201 -12.929 6.760 694 HH12 ARG 80 HH12 ARG 80 8.552 -13.890 7.275 695 HH21 ARG 80 HH21 ARG 80 10.922 -11.515 6.567 696 HH22 ARG 80 HH22 ARG 80 10.610 -13.116 7.172 697 H MET 81 H MET 81 8.941 -6.945 0.713 698 HA MET 81 HA MET 81 10.322 -6.037 -0.819 699 HB2 MET 81 HB2 MET 81 12.617 -7.231 0.737 700 HB3 MET 81 HB3 MET 81 12.677 -5.919 -0.437 701 HG2 MET 81 HG2 MET 81 12.740 -4.785 1.555 702 HG3 MET 81 HG3 MET 81 11.037 -4.669 1.125 703 HE1 MET 81 HE1 MET 81 10.637 -3.803 3.629 704 HE2 MET 81 HE2 MET 81 11.144 -4.706 5.076 705 HE3 MET 81 HE3 MET 81 12.367 -4.014 3.988 706 H GLY 82 H GLY 82 11.181 -9.474 -0.354 707 HA2 GLY 82 HA2 GLY 82 10.144 -10.631 -2.415 708 HA3 GLY 82 HA3 GLY 82 11.426 -9.818 -3.325 709 H ARG 83 H ARG 83 13.642 -10.109 -2.366 710 HA ARG 83 HA ARG 83 14.123 -12.755 -1.037 711 HB2 ARG 83 HB2 ARG 83 15.701 -11.746 -3.429 712 HB3 ARG 83 HB3 ARG 83 16.044 -13.176 -2.458 713 HG2 ARG 83 HG2 ARG 83 14.977 -14.202 -4.200 714 HG3 ARG 83 HG3 ARG 83 13.626 -13.945 -3.106 715 HD2 ARG 83 HD2 ARG 83 13.542 -11.621 -4.593 716 HD3 ARG 83 HD3 ARG 83 14.244 -12.712 -5.772 717 HE ARG 83 HE ARG 83 11.542 -12.827 -4.551 718 HH11 ARG 83 HH11 ARG 83 9.990 -14.109 -5.401 719 HH12 ARG 83 HH12 ARG 83 10.392 -15.288 -6.611 720 HH21 ARG 83 HH21 ARG 83 13.728 -14.511 -6.776 721 HH22 ARG 83 HH22 ARG 83 12.431 -15.516 -7.343 722 H THR 84 H THR 84 14.382 -9.634 -0.465 723 HA THR 84 HA THR 84 17.058 -9.050 0.055 724 HB THR 84 HB THR 84 14.513 -8.174 1.381 725 HG1 THR 84 HG1 THR 84 15.054 -6.281 0.071 726 HG21 THR 84 HG21 THR 84 17.274 -6.920 1.690 727 HG22 THR 84 HG22 THR 84 15.743 -6.130 2.151 728 HG23 THR 84 HG23 THR 84 16.253 -7.602 2.980 729 H ASN 85 H ASN 85 14.817 -10.535 2.117 730 HA ASN 85 HA ASN 85 16.870 -12.182 3.314 731 HB2 ASN 85 HB2 ASN 85 16.731 -9.898 4.709 732 HB3 ASN 85 HB3 ASN 85 15.311 -10.632 5.432 733 HD21 ASN 85 HD21 ASN 85 17.320 -13.146 7.154 734 HD22 ASN 85 HD22 ASN 85 15.784 -12.990 6.289 735 H ASN 86 H ASN 86 14.518 -12.471 1.767 736 HA ASN 86 HA ASN 86 12.714 -14.096 3.472 737 HB2 ASN 86 HB2 ASN 86 11.855 -11.981 2.482 738 HB3 ASN 86 HB3 ASN 86 12.170 -12.619 0.876 739 HD21 ASN 86 HD21 ASN 86 9.253 -14.572 0.812 740 HD22 ASN 86 HD22 ASN 86 10.739 -14.045 0.008 741 H PHE 87 H PHE 87 15.182 -15.152 2.486 742 HA PHE 87 HA PHE 87 14.275 -17.264 0.565 743 HB2 PHE 87 HB2 PHE 87 16.410 -17.148 -0.508 744 HB3 PHE 87 HB3 PHE 87 15.698 -15.539 -0.453 745 HD1 PHE 87 HD1 PHE 87 16.538 -13.819 1.094 746 HD2 PHE 87 HD2 PHE 87 18.517 -17.615 0.638 747 HE1 PHE 87 HE1 PHE 87 18.619 -12.862 2.110 748 HE2 PHE 87 HE2 PHE 87 20.566 -16.681 1.694 749 HZ PHE 87 HZ PHE 87 20.618 -14.303 2.426 750 H LYS 88 H LYS 88 14.553 -17.112 3.594 751 HA LYS 88 HA LYS 88 16.620 -18.950 4.399 752 HB2 LYS 88 HB2 LYS 88 15.690 -18.633 6.621 753 HB3 LYS 88 HB3 LYS 88 15.838 -17.096 5.762 754 HG2 LYS 88 HG2 LYS 88 13.368 -17.312 5.143 755 HG3 LYS 88 HG3 LYS 88 13.293 -18.711 6.229 756 HD2 LYS 88 HD2 LYS 88 13.976 -17.247 8.133 757 HD3 LYS 88 HD3 LYS 88 14.146 -15.887 7.009 758 HE2 LYS 88 HE2 LYS 88 12.027 -15.548 7.934 759 HE3 LYS 88 HE3 LYS 88 11.716 -16.252 6.338 760 HZ1 LYS 88 HZ1 LYS 88 11.685 -17.747 8.922 761 HZ2 LYS 88 HZ2 LYS 88 10.357 -17.300 8.091 762 HZ3 LYS 88 HZ3 LYS 88 11.371 -18.411 7.463 763 H THR 89 H THR 89 13.756 -19.689 2.922 764 HA THR 89 HA THR 89 13.889 -22.524 3.809 765 HB THR 89 HB THR 89 12.113 -21.361 5.111 766 HG1 THR 89 HG1 THR 89 10.705 -23.083 4.820 767 HG21 THR 89 HG21 THR 89 10.556 -21.406 2.515 768 HG22 THR 89 HG22 THR 89 9.986 -20.894 4.118 769 HG23 THR 89 HG23 THR 89 11.215 -19.933 3.275 770 H ILE 90 H ILE 90 12.659 -20.204 1.440 771 HA ILE 90 HA ILE 90 12.331 -22.026 -0.785 772 HB ILE 90 HB ILE 90 12.912 -19.062 -0.633 773 HG12 ILE 90 HG12 ILE 90 10.211 -20.229 -1.381 774 HG13 ILE 90 HG13 ILE 90 10.637 -20.197 0.317 775 HG21 ILE 90 HG21 ILE 90 11.973 -20.672 -3.034 776 HG22 ILE 90 HG22 ILE 90 11.929 -18.906 -2.934 777 HG23 ILE 90 HG23 ILE 90 13.478 -19.725 -2.886 778 HD11 ILE 90 HD11 ILE 90 10.621 -17.739 -1.460 779 HD12 ILE 90 HD12 ILE 90 9.374 -18.205 -0.279 780 HD13 ILE 90 HD13 ILE 90 11.007 -17.801 0.280 781 H LYS 91 H LYS 91 13.758 -22.052 -2.659 782 HA LYS 91 HA LYS 91 15.607 -22.781 -3.642 783 HB2 LYS 91 HB2 LYS 91 15.991 -20.263 -3.071 784 HB3 LYS 91 HB3 LYS 91 17.254 -20.840 -2.006 785 HG2 LYS 91 HG2 LYS 91 18.632 -21.459 -3.728 786 HG3 LYS 91 HG3 LYS 91 17.303 -21.977 -4.778 787 HD2 LYS 91 HD2 LYS 91 17.875 -19.053 -4.151 788 HD3 LYS 91 HD3 LYS 91 18.572 -19.878 -5.546 789 HE2 LYS 91 HE2 LYS 91 15.567 -19.980 -5.077 790 HE3 LYS 91 HE3 LYS 91 16.284 -18.524 -5.759 791 HZ1 LYS 91 HZ1 LYS 91 16.625 -21.234 -6.934 792 HZ2 LYS 91 HZ2 LYS 91 15.581 -20.109 -7.487 793 HZ3 LYS 91 HZ3 LYS 91 17.195 -19.832 -7.571 794 H MET 92 H MET 92 15.876 -23.026 -0.171 795 HA MET 92 HA MET 92 17.886 -25.206 -0.456 796 HB2 MET 92 HB2 MET 92 18.132 -25.079 1.969 797 HB3 MET 92 HB3 MET 92 18.520 -23.586 1.133 798 HG2 MET 92 HG2 MET 92 17.067 -22.417 2.329 799 HG3 MET 92 HG3 MET 92 15.744 -23.494 1.931 800 HE1 MET 92 HE1 MET 92 15.949 -26.172 3.234 801 HE2 MET 92 HE2 MET 92 15.354 -25.856 4.877 802 HE3 MET 92 HE3 MET 92 14.586 -25.054 3.490 803 H PHE 93 H PHE 93 14.433 -24.871 0.394 804 HA PHE 93 HA PHE 93 14.310 -27.747 1.002 805 HB2 PHE 93 HB2 PHE 93 12.262 -27.461 1.804 806 HB3 PHE 93 HB3 PHE 93 12.907 -25.872 2.115 807 HD1 PHE 93 HD1 PHE 93 9.967 -27.196 1.634 808 HD2 PHE 93 HD2 PHE 93 12.522 -24.519 -0.576 809 HE1 PHE 93 HE1 PHE 93 7.982 -26.212 0.523 810 HE2 PHE 93 HE2 PHE 93 10.535 -23.541 -1.688 811 HZ PHE 93 HZ PHE 93 8.260 -24.382 -1.139 812 H GLU 94 H GLU 94 14.562 -26.145 -1.865 813 HA GLU 94 HA GLU 94 12.674 -27.780 -3.443 814 HB2 GLU 94 HB2 GLU 94 14.601 -25.571 -4.256 815 HB3 GLU 94 HB3 GLU 94 13.468 -26.399 -5.335 816 HG2 GLU 94 HG2 GLU 94 11.560 -25.602 -3.946 817 HG3 GLU 94 HG3 GLU 94 12.693 -24.767 -2.883 818 H ASP 95 H ASP 95 13.294 -29.168 -5.149 819 HA ASP 95 HA ASP 95 16.077 -30.213 -5.129 820 HB2 ASP 95 HB2 ASP 95 14.700 -31.326 -3.348 821 HB3 ASP 95 HB3 ASP 95 13.615 -31.917 -4.604 822 H ASP 96 H ASP 96 14.783 -28.727 -7.191 823 HA ASP 96 HA ASP 96 14.039 -30.615 -9.329 824 HB2 ASP 96 HB2 ASP 96 14.382 -27.599 -9.303 825 HB3 ASP 96 HB3 ASP 96 13.905 -28.540 -10.714 826 H VAL 97 H VAL 97 15.190 -31.123 -11.129 827 HA VAL 97 HA VAL 97 18.060 -30.274 -11.320 828 HB VAL 97 HB VAL 97 16.999 -33.105 -11.674 829 HG11 VAL 97 HG11 VAL 97 19.845 -32.020 -11.838 830 HG12 VAL 97 HG12 VAL 97 19.391 -33.738 -11.865 