NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
632589 | 6ewu | 34195 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 1.811 -0.001 0.854 2 HA2 GLY 1 HA2 GLY 1 2.977 -0.572 -1.115 3 HA3 GLY 1 HA3 GLY 1 1.469 -0.468 -2.011 4 H ILE 2 H ILE 2 2.917 0.721 -3.521 5 HA ILE 2 HA ILE 2 3.014 3.571 -2.779 6 HB ILE 2 HB ILE 2 5.288 2.752 -2.886 7 HG12 ILE 2 HG12 ILE 2 6.172 4.230 -4.665 8 HG13 ILE 2 HG13 ILE 2 4.554 4.354 -5.347 9 HG21 ILE 2 HG21 ILE 2 4.267 1.202 -5.063 10 HG22 ILE 2 HG22 ILE 2 5.666 2.130 -5.602 11 HG23 ILE 2 HG23 ILE 2 5.805 1.051 -4.214 12 HD11 ILE 2 HD11 ILE 2 4.990 6.318 -4.075 13 HD12 ILE 2 HD12 ILE 2 3.805 5.352 -3.195 14 HD13 ILE 2 HD13 ILE 2 5.490 5.367 -2.676 15 H ASP 3 H ASP 3 2.245 5.020 -4.244 16 HA ASP 3 HA ASP 3 0.969 3.889 -6.638 17 HB2 ASP 3 HB2 ASP 3 0.366 6.624 -5.559 18 HB3 ASP 3 HB3 ASP 3 -0.665 5.549 -6.499 19 H ALA 4 H ALA 4 2.038 4.182 -8.469 20 HA ALA 4 HA ALA 4 4.258 5.776 -8.866 21 HB1 ALA 4 HB1 ALA 4 2.315 5.087 -11.057 22 HB2 ALA 4 HB2 ALA 4 4.061 5.310 -11.175 23 HB3 ALA 4 HB3 ALA 4 3.407 3.904 -10.335 24 H ALA 5 H ALA 5 0.853 6.542 -9.445 25 HA ALA 5 HA ALA 5 1.242 9.029 -10.697 26 HB1 ALA 5 HB1 ALA 5 -0.913 7.491 -10.235 27 HB2 ALA 5 HB2 ALA 5 -1.154 8.732 -9.004 28 HB3 ALA 5 HB3 ALA 5 -1.009 9.190 -10.700 29 H GLN 6 H GLN 6 1.067 8.096 -7.312 30 HA GLN 6 HA GLN 6 0.866 10.711 -6.245 31 HB2 GLN 6 HB2 GLN 6 1.690 8.052 -5.125 32 HB3 GLN 6 HB3 GLN 6 1.864 9.514 -4.164 33 HG2 GLN 6 HG2 GLN 6 -0.745 8.778 -5.437 34 HG3 GLN 6 HG3 GLN 6 -0.258 8.126 -3.874 35 HE21 GLN 6 HE21 GLN 6 -1.044 11.038 -5.642 36 HE22 GLN 6 HE22 GLN 6 -1.402 12.012 -4.261 37 H ILE 7 H ILE 7 3.580 8.673 -7.150 38 HA ILE 7 HA ILE 7 5.588 10.319 -5.976 39 HB ILE 7 HB ILE 7 5.887 8.338 -8.235 40 HG12 ILE 7 HG12 ILE 7 6.243 7.921 -5.259 41 HG13 ILE 7 HG13 ILE 7 4.862 7.359 -6.195 42 HG21 ILE 7 HG21 ILE 7 8.195 8.403 -6.677 43 HG22 ILE 7 HG22 ILE 7 7.986 9.066 -8.297 44 HG23 ILE 7 HG23 ILE 7 7.735 10.092 -6.885 45 HD11 ILE 7 HD11 ILE 7 7.093 6.374 -7.534 46 HD12 ILE 7 HD12 ILE 7 7.436 6.145 -5.819 47 HD13 ILE 7 HD13 ILE 7 5.965 5.473 -6.522 48 H VAL 8 H VAL 8 4.027 10.188 -9.116 49 HA VAL 8 HA VAL 8 5.836 11.988 -10.405 50 HB VAL 8 HB VAL 8 3.046 11.106 -11.148 51 HG11 VAL 8 HG11 VAL 8 3.686 12.002 -13.422 52 HG12 VAL 8 HG12 VAL 8 3.338 13.213 -12.186 53 HG13 VAL 8 HG13 VAL 8 5.008 12.848 -12.619 54 HG21 VAL 8 HG21 VAL 8 4.342 9.231 -11.426 55 HG22 VAL 8 HG22 VAL 8 4.529 9.992 -13.005 56 HG23 VAL 8 HG23 VAL 8 5.798 10.158 -11.792 57 H ASP 9 H ASP 9 2.883 12.321 -8.563 58 HA ASP 9 HA ASP 9 2.307 15.001 -9.304 59 HB2 ASP 9 HB2 ASP 9 0.752 13.283 -8.188 60 HB3 ASP 9 HB3 ASP 9 1.528 13.751 -6.678 61 H GLU 10 H GLU 10 3.905 13.592 -6.453 62 HA GLU 10 HA GLU 10 4.504 16.058 -5.219 63 HB2 GLU 10 HB2 GLU 10 5.953 14.802 -3.764 64 HB3 GLU 10 HB3 GLU 10 4.502 13.855 -4.062 65 HG2 GLU 10 HG2 GLU 10 5.743 12.566 -5.766 66 HG3 GLU 10 HG3 GLU 10 7.199 13.463 -5.338 67 H ALA 11 H ALA 11 6.229 14.070 -7.550 68 HA ALA 11 HA ALA 11 8.704 15.423 -7.432 69 HB1 ALA 11 HB1 ALA 11 9.246 14.295 -9.479 70 HB2 ALA 11 HB2 ALA 11 8.351 13.181 -8.444 71 HB3 ALA 11 HB3 ALA 11 7.544 13.967 -9.802 72 H LEU 12 H LEU 12 5.825 15.887 -9.438 73 HA LEU 12 HA LEU 12 6.917 17.903 -11.094 74 HB2 LEU 12 HB2 LEU 12 4.133 17.044 -10.403 75 HB3 LEU 12 HB3 LEU 12 4.411 18.481 -11.386 76 HG LEU 12 HG LEU 12 5.439 15.745 -12.117 77 HD11 LEU 12 HD11 LEU 12 2.761 16.861 -12.313 78 HD12 LEU 12 HD12 LEU 12 3.320 15.206 -12.548 79 HD13 LEU 12 HD13 LEU 12 3.416 16.365 -13.874 80 HD21 LEU 12 HD21 LEU 12 6.669 17.102 -13.443 81 HD22 LEU 12 HD22 LEU 12 5.529 18.442 -13.319 82 HD23 LEU 12 HD23 LEU 12 5.198 17.101 -14.416 83 H GLU 13 H GLU 13 5.244 17.972 -8.001 84 HA GLU 13 HA GLU 13 4.692 20.697 -7.828 85 HB2 GLU 13 HB2 GLU 13 5.223 18.564 -5.789 86 HB3 GLU 13 HB3 GLU 13 5.035 20.236 -5.279 87 HG2 GLU 13 HG2 GLU 13 2.870 19.975 -6.857 88 HG3 GLU 13 HG3 GLU 13 3.037 18.322 -6.269 89 H GLN 14 H GLN 14 7.678 18.945 -7.353 90 HA GLN 14 HA GLN 14 9.044 21.270 -6.280 91 HB2 GLN 14 HB2 GLN 14 10.491 18.801 -7.134 92 HB3 GLN 14 HB3 GLN 14 10.804 19.864 -5.768 93 HG2 GLN 14 HG2 GLN 14 8.306 18.796 -5.236 94 HG3 GLN 14 HG3 GLN 14 9.221 17.451 -5.915 95 HE21 GLN 14 HE21 GLN 14 8.715 16.787 -3.591 96 HE22 GLN 14 HE22 GLN 14 9.935 17.146 -2.422 97 H GLY 15 H GLY 15 8.142 20.267 -9.294 98 HA2 GLY 15 HA2 GLY 15 8.645 21.464 -11.267 99 HA3 GLY 15 HA3 GLY 15 10.151 21.995 -10.532 100 H ILE 16 H ILE 16 9.169 18.651 -10.465 101 HA ILE 16 HA ILE 16 11.340 18.041 -12.362 102 HB ILE 16 HB ILE 16 10.281 16.307 -10.127 103 HG12 ILE 16 HG12 ILE 16 13.093 17.215 -10.141 104 HG13 ILE 16 HG13 ILE 16 11.898 18.471 -9.841 105 HG21 ILE 16 HG21 ILE 16 11.071 15.050 -12.093 106 HG22 ILE 16 HG22 ILE 16 12.629 15.864 -11.964 107 HG23 ILE 16 HG23 ILE 16 12.086 14.791 -10.674 108 HD11 ILE 16 HD11 ILE 16 12.647 17.589 -7.751 109 HD12 ILE 16 HD12 ILE 16 10.979 17.079 -8.010 110 HD13 ILE 16 