831 HG13 VAL 97 HG13 VAL 97 18.894 -32.684 -13.187 832 HG21 VAL 97 HG21 VAL 97 17.122 -32.545 -9.286 833 HG22 VAL 97 HG22 VAL 97 18.419 -33.658 -9.713 834 HG23 VAL 97 HG23 VAL 97 18.776 -31.929 -9.494 835 H SER 98 H SER 98 15.399 -31.868 -13.120 836 HA SER 98 HA SER 98 16.463 -30.745 -15.663 837 HB2 SER 98 HB2 SER 98 15.242 -32.625 -16.717 838 HB3 SER 98 HB3 SER 98 16.474 -33.148 -15.559 839 HG SER 98 HG SER 98 14.480 -34.273 -15.284 840 H SER 99 H SER 99 14.225 -29.792 -13.534 841 HA SER 99 HA SER 99 12.057 -29.304 -15.468 842 HB2 SER 99 HB2 SER 99 11.810 -30.707 -13.300 843 HB3 SER 99 HB3 SER 99 11.714 -29.136 -12.487 844 HG SER 99 HG SER 99 9.652 -29.974 -13.125 845 H ALA 100 H ALA 100 14.561 -27.522 -14.591 846 HA ALA 100 HA ALA 100 13.183 -25.015 -13.862 847 HB1 ALA 100 HB1 ALA 100 16.128 -25.648 -14.281 848 HB2 ALA 100 HB2 ALA 100 15.460 -24.122 -13.663 849 HB3 ALA 100 HB3 ALA 100 15.268 -25.617 -12.724 850 H SER 101 H SER 101 12.623 -23.453 -15.240 851 HA SER 101 HA SER 101 13.849 -23.071 -17.894 852 HB2 SER 101 HB2 SER 101 10.893 -23.752 -17.555 853 HB3 SER 101 HB3 SER 101 11.620 -23.067 -19.018 854 HG SER 101 HG SER 101 11.396 -25.349 -19.141 855 H ALA 102 H ALA 102 13.877 -20.903 -18.311 856 HA ALA 102 HA ALA 102 13.736 -18.684 -17.928 857 HB1 ALA 102 HB1 ALA 102 10.775 -19.258 -17.646 858 HB2 ALA 102 HB2 ALA 102 11.525 -17.714 -18.103 859 HB3 ALA 102 HB3 ALA 102 11.663 -19.117 -19.184 860 H GLN 103 H GLN 103 14.382 -20.173 -15.622 861 HA GLN 103 HA GLN 103 13.610 -18.244 -13.477 862 HB2 GLN 103 HB2 GLN 103 13.972 -21.235 -13.234 863 HB3 GLN 103 HB3 GLN 103 13.892 -20.148 -11.848 864 HG2 GLN 103 HG2 GLN 103 11.655 -20.438 -13.891 865 HG3 GLN 103 HG3 GLN 103 11.742 -21.294 -12.362 866 HE21 GLN 103 HE21 GLN 103 10.620 -17.347 -12.381 867 HE22 GLN 103 HE22 GLN 103 11.328 -18.045 -13.834 868 HA PRO 104 HA PRO 104 18.245 -18.256 -13.792 869 HB2 PRO 104 HB2 PRO 104 18.804 -15.831 -14.856 870 HB3 PRO 104 HB3 PRO 104 18.169 -17.161 -15.863 871 HG2 PRO 104 HG2 PRO 104 16.562 -14.929 -14.551 872 HG3 PRO 104 HG3 PRO 104 16.575 -15.402 -16.282 873 HD2 PRO 104 HD2 PRO 104 14.704 -16.362 -14.534 874 HD3 PRO 104 HD3 PRO 104 15.373 -17.357 -15.865 875 H ASN 105 H ASN 105 16.996 -18.168 -11.457 876 HA ASN 105 HA ASN 105 17.911 -15.712 -9.997 877 HB2 ASN 105 HB2 ASN 105 15.454 -16.234 -9.975 878 HB3 ASN 105 HB3 ASN 105 15.811 -17.717 -9.095 879 HD21 ASN 105 HD21 ASN 105 16.867 -15.766 -6.132 880 HD22 ASN 105 HD22 ASN 105 17.481 -17.111 -7.094 881 H LEU 106 H LEU 106 20.066 -16.545 -10.141 882 HA LEU 106 HA LEU 106 20.727 -18.626 -8.103 883 HB2 LEU 106 HB2 LEU 106 22.096 -17.889 -10.717 884 HB3 LEU 106 HB3 LEU 106 22.863 -18.891 -9.497 885 HG LEU 106 HG LEU 106 20.241 -19.611 -10.885 886 HD11 LEU 106 HD11 LEU 106 23.078 -20.621 -11.360 887 HD12 LEU 106 HD12 LEU 106 21.601 -21.239 -12.134 888 HD13 LEU 106 HD13 LEU 106 22.138 -19.584 -12.457 889 HD21 LEU 106 HD21 LEU 106 20.453 -20.715 -8.690 890 HD22 LEU 106 HD22 LEU 106 20.718 -21.884 -9.983 891 HD23 LEU 106 HD23 LEU 106 22.108 -21.232 -9.088 892 HA PRO 107 HA PRO 107 22.978 -15.513 -5.893 893 HB2 PRO 107 HB2 PRO 107 24.945 -16.943 -4.637 894 HB3 PRO 107 HB3 PRO 107 23.212 -17.059 -4.204 895 HG2 PRO 107 HG2 PRO 107 24.803 -18.896 -6.025 896 HG3 PRO 107 HG3 PRO 107 23.715 -19.349 -4.674 897 HD2 PRO 107 HD2 PRO 107 22.861 -19.364 -7.248 898 HD3 PRO 107 HD3 PRO 107 21.784 -18.822 -5.929 Start of MODEL 30 1 H1 GLY -5 H1 GLY -5 -47.237 38.770 -1.506 2 H2 GLY -5 H2 GLY -5 -46.909 38.456 -3.079 3 H3 GLY -5 H3 GLY -5 -46.194 39.728 -2.331 4 HA2 GLY -5 HA2 GLY -5 -44.612 37.937 -2.565 5 HA3 GLY -5 HA3 GLY -5 -44.976 38.267 -0.861 6 H SER -4 H SER -4 -44.130 36.054 -0.601 7 HA SER -4 HA SER -4 -46.324 34.086 -0.524 8 HB2 SER -4 HB2 SER -4 -45.050 33.753 -2.712 9 HB3 SER -4 HB3 SER -4 -43.642 33.308 -1.723 10 HG SER -4 HG SER -4 -44.992 31.512 -2.405 11 H HIS -3 H HIS -3 -45.675 32.154 0.774 12 HA HIS -3 HA HIS -3 -43.534 32.645 2.791 13 HB2 HIS -3 HB2 HIS -3 -45.842 33.490 3.559 14 HB3 HIS -3 HB3 HIS -3 -46.326 31.801 3.625 15 HD2 HIS -3 HD2 HIS -3 -44.532 30.230 5.317 16 HE1 HIS -3 HE1 HIS -3 -43.794 33.545 7.900 17 HE2 HIS -3 HE2 HIS -3 -43.614 31.018 7.660 18 H MET -2 H MET -2 -42.281 30.953 2.937 19 HA MET -2 HA MET -2 -43.360 28.197 2.454 20 HB2 MET -2 HB2 MET -2 -40.684 29.354 1.587 21 HB3 MET -2 HB3 MET -2 -41.119 27.639 1.538 22 HG2 MET -2 HG2 MET -2 -43.013 28.165 0.027 23 HG3 MET -2 HG3 MET -2 -42.536 29.867 0.028 24 HE1 MET -2 HE1 MET -2 -42.547 29.851 -2.621 25 HE2 MET -2 HE2 MET -2 -41.648 28.674 -3.605 26 HE3 MET -2 HE3 MET -2 -43.014 28.133 -2.604 27 H ALA -1 H ALA -1 -43.504 27.306 4.355 28 HA ALA -1 HA ALA -1 -41.085 27.162 6.110 29 HB1 ALA -1 HB1 ALA -1 -43.951 27.587 7.056 30 HB2 ALA -1 HB2 ALA -1 -42.543 27.262 8.095 31 HB3 ALA -1 HB3 ALA -1 -42.614 28.751 7.137 32 H SER 0 H SER 0 -44.345 25.635 5.997 33 HA SER 0 HA SER 0 -45.025 23.493 6.165 34 HB2 SER 0 HB2 SER 0 -43.901 23.754 3.840 35 HB3 SER 0 HB3 SER 0 -42.688 22.634 4.484 36 HG SER 0 HG SER 0 -44.421 21.549 3.407 37 H MET 1 H MET 1 -43.257 24.281 8.278 38 HA MET 1 HA MET 1 -42.790 21.667 9.479 39 HB2 MET 1 HB2 MET 1 -40.421 21.911 9.986 40 HB3 MET 1 HB3 MET 1 -40.692 21.965 8.256 41 HG2 MET 1 HG2 MET 1 -39.135 23.625 8.548 42 HG3 MET 1 HG3 MET 1 -40.630 24.548 8.497 43 HE1 MET 1 HE1 MET 1 -39.589 26.690 9.472 44 HE2 MET 1 HE2 MET 1 -38.531 26.738 10.898 45 HE3 MET 1 HE3 MET 1 -37.998 25.894 9.427 46 H ASP 2 H ASP 2 -43.176 25.003 9.883 47 HA ASP 2 HA ASP 2 -43.213 24.750 12.856 48 HB2 ASP 2 HB2 ASP 2 -41.645 26.401 11.590 49 HB3 ASP 2 HB3 ASP 2 -43.095 27.350 11.311 50 H GLN 3 H GLN 3 -45.360 24.210 10.722 51 HA GLN 3 HA GLN 3 -47.668 25.608 11.949 52 HB2 GLN 3 HB2 GLN 3 -46.650 27.009 10.102 53 HB3 GLN 3 HB3 GLN 3 -46.979 25.700 8.985 54 HG2 GLN 3 HG2 GLN 3 -49.477 26.270 10.284 55 HG3 GLN 3 HG3 GLN 3 -48.723 27.831 9.997 56 HE21 GLN 3 HE21 GLN 3 -49.588 25.446 6.709 57 HE22 GLN 3 HE22 GLN 3 -49.206 24.702 8.271 58 H LEU 4 H LEU 4 -46.832 22.877 12.112 59 HA LEU 4 HA LEU 4 -48.991 21.402 10.647 60 HB2 LEU 4 HB2 LEU 4 -46.119 20.596 11.239 61 HB3 LEU 4 HB3 LEU 4 -47.385 19.402 11.045 62 HG LEU 4 HG LEU 4 -47.909 20.347 8.764 63 HD11 LEU 4 HD11 LEU 4 -45.278 21.811 9.229 64 HD12 LEU 4 HD12 LEU 4 -45.997 21.520 7.626 65 HD13 LEU 4 HD13 LEU 4 -46.846 22.530 8.783 66 HD21 LEU 4 HD21 LEU 4 -46.614 18.287 9.106 67 HD22 LEU 4 HD22 LEU 4 -46.004 19.186 7.714 68 HD23 LEU 4 HD23 LEU 4 -45.115 19.234 9.253 69 H ASP 5 H ASP 5 -49.645 19.391 11.788 70 HA ASP 5 HA ASP 5 -49.787 19.750 14.757 71 HB2 ASP 5 HB2 ASP 5 -51.759 20.632 13.453 72 HB3 ASP 5 HB3 ASP 5 -52.054 18.993 12.880 73 H GLU 6 H GLU 6 -48.604 17.673 12.533 74 HA GLU 6 HA GLU 6 -49.641 15.152 13.639 75 HB2 GLU 6 HB2 GLU 6 -48.485 14.086 11.803 76 HB3 GLU 6 HB3 GLU 6 -49.494 15.410 11.238 77 HG2 GLU 6 HG2 GLU 6 -47.524 16.863 10.978 78 HG3 GLU 6 HG3 GLU 6 -46.477 15.618 11.660 79 H ILE 7 H ILE 7 -47.620 17.019 15.109 80 HA ILE 7 HA ILE 7 -45.174 15.498 15.301 81 HB ILE 7 HB ILE 7 -46.129 17.660 17.213 82 HG12 ILE 7 HG12 ILE 7 -44.353 18.957 15.585 83 HG13 ILE 7 HG13 ILE 7 -45.071 17.874 14.400 84 HG21 ILE 7 HG21 ILE 7 -43.345 16.647 16.477 85 HG22 ILE 7 HG22 ILE 7 -43.703 18.000 17.571 86 HG23 ILE 7 HG23 ILE 7 -44.190 16.372 18.019 87 HD11 ILE 7 HD11 ILE 7 -46.557 19.852 16.192 88 HD12 ILE 7 HD12 ILE 7 -46.195 20.055 14.469 89 HD13 ILE 7 HD13 ILE 7 -47.328 18.799 14.989 90 H ILE 8 H ILE 8 -44.565 13.939 16.665 91 HA ILE 8 HA ILE 8 -46.185 13.233 19.064 92 HB ILE 8 HB ILE 8 -45.198 11.265 16.959 93 HG12 ILE 8 HG12 ILE 8 -48.040 11.998 17.815 94 HG13 ILE 8 HG13 ILE 8 -47.274 12.453 16.295 95 HG21 ILE 8 HG21 ILE 8 -46.642 10.731 19.600 96 HG22 ILE 8 HG22 ILE 8 -46.220 9.509 18.381 97 HG23 ILE 8 HG23 ILE 8 -44.945 10.332 19.244 98 HD11 ILE 8 HD11 ILE 8 -48.070 9.650 17.122 99 HD12 ILE 8 HD12 ILE 8 -48.722 10.643 15.815 100 HD13 ILE 8 HD13 ILE 8 -47.064 10.025 15.698 101 H GLU 9 H GLU 9 -44.995 12.630 20.809 102 HA GLU 9 HA GLU 9 -42.047 12.264 20.610 103 HB2 GLU 9 HB2 GLU 9 -43.453 14.225 22.473 104 HB3 GLU 9 HB3 GLU 9 -41.754 13.754 22.579 105 HG2 GLU 9 HG2 GLU 9 -41.388 14.637 20.262 106 HG3 GLU 9 HG3 GLU 9 -43.050 15.240 20.259 107 H GLN 10 H GLN 10 -41.132 11.505 22.746 108 HA GLN 10 HA GLN 10 -43.015 9.782 24.284 109 HB2 GLN 10 HB2 GLN 10 -41.318 8.776 22.309 110 HB3 GLN 10 HB3 GLN 10 -40.361 8.577 23.785 111 HG2 GLN 10 HG2 GLN 10 -42.197 7.300 24.825 112 HG3 GLN 10 HG3 GLN 10 -43.234 7.607 23.427 113 HE21 GLN 10 HE21 GLN 10 -40.307 4.731 23.128 114 HE22 GLN 10 HE22 GLN 10 -40.255 5.857 24.474 115 H ILE 11 H ILE 11 -41.811 8.730 26.170 116 HA ILE 11 HA ILE 11 -41.031 10.765 27.944 117 HB ILE 11 HB ILE 11 -42.267 8.708 28.481 118 HG12 ILE 11 HG12 ILE 11 -39.772 9.006 30.175 119 HG13 ILE 11 HG13 ILE 11 -41.120 10.149 30.166 120 HG21 ILE 11 HG21 ILE 11 -39.600 7.224 28.441 121 HG22 ILE 11 HG22 ILE 11 -41.197 6.564 28.824 122 HG23 ILE 11 HG23 ILE 11 -40.842 7.070 27.179 123 HD11 ILE 11 HD11 ILE 11 -41.265 7.226 31.025 124 HD12 ILE 11 HD12 ILE 11 -41.342 8.655 32.069 125 HD13 ILE 11 HD13 ILE 11 -42.655 8.331 30.920 126 H GLN 12 H GLN 12 -38.968 8.767 25.943 127 HA GLN 12 HA GLN 12 -36.710 8.567 25.705 128 HB2 GLN 12 HB2 GLN 12 -36.883 11.491 26.490 129 HB3 GLN 12 HB3 GLN 12 -35.433 10.745 25.833 130 HG2 GLN 12 HG2 GLN 12 -38.094 10.766 24.351 131 HG3 GLN 12 HG3 GLN 12 -36.846 11.989 24.168 132 HE21 GLN 12 HE21 GLN 12 -36.347 8.421 22.268 133 HE22 GLN 12 HE22 GLN 12 -37.771 8.704 23.254 134 H LYS 13 H LYS 13 -37.452 7.380 27.997 135 HA LYS 13 HA LYS 13 -35.375 7.983 30.052 136 HB2 LYS 13 HB2 LYS 13 -37.896 7.485 30.546 137 HB3 LYS 13 HB3 LYS 13 -37.456 5.795 30.264 138 HG2 LYS 13 HG2 LYS 13 -35.587 6.168 32.021 139 HG3 LYS 13 HG3 LYS 13 -36.347 7.721 32.360 140 HD2 LYS 13 HD2 LYS 13 -37.605 4.959 32.669 141 HD3 LYS 13 HD3 LYS 13 -36.998 5.991 33.970 142 HE2 LYS 13 HE2 LYS 13 -38.704 7.722 33.371 143 HE3 LYS 13 HE3 LYS 13 -39.341 6.635 32.127 144 HZ1 LYS 13 HZ1 LYS 13 -39.273 6.042 35.039 145 HZ2 LYS 13 HZ2 LYS 13 -40.607 6.435 34.190 146 HZ3 LYS 13 HZ3 LYS 13 -39.843 5.024 33.897 147 H GLU 14 H GLU 14 -35.955 5.903 27.410 148 HA GLU 14 HA GLU 14 -34.873 4.204 26.443 149 HB2 GLU 14 HB2 GLU 14 -33.181 6.208 26.715 150 HB3 GLU 14 HB3 GLU 14 -32.292 5.068 27.732 151 HG2 GLU 14 HG2 GLU 14 -32.423 3.424 25.791 152 HG3 GLU 14 HG3 GLU 14 -33.197 4.698 24.848 153 H ALA 15 H ALA 15 -36.171 3.295 28.640 154 HA ALA 15 HA ALA 15 -34.790 1.870 30.586 155 HB1 ALA 15 HB1 ALA 15 -37.500 1.325 29.321 156 HB2 ALA 15 HB2 ALA 15 -36.944 0.684 30.884 157 HB3 ALA 15 HB3 ALA 15 -37.161 2.434 30.667 158 H ILE 16 H ILE 16 -36.321 0.282 27.782 159 HA ILE 16 HA ILE 16 -34.283 -1.889 27.877 160 HB ILE 16 HB ILE 16 -37.298 -1.990 27.971 161 HG12 ILE 16 HG12 ILE 16 -35.153 -3.399 29.616 162 HG13 ILE 16 HG13 ILE 16 -36.053 -1.963 30.096 163 HG21 ILE 16 HG21 ILE 16 -35.551 -4.372 27.199 164 HG22 ILE 16 HG22 ILE 16 -37.292 -4.441 27.562 165 HG23 ILE 16 HG23 ILE 16 -36.742 -3.562 26.155 166 HD11 ILE 16 HD11 ILE 16 -37.177 -4.758 29.777 167 HD12 ILE 16 HD12 ILE 16 -37.022 -3.789 31.246 168 HD13 ILE 16 HD13 ILE 16 -38.180 -3.300 29.993 169 H ASN 17 H ASN 17 -35.600 0.356 25.957 170 HA ASN 17 HA ASN 17 -35.744 -1.219 23.532 171 HB2 ASN 17 HB2 ASN 17 -35.775 1.812 23.917 172 HB3 ASN 17 HB3 ASN 17 -36.143 0.987 22.405 173 HD21 ASN 17 HD21 ASN 17 -39.096 1.400 25.070 174 HD22 ASN 17 HD22 ASN 17 -37.579 2.278 25.181 175 H SER 18 H SER 18 -33.101 0.174 25.148 176 HA SER 18 HA SER 18 -31.403 0.529 22.766 177 HB2 SER 18 HB2 SER 18 -31.145 1.977 24.708 178 HB3 SER 18 HB3 SER 18 -30.683 0.590 25.715 179 HG SER 18 HG SER 18 -28.903 1.821 24.815 180 H ASN 19 H ASN 19 -31.371 -1.808 25.544 181 HA ASN 19 HA ASN 19 -29.159 -3.229 24.467 182 HB2 ASN 19 HB2 ASN 19 -29.421 -4.757 26.288 183 HB3 ASN 19 HB3 ASN 19 -29.757 -3.139 26.881 184 HD21 ASN 19 HD21 ASN 19 -33.005 -4.060 27.952 185 HD22 ASN 19 HD22 ASN 19 -31.727 -2.852 27.977 186 H VAL 20 H VAL 20 -32.435 -3.512 23.633 187 HA VAL 20 HA VAL 20 -32.288 -6.186 22.436 188 HB VAL 20 HB VAL 20 -34.348 -3.960 22.204 189 HG11 VAL 20 HG11 VAL 20 -34.517 -6.854 21.254 190 HG12 VAL 20 HG12 VAL 20 -35.900 -5.746 21.394 191 HG13 VAL 20 HG13 VAL 20 -34.616 -5.393 20.243 192 HG21 VAL 20 HG21 VAL 20 -34.164 -4.951 24.480 193 HG22 VAL 20 HG22 VAL 20 -35.687 -5.392 23.712 194 HG23 VAL 20 HG23 VAL 20 -34.358 -6.572 23.790 195 H VAL 21 H VAL 21 -31.372 -2.981 21.430 196 HA VAL 21 HA VAL 21 -31.026 -3.859 18.599 197 HB VAL 21 HB VAL 21 -31.956 -1.064 19.316 198 HG11 VAL 21 HG11 VAL 21 -32.092 -2.717 16.741 199 HG12 VAL 21 HG12 VAL 21 -32.640 -1.040 16.940 200 HG13 VAL 21 HG13 VAL 21 -30.923 -1.421 17.052 201 HG21 VAL 21 HG21 VAL 21 -33.779 -2.506 20.061 202 HG22 VAL 21 HG22 VAL 21 -34.223 -1.744 18.539 203 HG23 VAL 21 HG23 VAL 21 -33.701 -3.444 18.549 204 H LEU 22 H LEU 22 -28.973 -4.255 20.106 205 HA LEU 22 HA LEU 22 -27.014 -2.196 19.242 206 HB2 LEU 22 HB2 LEU 22 -27.321 -3.396 22.004 207 HB3 LEU 22 HB3 