HD13 ILE 16 12.300 15.940 -8.269 111 H THR 17 H THR 17 10.729 17.227 -14.244 112 HA THR 17 HA THR 17 8.032 16.138 -14.528 113 HB THR 17 HB THR 17 10.027 17.286 -16.427 114 HG1 THR 17 HG1 THR 17 8.471 18.708 -16.574 115 HG21 THR 17 HG21 THR 17 8.399 16.398 -18.260 116 HG22 THR 17 HG22 THR 17 8.042 15.141 -17.075 117 HG23 THR 17 HG23 THR 17 9.690 15.355 -17.664 118 H LEU 18 H LEU 18 7.681 14.023 -14.586 119 HA LEU 18 HA LEU 18 9.954 12.216 -14.947 120 HB2 LEU 18 HB2 LEU 18 7.190 11.841 -13.829 121 HB3 LEU 18 HB3 LEU 18 8.267 10.487 -14.164 122 HG LEU 18 HG LEU 18 8.295 12.437 -11.952 123 HD11 LEU 18 HD11 LEU 18 7.808 10.341 -11.198 124 HD12 LEU 18 HD12 LEU 18 9.563 10.315 -11.026 125 HD13 LEU 18 HD13 LEU 18 8.803 9.547 -12.419 126 HD21 LEU 18 HD21 LEU 18 10.746 12.122 -11.633 127 HD22 LEU 18 HD22 LEU 18 10.325 13.141 -13.009 128 HD23 LEU 18 HD23 LEU 18 10.828 11.470 -13.269 129 H PHE 19 H PHE 19 9.900 10.479 -16.405 130 HA PHE 19 HA PHE 19 7.757 9.907 -18.137 131 HB2 PHE 19 HB2 PHE 19 8.754 10.808 -20.251 132 HB3 PHE 19 HB3 PHE 19 8.163 12.049 -19.151 133 HD1 PHE 19 HD1 PHE 19 11.001 10.745 -20.925 134 HD2 PHE 19 HD2 PHE 19 9.808 13.314 -17.749 135 HE1 PHE 19 HE1 PHE 19 13.204 11.840 -20.989 136 HE2 PHE 19 HE2 PHE 19 12.008 14.414 -17.807 137 HZ PHE 19 HZ PHE 19 13.709 13.678 -19.429 138 H VAL 20 H VAL 20 8.470 8.493 -19.994 139 HA VAL 20 HA VAL 20 10.924 7.029 -19.267 140 HB VAL 20 HB VAL 20 8.390 5.836 -20.400 141 HG11 VAL 20 HG11 VAL 20 11.009 4.627 -19.536 142 HG12 VAL 20 HG12 VAL 20 9.538 3.684 -19.783 143 HG13 VAL 20 HG13 VAL 20 10.260 4.563 -21.131 144 HG21 VAL 20 HG21 VAL 20 8.896 6.627 -17.778 145 HG22 VAL 20 HG22 VAL 20 7.628 5.532 -18.330 146 HG23 VAL 20 HG23 VAL 20 9.177 4.886 -17.789 147 H VAL 21 H VAL 21 12.398 6.834 -20.820 148 HA VAL 21 HA VAL 21 11.562 7.321 -23.606 149 HB VAL 21 HB VAL 21 14.134 8.071 -22.222 150 HG11 VAL 21 HG11 VAL 21 13.626 7.465 -25.026 151 HG12 VAL 21 HG12 VAL 21 14.297 9.077 -24.773 152 HG13 VAL 21 HG13 VAL 21 15.154 7.659 -24.168 153 HG21 VAL 21 HG21 VAL 21 12.015 9.687 -23.635 154 HG22 VAL 21 HG22 VAL 21 12.338 9.657 -21.901 155 HG23 VAL 21 HG23 VAL 21 13.531 10.336 -23.008 156 H ASN 22 H ASN 22 11.597 5.497 -24.735 157 HA ASN 22 HA ASN 22 12.246 3.496 -25.598 158 HB2 ASN 22 HB2 ASN 22 14.918 4.506 -24.620 159 HB3 ASN 22 HB3 ASN 22 14.738 3.004 -25.521 160 HD21 ASN 22 HD21 ASN 22 15.679 6.027 -25.883 161 HD22 ASN 22 HD22 ASN 22 15.202 6.334 -27.515 162 H ASN 23 H ASN 23 