LEU 22 -25.725 -2.939 21.434 208 HG LEU 22 HG LEU 22 -28.057 -0.984 21.563 209 HD11 LEU 22 HD11 LEU 22 -25.717 -1.420 23.476 210 HD12 LEU 22 HD12 LEU 22 -26.913 -0.107 23.570 211 HD13 LEU 22 HD13 LEU 22 -27.425 -1.781 23.812 212 HD21 LEU 22 HD21 LEU 22 -26.310 -0.284 19.964 213 HD22 LEU 22 HD22 LEU 22 -26.265 0.719 21.411 214 HD23 LEU 22 HD23 LEU 22 -25.058 -0.565 21.198 215 H LYS 23 H LYS 23 -24.984 -2.900 18.764 216 HA LYS 23 HA LYS 23 -24.641 -5.819 18.165 217 HB2 LYS 23 HB2 LYS 23 -23.918 -3.409 16.450 218 HB3 LYS 23 HB3 LYS 23 -23.504 -5.089 16.077 219 HG2 LYS 23 HG2 LYS 23 -25.876 -5.702 15.934 220 HG3 LYS 23 HG3 LYS 23 -26.359 -4.067 16.393 221 HD2 LYS 23 HD2 LYS 23 -26.619 -4.316 14.021 222 HD3 LYS 23 HD3 LYS 23 -25.329 -3.150 14.348 223 HE2 LYS 23 HE2 LYS 23 -23.626 -4.898 13.894 224 HE3 LYS 23 HE3 LYS 23 -24.905 -6.091 13.630 225 HZ1 LYS 23 HZ1 LYS 23 -24.489 -3.649 11.983 226 HZ2 LYS 23 HZ2 LYS 23 -24.095 -5.167 11.531 227 HZ3 LYS 23 HZ3 LYS 23 -25.661 -4.760 11.733 228 H ASN 24 H ASN 24 -23.724 -4.566 20.526 229 HA ASN 24 HA ASN 24 -21.958 -4.088 21.853 230 HB2 ASN 24 HB2 ASN 24 -21.914 -6.582 21.386 231 HB3 ASN 24 HB3 ASN 24 -20.554 -6.290 20.309 232 HD21 ASN 24 HD21 ASN 24 -18.291 -5.589 23.033 233 HD22 ASN 24 HD22 ASN 24 -18.648 -5.133 21.360 234 HA PRO 25 HA PRO 25 -19.611 -1.585 18.673 235 HB2 PRO 25 HB2 PRO 25 -20.634 0.902 18.976 236 HB3 PRO 25 HB3 PRO 25 -21.517 -0.384 18.104 237 HG2 PRO 25 HG2 PRO 25 -21.871 0.443 21.012 238 HG3 PRO 25 HG3 PRO 25 -23.132 0.267 19.750 239 HD2 PRO 25 HD2 PRO 25 -22.540 -1.741 21.518 240 HD3 PRO 25 HD3 PRO 25 -23.029 -2.060 19.827 241 H ARG 26 H ARG 26 -17.973 -2.319 20.226 242 HA ARG 26 HA ARG 26 -16.782 0.011 21.711 243 HB2 ARG 26 HB2 ARG 26 -17.030 -2.861 22.665 244 HB3 ARG 26 HB3 ARG 26 -15.764 -1.774 23.255 245 HG2 ARG 26 HG2 ARG 26 -17.515 -0.127 23.943 246 HG3 ARG 26 HG3 ARG 26 -18.767 -1.308 23.503 247 HD2 ARG 26 HD2 ARG 26 -17.939 -2.881 25.171 248 HD3 ARG 26 HD3 ARG 26 -16.514 -1.869 25.471 249 HE ARG 26 HE ARG 26 -19.105 -0.564 25.965 250 HH11 ARG 26 HH11 ARG 26 -19.498 0.230 28.005 251 HH12 ARG 26 HH12 ARG 26 -18.517 -0.289 29.344 252 HH21 ARG 26 HH21 ARG 26 -16.507 -2.357 27.493 253 HH22 ARG 26 HH22 ARG 26 -16.862 -1.702 29.069 254 H VAL 27 H VAL 27 -15.815 -3.226 20.470 255 HA VAL 27 HA VAL 27 -13.508 -2.045 19.114 256 HB VAL 27 HB VAL 27 -12.711 -2.200 21.334 257 HG11 VAL 27 HG11 VAL 27 -13.128 -5.203 21.388 258 HG12 VAL 27 HG12 VAL 27 -12.388 -4.184 22.627 259 HG13 VAL 27 HG13 VAL 27 -14.112 -4.018 22.278 260 HG21 VAL 27 HG21 VAL 27 -11.161 -2.653 19.466 261 HG22 VAL 27 HG22 VAL 27 -10.677 -3.474 20.958 262 HG23 VAL 27 HG23 VAL 27 -11.447 -4.398 19.654 263 HA PRO 28 HA PRO 28 -14.682 -5.765 16.768 264 HB2 PRO 28 HB2 PRO 28 -13.870 -5.002 14.309 265 HB3 PRO 28 HB3 PRO 28 -15.335 -4.311 15.080 266 HG2 PRO 28 HG2 PRO 28 -12.557 -3.107 14.930 267 HG3 PRO 28 HG3 PRO 28 -14.139 -2.302 14.663 268 HD2 PRO 28 HD2 PRO 28 -12.720 -2.208 17.033 269 HD3 PRO 28 HD3 PRO 28 -14.500 -2.050 16.931 270 H THR 29 H THR 29 -13.591 -7.461 15.710 271 HA THR 29 HA THR 29 -10.754 -7.775 16.328 272 HB THR 29 HB THR 29 -11.263 -10.097 15.312 273 HG1 THR 29 HG1 THR 29 -13.450 -10.625 15.284 274 HG21 THR 29 HG21 THR 29 -12.802 -9.185 17.782 275 HG22 THR 29 HG22 THR 29 -12.359 -10.861 17.382 276 HG23 THR 29 HG23 THR 29 -11.095 -9.676 17.742 277 H GLN 30 H GLN 30 -10.529 -5.846 14.876 278 HA GLN 30 HA GLN 30 -9.698 -4.866 13.064 279 HB2 GLN 30 HB2 GLN 30 -8.342 -7.568 12.734 280 HB3 GLN 30 HB3 GLN 30 -7.888 -6.118 11.847 281 HG2 GLN 30 HG2 GLN 30 -6.375 -6.257 13.642 282 HG3 GLN 30 HG3 GLN 30 -7.471 -4.922 13.980 283 HE21 GLN 30 HE21 GLN 30 -8.078 -6.277 17.206 284 HE22 GLN 30 HE22 GLN 30 -7.810 -4.852 16.216 285 H LYS 31 H LYS 31 -12.291 -6.051 12.608 286 HA LYS 31 HA LYS 31 -12.401 -7.101 9.933 287 HB2 LYS 31 HB2 LYS 31 -13.794 -7.702 11.973 288 HB3 LYS 31 HB3 LYS 31 -14.664 -6.195 11.760 289 HG2 LYS 31 HG2 LYS 31 -15.892 -8.139 10.959 290 HG3 LYS 31 HG3 LYS 31 -15.625 -7.014 9.648 291 HD2 LYS 31 HD2 LYS 31 -13.693 -9.317 10.063 292 HD3 LYS 31 HD3 LYS 31 -15.273 -9.654 9.377 293 HE2 LYS 31 HE2 LYS 31 -13.361 -7.594 8.194 294 HE3 LYS 31 HE3 LYS 31 -13.403 -9.292 7.710 295 HZ1 LYS 31 HZ1 LYS 31 -15.689 -7.407 7.476 296 HZ2 LYS 31 HZ2 LYS 31 -14.776 -7.954 6.239 297 HZ3 LYS 31 HZ3 LYS 31 -15.732 -8.988 7.059 298 H THR 32 H THR 32 -11.215 -4.586 9.858 299 HA THR 32 HA THR 32 -13.184 -2.810 8.467 300 HB THR 32 HB THR 32 -12.955 -2.364 10.905 301 HG1 THR 32 HG1 THR 32 -12.768 -0.157 10.684 302 HG21 THR 32 HG21 THR 32 -10.137 -1.426 10.225 303 HG22 THR 32 HG22 THR 32 -10.974 -1.250 11.783 304 HG23 THR 32 HG23 THR 32 -10.552 -2.862 11.188 305 H GLY 33 H GLY 33 -10.544 -4.421 7.764 306 HA2 GLY 33 HA2 GLY 33 -9.635 -2.576 5.674 307 HA3 GLY 33 HA3 GLY 33 -8.460 -2.805 6.974 308 H GLU 34 H GLU 34 -10.680 -5.219 5.551 309 HA GLU 34 HA GLU 34 -8.407 -7.090 5.389 310 HB2 GLU 34 HB2 GLU 34 -11.404 -7.533 5.409 311 HB3 GLU 34 HB3 GLU 34 -10.208 -8.829 5.346 312 HG2 GLU 34 HG2 GLU 34 -10.378 -6.799 7.616 313 HG3 GLU 34 HG3 GLU 34 -11.147 -8.375 7.621 314 H LEU 35 H LEU 35 -8.877 -5.097 3.245 315 HA LEU 35 HA LEU 35 -8.566 -4.857 1.081 316 HB2 LEU 35 HB2 LEU 35 -6.668 -6.504 2.166 317 HB3 LEU 35 HB3 LEU 35 -7.184 -7.476 0.811 318 HG LEU 35 HG LEU 35 -6.875 -5.223 -0.567 319 HD11 LEU 35 HD11 LEU 35 -5.027 -4.719 1.828 320 HD12 LEU 35 HD12 LEU 35 -5.124 -3.748 0.351 321 HD13 LEU 35 HD13 LEU 35 -6.487 -3.784 1.484 322 HD21 LEU 35 HD21 LEU 35 -5.538 -7.226 -0.913 323 HD22 LEU 35 HD22 LEU 35 -4.469 -5.811 -0.874 324 HD23 LEU 35 HD23 LEU 35 -4.597 -6.888 0.541 325 H SER 36 H SER 36 -10.672 -4.826 0.371 326 HA SER 36 HA SER 36 -12.099 -7.233 -0.453 327 HB2 SER 36 HB2 SER 36 -13.263 -5.416 0.626 328 HB3 SER 36 HB3 SER 36 -12.870 -4.330 -0.719 329 HG SER 36 HG SER 36 -14.974 -5.320 -0.880 330 H GLU 37 H GLU 37 -11.821 -4.412 -2.513 331 HA GLU 37 HA GLU 37 -10.723 -5.974 -4.778 332 HB2 GLU 37 HB2 GLU 37 -13.502 -5.833 -4.140 333 HB3 GLU 37 HB3 GLU 37 -13.297 -4.662 -5.436 334 HG2 GLU 37 HG2 GLU 37 -12.347 -7.555 -5.494 335 HG3 GLU 37 HG3 GLU 37 -13.896 -7.013 -6.132 336 H GLU 38 H GLU 38 -12.218 -2.917 -3.732 337 HA GLU 38 HA GLU 38 -10.808 -1.318 -5.730 338 HB2 GLU 38 HB2 GLU 38 -12.959 -0.674 -4.699 339 HB3 GLU 38 HB3 GLU 38 -12.172 -0.532 -3.125 340 HG2 GLU 38 HG2 GLU 38 -10.781 1.320 -3.956 341 HG3 GLU 38 HG3 GLU 38 -11.421 1.100 -5.590 342 H GLN 39 H GLN 39 -10.039 -2.574 -2.556 343 HA GLN 39 HA GLN 39 -8.071 -0.611 -1.835 344 HB2 GLN 39 HB2 GLN 39 -8.501 -3.415 -0.736 345 HB3 GLN 39 HB3 GLN 39 -7.630 -2.111 0.060 346 HG2 GLN 39 HG2 GLN 39 -10.617 -2.316 -0.451 347 HG3 GLN 39 HG3 GLN 39 -9.781 -2.252 1.090 348 HE21 GLN 39 HE21 GLN 39 -10.938 1.212 -0.603 349 HE22 GLN 39 HE22 GLN 39 -11.496 -0.348 -1.183 350 H LYS 40 H LYS 40 -7.646 -4.006 -2.963 351 HA LYS 40 HA LYS 40 -4.795 -3.731 -3.338 352 HB2 LYS 40 HB2 LYS 40 -4.919 -5.840 -4.541 353 HB3 LYS 40 HB3 LYS 40 -5.813 -5.865 -3.033 354 HG2 LYS 40 HG2 LYS 40 -7.875 -5.214 -4.672 355 HG3 LYS 40 HG3 LYS 40 -6.803 -5.925 -5.873 356 HD2 LYS 40 HD2 LYS 40 -8.365 -7.600 -5.029 357 HD3 LYS 40 HD3 LYS 40 -6.733 -8.032 -4.501 358 HE2 LYS 40 HE2 LYS 40 -7.214 -7.137 -2.221 359 HE3 LYS 40 HE3 LYS 40 -8.783 -6.558 -2.751 360 HZ1 LYS 40 HZ1 LYS 40 -7.999 -9.427 -2.710 361 HZ2 LYS 40 HZ2 LYS 40 -8.941 -8.660 -1.596 362 HZ3 LYS 40 HZ3 LYS 40 -9.480 -8.821 -3.115 363 H LYS 41 H LYS 41 -7.470 -2.796 -5.452 364 HA LYS 41 HA LYS 41 -5.796 -2.102 -7.722 365 HB2 LYS 41 HB2 LYS 41 -8.515 -1.042 -6.876 366 HB3 LYS 41 HB3 LYS 41 -7.715 -0.626 -8.388 367 HG2 LYS 41 HG2 LYS 41 -7.704 -2.937 -9.113 368 HG3 LYS 41 HG3 LYS 41 -8.374 -3.465 -7.565 369 HD2 LYS 41 HD2 LYS 41 -10.391 -1.992 -8.019 370 HD3 LYS 41 HD3 LYS 41 -9.762 -1.705 -9.645 371 HE2 LYS 41 HE2 LYS 41 -10.414 -4.436 -8.441 372 HE3 LYS 41 HE3 LYS 41 -11.521 -3.510 -9.454 373 HZ1 LYS 41 HZ1 LYS 41 -8.880 -4.542 -10.335 374 HZ2 LYS 41 HZ2 LYS 41 -10.334 -5.148 -10.756 375 HZ3 LYS 41 HZ3 LYS 41 -9.901 -3.660 -11.267 376 H ILE 42 H ILE 42 -5.765 -0.716 -4.658 377 HA ILE 42 HA ILE 42 -4.411 1.744 -5.698 378 HB ILE 42 HB ILE 42 -5.449 0.950 -2.983 379 HG12 ILE 42 HG12 ILE 42 -6.222 3.539 -4.266 380 HG13 ILE 42 HG13 ILE 42 -6.786 2.109 -5.108 381 HG21 ILE 42 HG21 ILE 42 -3.888 3.481 -3.591 382 HG22 ILE 42 HG22 ILE 42 -4.720 3.069 -2.069 383 HG23 ILE 42 HG23 ILE 42 -3.333 2.127 -2.582 384 HD11 ILE 42 HD11 ILE 42 -7.322 2.724 -2.188 385 HD12 ILE 42 HD12 ILE 42 -8.483 2.762 -3.545 386 HD13 ILE 42 HD13 ILE 42 -7.779 1.228 -3.032 387 H VAL 43 H VAL 43 -3.824 -0.993 -3.382 388 HA VAL 43 HA VAL 43 -1.049 -0.196 -3.173 389 HB VAL 43 HB VAL 43 -2.299 -2.760 -2.130 390 HG11 VAL 43 HG11 VAL 43 0.293 -1.239 -1.523 391 HG12 VAL 43 HG12 VAL 43 -0.335 -2.530 -0.495 392 HG13 VAL 43 HG13 VAL 43 0.149 -2.896 -2.143 393 HG21 VAL 43 HG21 VAL 43 -3.500 -0.867 -1.212 394 HG22 VAL 43 HG22 VAL 43 -2.407 -1.474 0.025 395 HG23 VAL 43 HG23 VAL 43 -1.985 -0.002 -0.871 396 H ALA 44 H ALA 44 -2.508 -3.127 -4.747 397 HA ALA 44 HA ALA 44 0.097 -4.101 -5.583 398 HB1 ALA 44 HB1 ALA 44 -2.672 -4.805 -6.639 399 HB2 ALA 44 HB2 ALA 44 -1.173 -5.720 -6.877 400 HB3 ALA 44 HB3 ALA 44 -1.865 -5.574 -5.250 401 H ASP 45 H ASP 45 -2.408 -2.056 -7.055 402 HA ASP 45 HA ASP 45 -1.169 -1.566 -9.573 403 HB2 ASP 45 HB2 ASP 45 -3.447 -0.865 -8.899 404 HB3 ASP 45 HB3 ASP 45 -2.746 0.346 -7.819 405 H TYR 46 H TYR 46 -0.412 -0.065 -6.369 406 HA TYR 46 HA TYR 46 1.499 1.793 -7.463 407 HB2 TYR 46 HB2 TYR 46 0.227 1.666 -5.122 408 HB3 TYR 46 HB3 TYR 46 1.678 0.831 -4.609 409 HD1 TYR 46 HD1 TYR 46 0.594 3.389 -3.468 410 HD2 TYR 46 HD2 TYR 46 3.438 2.712 -6.613 411 HE1 TYR 46 HE1 TYR 46 1.596 5.640 -3.045 412 HE2 TYR 46 HE2 TYR 46 4.402 4.920 -6.285 413 HH TYR 46 HH TYR 46 3.119 7.216 -3.794 414 H ILE 47 H ILE 47 1.824 -1.470 -6.019 415 HA ILE 47 HA ILE 47 4.676 -1.721 -6.323 416 HB ILE 47 HB ILE 47 2.339 -3.552 -5.922 417 HG12 ILE 47 HG12 ILE 47 3.397 -4.188 -3.922 418 HG13 ILE 47 HG13 ILE 47 4.988 -3.670 -4.463 419 HG21 ILE 47 HG21 ILE 47 5.075 -4.612 -6.688 420 HG22 ILE 47 HG22 ILE 47 3.768 -5.567 -5.959 421 HG23 ILE 47 HG23 ILE 47 3.545 -4.869 -7.568 422 HD11 ILE 47 HD11 ILE 47 2.729 -1.762 -3.741 423 HD12 ILE 47 HD12 ILE 47 4.119 -2.202 -2.719 424 HD13 ILE 47 HD13 ILE 47 4.385 -1.331 -4.232 425 H SER 48 H SER 48 2.062 -2.103 -8.659 426 HA SER 48 HA SER 48 3.757 -2.994 -10.824 427 HB2 SER 48 HB2 SER 48 1.166 -3.110 -10.528 428 HB3 SER 48 HB3 SER 48 1.179 -1.466 -11.198 429 HG SER 48 HG SER 48 0.942 -3.109 -12.809 430 H GLU 49 H GLU 49 3.456 0.192 -9.364 431 HA GLU 49 HA GLU 49 4.092 1.561 -11.918 432 HB2 GLU 49 HB2 GLU 49 2.113 2.196 -10.496 433 HB3 GLU 49 HB3 GLU 49 3.237 2.671 -9.225 434 HG2 GLU 49 HG2 GLU 49 2.562 4.635 -10.367 435 HG3 GLU 49 HG3 GLU 49 4.238 4.350 -10.814 436 H VAL 50 H VAL 50 5.359 1.257 -8.556 437 HA VAL 50 HA VAL 50 7.917 2.501 -9.497 438 HB VAL 50 HB VAL 50 8.064 3.850 -7.561 439 HG11 VAL 50 HG11 VAL 50 5.190 4.124 -8.438 440 HG12 VAL 50 HG12 VAL 50 6.259 5.362 -7.751 441 HG13 VAL 50 HG13 VAL 50 6.594 4.709 -9.360 442 HG21 VAL 50 HG21 VAL 50 7.256 2.353 -5.836 443 HG22 VAL 50 HG22 VAL 50 6.374 3.877 -5.791 444 HG23 VAL 50 HG23 VAL 50 5.618 2.425 -6.497 445 H GLY 51 H GLY 51 6.587 -0.183 -7.799 446 HA2 GLY 51 HA2 GLY 51 8.225 -2.067 -8.094 447 HA3 GLY 51 HA3 GLY 51 9.365 -1.116 -7.137 448 H LEU 52 H LEU 52 8.777 -0.572 -5.015 449 HA LEU 52 HA LEU 52 6.775 -1.898 -3.441 450 HB2 LEU 52 HB2 LEU 52 8.175 -3.905 -3.942 451 HB3 LEU 52 HB3 LEU 52 9.613 -3.059 -3.389 452 HG LEU 52 HG LEU 52 8.714 -3.033 -1.068 453 HD11 LEU 52 HD11 LEU 52 6.430 -4.640 -2.283 454 HD12 LEU 52 HD12 LEU 52 6.731 -4.425 -0.538 455 HD13 LEU 52 HD13 LEU 52 6.296 -3.035 -1.536 456 HD21 LEU 52 HD21 LEU 52 10.130 -4.905 -1.846 457 HD22 LEU 52 HD22 LEU 52 8.950 -5.417 -0.626 458 HD23 LEU 52 HD23 LEU 52 8.672 -5.793 -2.339 459 H ASN 53 H ASN 53 9.943 -0.467 -3.586 460 HA ASN 53 HA ASN 53 9.751 0.598 -0.823 461 HB2 ASN 53 HB2 ASN 53 12.127 0.435 -0.745 462 HB3 ASN 53 HB3 ASN 53 11.503 -1.073 -1.410 463 HD21 ASN 53 HD21 ASN 53 13.286 -0.727 -4.441 464 HD22 ASN 53 HD22 ASN 53 12.205 -1.718 -3.479 465 H ASN 54 H ASN 54 9.546 1.806 -3.966 466 HA ASN 54 HA ASN 54 10.633 4.484 -3.277 467 HB2 ASN 54 HB2 ASN 54 9.473 3.425 -5.874 468 HB3 ASN 54 HB3 ASN 54 10.283 4.973 -5.657 469 HD21 ASN 54 HD21 ASN 54 12.478 1.689 -6.371 470 HD22 ASN 54 HD22 ASN 54 10.733 1.769 -6.610 471 H LEU 55 H LEU 55 7.605 2.866 -3.221 472 HA LEU 55 HA LEU 55 5.863 5.128 -3.628 473 HB2 LEU 55 HB2 LEU 55 4.118 3.596 -2.885 474 HB3 LEU 55 HB3 LEU 55 5.171 2.864 -4.065 475 HG LEU 55 HG LEU 55 6.395 1.909 -1.848 476 HD11 LEU 55 HD11 LEU 55 3.478 2.291 -1.048 477 HD12 LEU 55 HD12 LEU 55 4.626 1.203 -0.262 478 HD13 LEU 55 HD13 LEU 55 4.897 2.949 -0.197 479 HD21 LEU 55 HD21 LEU 55 5.483 0.597 -3.713 480 HD22 LEU 55 HD22 LEU 55 5.035 -0.108 -2.154 481 HD23 LEU 55 HD23 LEU 55 3.836 0.822 -3.083 482 H ASN 56 H ASN 56 4.287 5.843 -2.010 483 HA ASN 56 HA ASN 56 