11.115 3.463 -23.035 163 HA ASN 23 HA ASN 23 10.678 1.942 -21.393 164 HB2 ASN 23 HB2 ASN 23 11.459 0.319 -23.260 165 HB3 ASN 23 HB3 ASN 23 12.959 0.227 -22.342 166 HD21 ASN 23 HD21 ASN 23 9.565 0.409 -21.341 167 HD22 ASN 23 HD22 ASN 23 9.585 -1.045 -20.407 168 H ARG 24 H ARG 24 12.606 4.118 -21.121 169 HA ARG 24 HA ARG 24 14.077 3.070 -18.801 170 HB2 ARG 24 HB2 ARG 24 15.228 5.242 -20.529 171 HB3 ARG 24 HB3 ARG 24 16.044 4.224 -19.349 172 HG2 ARG 24 HG2 ARG 24 15.101 2.408 -21.186 173 HG3 ARG 24 HG3 ARG 24 15.570 3.788 -22.181 174 HD2 ARG 24 HD2 ARG 24 17.786 3.664 -21.539 175 HD3 ARG 24 HD3 ARG 24 17.411 2.812 -20.042 176 HE ARG 24 HE ARG 24 16.690 1.072 -22.017 177 HH11 ARG 24 HH11 ARG 24 19.606 2.781 -21.182 178 HH12 ARG 24 HH12 ARG 24 20.659 1.561 -21.819 179 HH21 ARG 24 HH21 ARG 24 18.066 -0.541 -22.859 180 HH22 ARG 24 HH22 ARG 24 19.781 -0.328 -22.773 181 H LEU 25 H LEU 25 13.532 4.095 -17.000 182 HA LEU 25 HA LEU 25 11.819 6.351 -16.993 183 HB2 LEU 25 HB2 LEU 25 12.184 4.468 -15.227 184 HB3 LEU 25 HB3 LEU 25 13.434 5.546 -14.611 185 HG LEU 25 HG LEU 25 10.515 6.258 -14.888 186 HD11 LEU 25 HD11 LEU 25 10.731 6.248 -12.324 187 HD12 LEU 25 HD12 LEU 25 12.144 5.229 -12.595 188 HD13 LEU 25 HD13 LEU 25 10.558 4.704 -13.160 189 HD21 LEU 25 HD21 LEU 25 12.952 7.762 -14.172 190 HD22 LEU 25 HD22 LEU 25 11.540 8.026 -13.148 191 HD23 LEU 25 HD23 LEU 25 11.439 8.320 -14.885 192 H GLN 26 H GLN 26 12.346 8.398 -17.324 193 HA GLN 26 HA GLN 26 14.913 9.391 -16.316 194 HB2 GLN 26 HB2 GLN 26 13.848 10.095 -19.052 195 HB3 GLN 26 HB3 GLN 26 15.385 10.583 -18.352 196 HG2 GLN 26 HG2 GLN 26 15.354 7.784 -18.267 197 HG3 GLN 26 HG3 GLN 26 14.733 8.235 -19.855 198 HE21 GLN 26 HE21 GLN 26 16.075 10.283 -20.686 199 HE22 GLN 26 HE22 GLN 26 17.781 10.013 -20.704 200 H TYR 27 H TYR 27 14.966 11.647 -15.883 201 HA TYR 27 HA TYR 27 12.361 13.004 -15.920 202 HB2 TYR 27 HB2 TYR 27 12.661 13.780 -13.640 203 HB3 TYR 27 HB3 TYR 27 12.726 12.022 -13.673 204 HD1 TYR 27 HD1 TYR 27 14.899 10.860 -13.396 205 HD2 TYR 27 HD2 TYR 27 14.545 15.077 -12.953 206 HE1 TYR 27 HE1 TYR 27 17.069 10.915 -12.239 207 HE2 TYR 27 HE2 TYR 27 16.714 15.144 -11.796 208 HH TYR 27 HH TYR 27 18.626 12.190 -11.305 209 H GLU 28 H GLU 28 12.457 15.291 -15.916 210 HA GLU 28 HA GLU 28 15.117 16.443 -16.413 211 HB2 GLU 28 HB2 GLU 28 14.312 16.280 -18.598 212 HB3 GLU 28 HB3 GLU 28 12.656 16.626 -18.117 213 HG2 GLU 28 HG2 GLU 28 12.937 18.846 -18.260 214 HG3 GLU 28 HG3 GLU 28 