5.617 6.468 0.591 484 HB2 ASN 56 HB2 ASN 56 5.298 8.339 -0.985 485 HB3 ASN 56 HB3 ASN 56 3.560 8.021 -1.013 486 HD21 ASN 56 HD21 ASN 56 3.887 10.744 1.353 487 HD22 ASN 56 HD22 ASN 56 3.851 10.436 -0.380 488 H ALA 57 H ALA 57 4.826 5.457 2.287 489 HA ALA 57 HA ALA 57 2.390 3.985 2.432 490 HB1 ALA 57 HB1 ALA 57 4.225 5.123 4.580 491 HB2 ALA 57 HB2 ALA 57 3.024 3.840 4.839 492 HB3 ALA 57 HB3 ALA 57 4.408 3.550 3.770 493 H THR 58 H THR 58 3.028 7.415 3.027 494 HA THR 58 HA THR 58 0.588 7.968 4.481 495 HB THR 58 HB THR 58 2.335 9.810 2.821 496 HG1 THR 58 HG1 THR 58 3.210 10.314 4.823 497 HG21 THR 58 HG21 THR 58 0.166 10.412 4.870 498 HG22 THR 58 HG22 THR 58 1.351 11.600 4.274 499 HG23 THR 58 HG23 THR 58 0.198 10.877 3.151 500 H GLU 59 H GLU 59 1.386 8.056 0.957 501 HA GLU 59 HA GLU 59 -1.228 8.877 0.086 502 HB2 GLU 59 HB2 GLU 59 0.861 7.166 -1.315 503 HB3 GLU 59 HB3 GLU 59 -0.588 7.802 -2.082 504 HG2 GLU 59 HG2 GLU 59 1.604 9.517 -0.841 505 HG3 GLU 59 HG3 GLU 59 1.477 9.121 -2.547 506 H LEU 60 H LEU 60 0.110 5.565 0.638 507 HA LEU 60 HA LEU 60 -2.318 4.143 0.176 508 HB2 LEU 60 HB2 LEU 60 0.042 3.621 2.014 509 HB3 LEU 60 HB3 LEU 60 -1.402 2.625 2.090 510 HG LEU 60 HG LEU 60 -1.160 2.109 -0.351 511 HD11 LEU 60 HD11 LEU 60 1.587 3.367 0.030 512 HD12 LEU 60 HD12 LEU 60 1.082 2.377 -1.355 513 HD13 LEU 60 HD13 LEU 60 0.315 3.944 -1.071 514 HD21 LEU 60 HD21 LEU 60 -0.456 0.538 1.390 515 HD22 LEU 60 HD22 LEU 60 0.700 0.490 0.050 516 HD23 LEU 60 HD23 LEU 60 1.111 1.362 1.541 517 H SER 61 H SER 61 -1.260 5.708 3.277 518 HA SER 61 HA SER 61 -3.543 4.966 4.756 519 HB2 SER 61 HB2 SER 61 -2.842 6.462 6.392 520 HB3 SER 61 HB3 SER 61 -1.352 5.996 5.573 521 HG SER 61 HG SER 61 -1.728 8.025 4.300 522 H LYS 62 H LYS 62 -3.319 7.279 2.268 523 HA LYS 62 HA LYS 62 -5.733 8.850 3.074 524 HB2 LYS 62 HB2 LYS 62 -3.612 9.228 0.925 525 HB3 LYS 62 HB3 LYS 62 -5.038 10.258 1.073 526 HG2 LYS 62 HG2 LYS 62 -4.362 11.123 3.186 527 HG3 LYS 62 HG3 LYS 62 -3.174 9.856 3.436 528 HD2 LYS 62 HD2 LYS 62 -2.009 11.897 2.880 529 HD3 LYS 62 HD3 LYS 62 -1.777 10.709 1.606 530 HE2 LYS 62 HE2 LYS 62 -2.113 12.809 0.541 531 HE3 LYS 62 HE3 LYS 62 -3.568 11.856 0.254 532 HZ1 LYS 62 HZ1 LYS 62 -3.289 13.976 2.327 533 HZ2 LYS 62 HZ2 LYS 62 -4.091 14.142 0.919 534 HZ3 LYS 62 HZ3 LYS 62 -4.653 13.116 2.056 535 H ARG 63 H ARG 63 -4.578 6.864 0.356 536 HA ARG 63 HA ARG 63 -7.168 6.856 -1.037 537 HB2 ARG 63 HB2 ARG 63 -4.584 5.273 -1.363 538 HB3 ARG 63 HB3 ARG 63 -5.970 5.109 -2.439 539 HG2 ARG 63 HG2 ARG 63 -4.450 7.722 -2.027 540 HG3 ARG 63 HG3 ARG 63 -4.113 6.546 -3.297 541 HD2 ARG 63 HD2 ARG 63 -6.520 6.790 -4.076 542 HD3 ARG 63 HD3 ARG 63 -6.703 8.096 -2.907 543 HE ARG 63 HE ARG 63 -5.447 9.515 -4.246 544 HH11 ARG 63 HH11 ARG 63 -4.474 10.192 -6.121 545 HH12 ARG 63 HH12 ARG 63 -4.006 9.033 -7.329 546 HH21 ARG 63 HH21 ARG 63 -5.115 6.293 -5.601 547 HH22 ARG 63 HH22 ARG 63 -4.349 6.887 -7.048 548 H LEU 64 H LEU 64 -5.469 4.624 1.126 549 HA LEU 64 HA LEU 64 -7.533 2.541 0.792 550 HB2 LEU 64 HB2 LEU 64 -4.821 2.427 0.827 551 HB3 LEU 64 HB3 LEU 64 -5.124 2.235 2.541 552 HG LEU 64 HG LEU 64 -6.742 0.298 1.825 553 HD11 LEU 64 HD11 LEU 64 -5.053 0.756 -0.679 554 HD12 LEU 64 HD12 LEU 64 -5.973 -0.709 -0.344 555 HD13 LEU 64 HD13 LEU 64 -6.823 0.835 -0.568 556 HD21 LEU 64 HD21 LEU 64 -4.686 -0.175 2.946 557 HD22 LEU 64 HD22 LEU 64 -4.794 -1.268 1.572 558 HD23 LEU 64 HD23 LEU 64 -3.722 0.153 1.486 559 H ASN 65 H ASN 65 -6.825 5.042 3.038 560 HA ASN 65 HA ASN 65 -7.719 5.664 5.013 561 HB2 ASN 65 HB2 ASN 65 -9.773 5.314 3.562 562 HB3 ASN 65 HB3 ASN 65 -10.045 3.809 4.437 563 HD21 ASN 65 HD21 ASN 65 -10.974 5.532 7.488 564 HD22 ASN 65 HD22 ASN 65 -10.105 4.098 6.926 565 H ILE 66 H ILE 66 -5.743 4.278 5.530 566 HA ILE 66 HA ILE 66 -6.366 2.564 7.892 567 HB ILE 66 HB ILE 66 -4.045 1.524 7.466 568 HG12 ILE 66 HG12 ILE 66 -4.573 2.476 4.631 569 HG13 ILE 66 HG13 ILE 66 -3.324 3.087 5.722 570 HG21 ILE 66 HG21 ILE 66 -6.308 0.713 5.629 571 HG22 ILE 66 HG22 ILE 66 -4.965 -0.303 6.215 572 HG23 ILE 66 HG23 ILE 66 -6.144 0.316 7.366 573 HD11 ILE 66 HD11 ILE 66 -3.442 0.253 4.640 574 HD12 ILE 66 HD12 ILE 66 -2.392 1.573 4.091 575 HD13 ILE 66 HD13 ILE 66 -2.229 0.910 5.742 576 H THR 67 H THR 67 -4.719 2.621 9.540 577 HA THR 67 HA THR 67 -3.488 5.111 10.227 578 HB THR 67 HB THR 67 -2.996 2.212 11.018 579 HG1 THR 67 HG1 THR 67 -4.199 2.847 12.830 580 HG21 THR 67 HG21 THR 67 -1.938 4.749 12.303 581 HG22 THR 67 HG22 THR 67 -1.984 3.150 13.095 582 HG23 THR 67 HG23 THR 67 -1.013 3.370 11.645 583 H VAL 68 H VAL 68 -1.432 5.923 9.742 584 HA VAL 68 HA VAL 68 -0.080 5.061 7.397 585 HB VAL 68 HB VAL 68 1.236 6.649 9.625 586 HG11 VAL 68 HG11 VAL 68 1.550 6.689 6.587 587 HG12 VAL 68 HG12 VAL 68 2.372 7.785 7.718 588 HG13 VAL 68 HG13 VAL 68 2.725 6.060 7.763 589 HG21 VAL 68 HG21 VAL 68 -0.940 7.740 9.215 590 HG22 VAL 68 HG22 VAL 68 0.371 8.706 8.546 591 HG23 VAL 68 HG23 VAL 68 -0.627 7.718 7.466 592 H ASP 69 H ASP 69 0.479 4.198 10.772 593 HA ASP 69 HA ASP 69 2.925 2.731 10.248 594 HB2 ASP 69 HB2 ASP 69 2.355 3.732 12.458 595 HB3 ASP 69 HB3 ASP 69 1.027 2.583 12.623 596 H LYS 70 H LYS 70 -0.497 1.839 10.183 597 HA LYS 70 HA LYS 70 0.001 -1.014 9.806 598 HB2 LYS 70 HB2 LYS 70 -2.396 0.757 9.184 599 HB3 LYS 70 HB3 LYS 70 -2.280 -0.908 8.625 600 HG2 LYS 70 HG2 LYS 70 -1.968 -1.687 10.965 601 HG3 LYS 70 HG3 LYS 70 -2.210 -0.024 11.537 602 HD2 LYS 70 HD2 LYS 70 -4.475 0.005 10.547 603 HD3 LYS 70 HD3 LYS 70 -4.214 -1.610 9.855 604 HE2 LYS 70 HE2 LYS 70 -3.918 -2.536 12.150 605 HE3 LYS 70 HE3 LYS 70 -4.243 -0.935 12.831 606 HZ1 LYS 70 HZ1 LYS 70 -6.154 -2.514 11.183 607 HZ2 LYS 70 HZ2 LYS 70 -6.245 -2.308 12.801 608 HZ3 LYS 70 HZ3 LYS 70 -6.461 -1.032 11.808 609 H ALA 71 H ALA 71 -0.134 1.820 7.667 610 HA ALA 71 HA ALA 71 0.038 0.291 5.218 611 HB1 ALA 71 HB1 ALA 71 0.995 3.148 5.720 612 HB2 ALA 71 HB2 ALA 71 0.613 2.405 4.161 613 HB3 ALA 71 HB3 ALA 71 -0.670 2.710 5.347 614 H LYS 72 H LYS 72 2.571 1.870 7.183 615 HA LYS 72 HA LYS 72 4.793 0.992 5.599 616 HB2 LYS 72 HB2 LYS 72 4.420 2.129 8.343 617 HB3 LYS 72 HB3 LYS 72 5.913 1.246 8.079 618 HG2 LYS 72 HG2 LYS 72 6.844 2.997 7.087 619 HG3 LYS 72 HG3 LYS 72 5.667 2.920 5.797 620 HD2 LYS 72 HD2 LYS 72 5.598 5.142 6.668 621 HD3 LYS 72 HD3 LYS 72 4.113 4.322 7.134 622 HE2 LYS 72 HE2 LYS 72 4.823 5.596 9.023 623 HE3 LYS 72 HE3 LYS 72 5.115 3.902 9.418 624 HZ1 LYS 72 HZ1 LYS 72 7.186 5.819 8.464 625 HZ2 LYS 72 HZ2 LYS 72 7.008 5.325 10.006 626 HZ3 LYS 72 HZ3 LYS 72 7.473 4.260 8.864 627 H THR 73 H THR 73 3.164 -0.796 8.221 628 HA THR 73 HA THR 73 5.178 -2.953 7.928 629 HB THR 73 HB THR 73 4.271 -2.343 10.134 630 HG1 THR 73 HG1 THR 73 4.278 -4.454 10.792 631 HG21 THR 73 HG21 THR 73 1.800 -3.935 9.332 632 HG22 THR 73 HG22 THR 73 2.180 -3.246 10.923 633 HG23 THR 73 HG23 THR 73 1.845 -2.179 9.556 634 H TYR 74 H TYR 74 1.745 -2.495 7.003 635 HA TYR 74 HA TYR 74 1.212 -5.071 6.037 636 HB2 TYR 74 HB2 TYR 74 -0.535 -3.466 6.386 637 HB3 TYR 74 HB3 TYR 74 0.197 -2.332 5.240 638 HD1 TYR 74 HD1 TYR 74 -0.494 -2.242 3.039 639 HD2 TYR 74 HD2 TYR 74 -1.312 -5.779 5.383 640 HE1 TYR 74 HE1 TYR 74 -1.536 -3.305 1.080 641 HE2 TYR 74 HE2 TYR 74 -2.350 -6.847 3.390 642 HH TYR 74 HH TYR 74 -2.273 -5.267 0.173 643 H ILE 75 H ILE 75 2.777 -2.366 4.304 644 HA ILE 75 HA ILE 75 3.085 -3.416 1.722 645 HB ILE 75 HB ILE 75 4.868 -1.724 3.500 646 HG12 ILE 75 HG12 ILE 75 3.435 -0.940 0.927 647 HG13 ILE 75 HG13 ILE 75 2.594 -0.939 2.462 648 HG21 ILE 75 HG21 ILE 75 5.393 -2.409 0.575 649 HG22 ILE 75 HG22 ILE 75 6.224 -1.130 1.476 650 HG23 ILE 75 HG23 ILE 75 6.445 -2.799 1.957 651 HD11 ILE 75 HD11 ILE 75 5.090 0.727 1.858 652 HD12 ILE 75 HD12 ILE 75 3.427 1.321 1.960 653 HD13 ILE 75 HD13 ILE 75 4.234 0.686 3.401 654 H LYS 76 H LYS 76 4.929 -4.307 4.642 655 HA LYS 76 HA LYS 76 6.575 -6.273 3.127 656 HB2 LYS 76 HB2 LYS 76 6.592 -5.250 6.005 657 HB3 LYS 76 HB3 LYS 76 7.609 -6.593 5.465 658 HG2 LYS 76 HG2 LYS 76 8.669 -5.254 3.789 659 HG3 LYS 76 HG3 LYS 76 7.621 -3.868 4.124 660 HD2 LYS 76 HD2 LYS 76 9.604 -5.053 6.115 661 HD3 LYS 76 HD3 LYS 76 9.915 -3.647 5.085 662 HE2 LYS 76 HE2 LYS 76 7.956 -2.474 6.112 663 HE3 LYS 76 HE3 LYS 76 7.718 -3.851 7.195 664 HZ1 LYS 76 HZ1 LYS 76 10.164 -2.165 7.100 665 HZ2 LYS 76 HZ2 LYS 76 9.022 -2.103 8.262 666 HZ3 LYS 76 HZ3 LYS 76 9.947 -3.439 8.100 667 H ASN 77 H ASN 77 3.911 -6.267 5.468 668 HA ASN 77 HA ASN 77 4.229 -9.007 6.081 669 HB2 ASN 77 HB2 ASN 77 1.562 -7.530 6.109 670 HB3 ASN 77 HB3 ASN 77 1.968 -8.980 7.018 671 HD21 ASN 77 HD21 ASN 77 4.149 -6.806 9.202 672 HD22 ASN 77 HD22 ASN 77 4.496 -8.198 8.183 673 H SER 78 H SER 78 2.427 -7.473 3.454 674 HA SER 78 HA SER 78 1.375 -9.993 2.397 675 HB2 SER 78 HB2 SER 78 1.382 -7.120 1.424 676 HB3 SER 78 HB3 SER 78 0.798 -8.461 0.413 677 HG SER 78 HG SER 78 -0.874 -7.519 1.676 678 H ASN 79 H ASN 79 4.124 -7.892 1.565 679 HA ASN 79 HA ASN 79 5.303 -10.002 -0.116 680 HB2 ASN 79 HB2 ASN 79 5.380 -8.357 -2.105 681 HB3 ASN 79 HB3 ASN 79 3.902 -9.252 -1.786 682 HD21 ASN 79 HD21 ASN 79 3.858 -5.215 -1.045 683 HD22 ASN 79 HD22 ASN 79 5.369 -6.097 -0.894 684 H ARG 80 H ARG 80 6.822 -9.774 1.635 685 HA ARG 80 HA ARG 80 8.861 -7.625 1.264 686 HB2 ARG 80 HB2 ARG 80 9.880 -8.390 3.264 687 HB3 ARG 80 HB3 ARG 80 8.188 -8.040 3.527 688 HG2 ARG 80 HG2 ARG 80 7.628 -10.445 3.527 689 HG3 ARG 80 HG3 ARG 80 9.303 -10.858 3.094 690 HD2 ARG 80 HD2 ARG 80 10.099 -9.735 5.140 691 HD3 ARG 80 HD3 ARG 80 8.436 -9.395 5.613 692 HE ARG 80 HE ARG 80 9.867 -11.974 5.732 693 HH11 ARG 80 HH11 ARG 80 8.941 -13.704 6.757 694 HH12 ARG 80 HH12 ARG 80 7.252 -13.676 7.166 695 HH21 ARG 80 HH21 ARG 80 6.664 -10.568 5.829 696 HH22 ARG 80 HH22 ARG 80 5.990 -11.942 6.670 697 H MET 81 H MET 81 8.337 -10.132 -0.568 698 HA MET 81 HA MET 81 10.236 -12.066 0.083 699 HB2 MET 81 HB2 MET 81 8.870 -11.575 -2.588 700 HB3 MET 81 HB3 MET 81 9.795 -13.025 -2.167 701 HG2 MET 81 HG2 MET 81 8.277 -13.337 -0.165 702 HG3 MET 81 HG3 MET 81 7.292 -12.010 -0.773 703 HE1 MET 81 HE1 MET 81 8.309 -15.738 -1.063 704 HE2 MET 81 HE2 MET 81 7.634 -16.242 -2.625 705 HE3 MET 81 HE3 MET 81 9.040 -15.162 -2.579 706 H GLY 82 H GLY 82 10.871 -9.248 -2.032 707 HA2 GLY 82 HA2 GLY 82 13.491 -9.186 -1.139 708 HA3 GLY 82 HA3 GLY 82 13.598 -10.080 -2.667 709 H ARG 83 H ARG 83 12.471 -9.114 -4.497 710 HA ARG 83 HA ARG 83 12.351 -6.120 -4.520 711 HB2 ARG 83 HB2 ARG 83 13.404 -7.977 -6.619 712 HB3 ARG 83 HB3 ARG 83 12.788 -6.352 -7.015 713 HG2 ARG 83 HG2 ARG 83 14.378 -5.304 -5.490 714 HG3 ARG 83 HG3 ARG 83 14.893 -6.879 -4.870 715 HD2 ARG 83 HD2 ARG 83 16.570 -6.166 -6.368 716 HD3 ARG 83 HD3 ARG 83 15.697 -7.500 -7.116 717 HE ARG 83 HE ARG 83 14.820 -6.059 -8.756 718 HH11 ARG 83 HH11 ARG 83 14.913 -4.268 -10.056 719 HH12 ARG 83 HH12 ARG 83 15.714 -2.829 -9.501 720 HH21 ARG 83 HH21 ARG 83 16.624 -4.116 -6.459 721 HH22 ARG 83 HH22 ARG 83 16.664 -2.739 -7.524 722 H THR 84 H THR 84 11.191 -8.162 -7.074 723 HA THR 84 HA THR 84 8.349 -7.754 -6.213 724 HB THR 84 HB THR 84 7.788 -6.917 -8.471 725 HG1 THR 84 HG1 THR 84 9.487 -6.206 -9.780 726 HG21 THR 84 HG21 THR 84 9.963 -5.243 -7.159 727 HG22 THR 84 HG22 THR 84 8.552 -4.675 -8.087 728 HG23 THR 84 HG23 THR 84 8.335 -5.431 -6.489 729 H ASN 85 H ASN 85 9.717 -10.157 -6.049 730 HA ASN 85 HA ASN 85 9.587 -12.348 -6.498 731 HB2 ASN 85 HB2 ASN 85 7.071 -11.602 -6.292 732 HB3 ASN 85 HB3 ASN 85 6.992 -12.039 -7.994 733 HD21 ASN 85 HD21 ASN 85 7.596 -15.582 -7.192 734 HD22 ASN 85 HD22 ASN 85 8.215 -14.368 -8.320 735 H ASN 86 H ASN 86 10.750 -10.467 -8.550 736 HA ASN 86 HA ASN 86 10.600 -11.812 -11.118 737 HB2 ASN 86 HB2 ASN 86 12.176 -10.018 -11.738 738 HB3 ASN 86 HB3 ASN 86 10.832 -9.361 -10.803 739 HD21 ASN 86 HD21 ASN 86 14.605 -9.250 -9.262 740 HD22 ASN 86 HD22 ASN 86 14.272 -10.004 -10.819 741 H PHE 87 H PHE 87 12.436 -12.462 -8.314 742 HA PHE 87 HA PHE 87 14.978 -13.133 -9.450 743 HB2 PHE 87 HB2 PHE 87 15.541 -13.779 -7.193 744 HB3 PHE 87 HB3 PHE 87 14.614 -12.294 -7.159 745 HD1 PHE 87 HD1 PHE 87 12.291 -12.262 -6.257 746 HD2 PHE 87 HD2 PHE 87 14.625 -15.886 -6.310 747 HE1 PHE 87 HE1 PHE 87 10.673 -13.333 -4.695 748 HE2 PHE 87 HE2 PHE 87 12.990 -16.960 -4.782 749 HZ PHE 87 HZ PHE 87 11.015 -15.684 -3.969 750 H LYS 88 H LYS 88 12.569 -14.738 -10.490 751 HA LYS 88 HA LYS 88 12.900 -17.462 -9.417 752 HB2 LYS 88 HB2 LYS 88 10.948 -17.972 -10.740 753 HB3 LYS 88 HB3 LYS 88 10.677 -16.427 -9.919 754 HG2 LYS 88 HG2 LYS 88 11.504 -15.313 -12.114 755 HG3 LYS 88 HG3 LYS 88 11.395 -16.931 -12.823 756 HD2 LYS 88 HD2 LYS 88 9.404 -15.903 -13.454 757 HD3 LYS 88 HD3 LYS 88 8.932 -16.942 -12.096 758 HE2 LYS 88 HE2 LYS 88 9.075 -14.983 -10.571 759 HE3 LYS 88 HE3 LYS 88 9.614 -13.960 -11.901 760 HZ1 LYS 88 HZ1 LYS 88 6.959 -15.300 -11.744 761 HZ2 LYS 88 HZ2 LYS 88 7.233 -13.706 -11.514 762 HZ3 LYS 88 HZ3 LYS 88 7.458 -14.367 -12.989 763 H THR 89 H THR 89 14.107 -15.639 -11.997 764 HA THR 89 HA THR 89 15.129 -18.005 -13.519 765 HB THR 89 HB THR 89 14.381 -15.211 -14.475 766 HG1 THR 89 HG1 THR 89 12.690 -16.308 -15.487 767 HG21 THR 89 HG21 THR 89 15.250 -17.705 -15.968 768 HG22 THR 89 HG22 THR 89 14.580 -16.229 -16.725 769 HG23 THR 89 HG23 THR 89 16.129 -16.157 -15.867 770 H ILE 90 H ILE 90 15.905 -14.707 -12.389 771 HA ILE 90 HA ILE 90 18.776 -14.860 -12.935 772 HB ILE 90 HB ILE 90 17.301 -13.112 -10.937 773 HG12 ILE 90 HG12 ILE 90 17.899 -12.600 -13.886 774 HG13 ILE 90 HG13 ILE 90 16.301 -12.843 -13.189 775 HG21 ILE 90 HG21 ILE 90 20.001 -12.767 -12.331 776 HG22 ILE 90 HG22 ILE 90 19.238 -11.564 -11.273 777 HG23 ILE 90 HG23 ILE 90 19.741 -13.079 -10.594 778 HD11 ILE 90 HD11 ILE 90 18.072 -10.424 -12.782 779 HD12 ILE 90 HD12 ILE 90 16.495 -10.528 -13.568 780 HD13 ILE 90 HD13 ILE 90 16.612 -10.761 -11.813 781 H LYS 91 H LYS 91 20.364 -15.070 -11.221 782 HA LYS 91 HA LYS 91 21.393 -15.966 -9.435 783 HB2 LYS 91 HB2 LYS 91 19.539 -14.358 -8.581 784 HB3 LYS 91 HB3 LYS 91 18.759 -15.790 -7.945 785 HG2 LYS 91 HG2 LYS 91 20.467 -16.210 -6.406 786 HG3 LYS 91 HG3 LYS 91 21.665 -15.246 -7.294 787 HD2 LYS 91 HD2 LYS 91 19.203 -14.094 -5.912 788 HD3 LYS 91 HD3 LYS 91 20.791 -14.171 -5.155 789 HE2 LYS 91 HE2 LYS 91 20.284 -12.727 -7.807 790 HE3 LYS 91 HE3 LYS 91 20.114 -11.943 -6.235 791 HZ1 LYS 91 HZ1 LYS 91 22.628 -13.173 -7.235 792 HZ2 LYS 91 HZ2 LYS 91 22.321 -11.573 -7.148 793 HZ3 LYS 91 HZ3 LYS 91 22.448 -12.450 -5.780 794 H MET 92 H MET 92 18.880 -17.907 -10.679 795 HA MET 92 HA MET 92 19.458 -20.213 -8.961 796 HB2 MET 92 HB2 MET 92 17.871 -21.415 -10.232 797 HB3 MET 92 HB3 MET 92 17.214 -19.800 -9.965 798 HG2 MET 92 HG2 MET 92 17.868 -19.160 -12.262 799 HG3 MET 92 HG3 MET 92 18.567 -20.760 -12.524 800 HE1 MET 92 HE1 MET 92 17.299 -21.179 -14.733 801 HE2 MET 92 HE2 MET 92 15.557 -20.887 -14.939 802 HE3 MET 92 HE3 MET 92 16.652 -19.529 -14.595 803 H PHE 93 H PHE 93 20.719 -19.007 -11.996 804 HA PHE 93 HA PHE 93 22.350 -21.481 -12.344 805 HB2 PHE 93 HB2 PHE 93 22.138 -21.289 -14.666 806 HB3 PHE 93 HB3 PHE 93 20.524 -21.047 -14.033 807 HD1 PHE 93 HD1 PHE 93 19.440 -18.796 -14.158 808 HD2 PHE 93 HD2 PHE 93 23.364 -19.509 -15.801 809 HE1 PHE 93 HE1 PHE 93 19.292 -16.677 -15.443 810 HE2 PHE 93 HE2 PHE 93 23.208 -17.393 -17.085 811 HZ PHE 93 HZ PHE 93 21.173 -15.971 -16.908 812 H GLU 94 H GLU 94 22.652 -18.201 -11.583 813 HA GLU 94 HA GLU 94 25.191 -17.714 -12.983 814 HB2 GLU 94 HB2 GLU 94 23.534 -16.072 -11.038 815 HB3 GLU 94 HB3 GLU 94 25.051 -15.512 -11.734 816 HG2 GLU 94 HG2 GLU 94 22.715 -16.354 -13.500 817 HG3 GLU 94 HG3 GLU 94 22.829 -14.751 -12.796 818 H ASP 95 H ASP 95 27.194 -17.878 -12.166 819 HA ASP 95 HA ASP 95 27.722 -17.912 -9.274 820 HB2 ASP 95 HB2 ASP 95 27.211 -20.274 -9.751 821 HB3 ASP 95 HB3 ASP 95 28.377 -20.286 -11.072 822 H ASP 96 H ASP 96 29.216 -16.391 -9.149 823 HA ASP 96 HA ASP 96 30.824 -14.890 -9.598 824 HB2 ASP 96 HB2 ASP 96 32.283 -17.217 -10.886 825 HB3 ASP 96 HB3 ASP 96 32.998 -15.664 -10.489 826 H VAL 97 H VAL 97 32.334 -13.882 -11.393 827 HA VAL 97 HA VAL 97 30.598 -13.336 -13.762 828 HB VAL 97 HB VAL 97 32.859 -11.755 -12.482 829 HG11 VAL 97 HG11 VAL 97 31.047 -11.001 -14.814 830 HG12 VAL 97 HG12 VAL 97 32.113 -9.874 -13.941 831 HG13 VAL 97 HG13 VAL 97 32.816 -11.202 -14.854 832 HG21 VAL 97 HG21 VAL 97 30.809 -11.729 -11.113 833 HG22 VAL 97 HG22 VAL 97 31.065 -10.156 -11.863 834 HG23 VAL 97 HG23 VAL 97 29.848 -11.265 -12.534 835 H SER 98 H SER 98 33.479 -14.943 -12.865 836 HA SER 98 HA SER 98 35.297 -15.707 -13.866 837 HB2 SER 98 HB2 SER 98 33.664 -15.790 -16.416 838 HB3 SER 98 HB3 SER 98 35.205 -16.621 -16.134 839 HG SER 98 HG SER 98 33.390 -17.984 -15.751 840 H SER 99 H SER 99 34.864 -12.814 -13.743 841 HA SER 99 HA SER 99 37.338 -12.064 -15.018 842 HB2 SER 99 HB2 SER 99 35.668 -11.611 -16.846 843 HB3 SER 99 HB3 SER 99 34.849 -10.471 -15.762 844 HG SER 99 HG SER 99 36.396 -9.464 -17.173 845 H ALA 100 H ALA 100 38.297 -10.293 -13.998 846 HA ALA 100 HA ALA 100 36.947 -8.801 -11.871 847 HB1 ALA 100 HB1 ALA 100 39.127 -10.846 -11.227 848 HB2 ALA 100 HB2 ALA 100 38.398 -9.704 -10.077 849 HB3 ALA 100 HB3 ALA 100 37.410 -10.993 -10.791 850 H SER 101 H SER 101 38.552 -7.337 -10.724 851 HA SER 101 HA SER 101 40.700 -6.373 -12.581 852 HB2 SER 101 HB2 SER 101 38.714 -4.856 -12.151 853 HB3 SER 101 HB3 SER 101 39.258 -4.761 -10.462 854 HG SER 101 HG SER 101 40.074 -3.061 -11.848 855 H ALA 102 H ALA 102 42.343 -5.002 -11.163 856 HA ALA 102 HA ALA 102 43.723 -6.801 -9.393 857 HB1 ALA 102 HB1 ALA 102 44.071 -3.804 -9.834 858 HB2 ALA 102 HB2 ALA 102 45.245 -4.883 -9.049 859 HB3 ALA 102 HB3 ALA 102 44.871 -5.090 -10.770 860 H GLN 103 H GLN 103 41.427 -4.336 -8.867 861 HA GLN 103 HA GLN 103 40.928 -5.234 -6.130 862 HB2 GLN 103 HB2 GLN 103 41.626 -2.328 -6.769 863 HB3 GLN 103 HB3 GLN 103 40.872 -2.862 -5.257 864 HG2 GLN 103 HG2 GLN 103 42.874 -4.312 -4.825 865 HG3 GLN 103 HG3 GLN 103 43.647 -3.585 -6.243 866 HE21 GLN 103 HE21 GLN 103 44.413 -0.518 -4.582 867 HE22 GLN 103 HE22 GLN 103 44.321 -1.326 -6.138 868 HA PRO 104 HA PRO 104 36.817 -4.525 -7.531 869 HB2 PRO 104 HB2 PRO 104 35.338 -4.573 -5.247 870 HB3 PRO 104 HB3 PRO 104 36.243 -5.990 -5.851 871 HG2 PRO 104 HG2 PRO 104 37.130 -4.000 -3.734 872 HG3 PRO 104 HG3 PRO 104 37.139 -5.790 -3.644 873 HD2 PRO 104 HD2 PRO 104 39.358 -4.365 -4.334 874 HD3 PRO 104 HD3 PRO 104 38.993 -5.949 -5.078 875 H ASN 105 H ASN 105 37.054 -2.514 -8.490 876 HA ASN 105 HA ASN 105 36.630 -0.351 -8.973 877 HB2 ASN 105 HB2 ASN 105 34.356 -0.767 -7.000 878 HB3 ASN 105 HB3 ASN 105 34.480 0.582 -8.122 879 HD21 ASN 105 HD21 ASN 105 32.244 -1.854 -9.716 880 HD22 ASN 105 HD22 ASN 105 32.228 -0.884 -8.249 881 H LEU 106 H LEU 106 38.713 -0.642 -7.212 882 HA LEU 106 HA LEU 106 38.552 1.738 -5.408 883 HB2 LEU 106 HB2 LEU 106 38.428 -0.629 -4.440 884 HB3 LEU 106 HB3 LEU 106 40.127 -0.780 -4.851 885 HG LEU 106 HG LEU 106 38.894 1.321 -3.012 886 HD11 LEU 106 HD11 LEU 106 40.542 -1.168 -2.400 887 HD12 LEU 106 HD12 LEU 106 39.937 0.010 -1.209 888 HD13 LEU 106 HD13 LEU 106 38.794 -0.984 -2.131 889 HD21 LEU 106 HD21 LEU 106 40.959 2.221 -3.947 890 HD22 LEU 106 HD22 LEU 106 41.254 1.725 -2.282 891 HD23 LEU 106 HD23 LEU 106 41.815 0.696 -3.620 892 HA PRO 107 HA PRO 107 41.924 2.545 -8.410 893 HB2 PRO 107 HB2 PRO 107 41.798 5.266 -8.484 894 HB3 PRO 107 HB3 PRO 107 40.613 4.207 -9.310 895 HG2 PRO 107 HG2 PRO 107 40.337 5.559 -6.608 896 HG3 PRO 107 HG3 PRO 107 39.154 5.518 -7.952 897 HD2 PRO 107 HD2 PRO 107 39.031 3.803 -5.828 898 HD3 PRO 107 HD3 PRO 107 38.545 3.299 -7.473
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