14.575 18.788 -17.613 215 H THR 29 H THR 29 15.505 18.030 -15.035 216 HA THR 29 HA THR 29 13.402 19.936 -14.373 217 HB THR 29 HB THR 29 13.265 18.207 -12.604 218 HG1 THR 29 HG1 THR 29 12.729 19.894 -11.457 219 HG21 THR 29 HG21 THR 29 15.027 17.515 -11.340 220 HG22 THR 29 HG22 THR 29 15.854 19.069 -11.446 221 HG23 THR 29 HG23 THR 29 15.919 17.942 -12.800 222 H SER 30 H SER 30 14.186 21.925 -13.534 223 HA SER 30 HA SER 30 17.085 22.315 -13.902 224 HB2 SER 30 HB2 SER 30 14.808 24.177 -14.611 225 HB3 SER 30 HB3 SER 30 16.507 24.649 -14.628 226 HG SER 30 HG SER 30 15.954 24.013 -16.687 227 H ARG 31 H ARG 31 17.794 22.314 -11.832 228 HA ARG 31 HA ARG 31 17.614 24.566 -10.248 229 HB2 ARG 31 HB2 ARG 31 16.227 23.542 -8.330 230 HB3 ARG 31 HB3 ARG 31 15.369 24.235 -9.700 231 HG2 ARG 31 HG2 ARG 31 14.585 22.229 -10.405 232 HG3 ARG 31 HG3 ARG 31 16.003 21.348 -9.831 233 HD2 ARG 31 HD2 ARG 31 13.784 20.964 -8.614 234 HD3 ARG 31 HD3 ARG 31 15.216 21.277 -7.634 235 HE ARG 31 HE ARG 31 14.046 23.733 -8.056 236 HH11 ARG 31 HH11 ARG 31 13.115 20.701 -6.619 237 HH12 ARG 31 HH12 ARG 31 12.031 21.425 -5.479 238 HH21 ARG 31 HH21 ARG 31 12.620 24.698 -6.560 239 HH22 ARG 31 HH22 ARG 31 11.749 23.699 -5.446 240 H ASP 32 H ASP 32 18.024 23.797 -7.739 241 HA ASP 32 HA ASP 32 19.937 21.571 -7.811 242 HB2 ASP 32 HB2 ASP 32 21.546 22.919 -6.492 243 HB3 ASP 32 HB3 ASP 32 21.266 23.583 -8.099 244 H SER 33 H SER 33 20.648 20.956 -5.559 245 HA SER 33 HA SER 33 20.149 20.229 -3.461 246 HB2 SER 33 HB2 SER 33 19.666 22.885 -3.347 247 HB3 SER 33 HB3 SER 33 18.055 22.271 -2.974 248 HG SER 33 HG SER 33 20.479 21.795 -1.596 249 H ILE 34 H ILE 34 18.871 18.946 -5.502 250 HA ILE 34 HA ILE 34 16.071 18.793 -5.293 251 HB ILE 34 HB ILE 34 18.165 17.317 -6.652 252 HG12 ILE 34 HG12 ILE 34 15.215 17.488 -7.277 253 HG13 ILE 34 HG13 ILE 34 16.343 18.796 -7.615 254 HG21 ILE 34 HG21 ILE 34 15.799 15.737 -5.653 255 HG22 ILE 34 HG22 ILE 34 16.967 15.188 -6.853 256 HG23 ILE 34 HG23 ILE 34 17.484 15.492 -5.195 257 HD11 ILE 34 HD11 ILE 34 17.400 17.626 -9.290 258 HD12 ILE 34 HD12 ILE 34 16.885 16.059 -8.666 259 HD13 ILE 34 HD13 ILE 34 15.724 17.111 -9.477 260 HA PRO 35 HA PRO 35 15.382 16.534 -1.586 261 HB2 PRO 35 HB2 PRO 35 13.076 15.252 -2.228 262 HB3 PRO 35 HB3 PRO 35 13.149 16.985 -1.888 263 HG2 PRO 35 HG2 PRO 35 13.087 15.573 -4.527 264 HG3 PRO 35 HG3 PRO 35 12.211 17.028 -4.016 265 HD2 PRO 35 HD2 PRO 35 14.452 17.134 -5.532 266 HD3 PRO 35 HD3 PRO 35 14.034 18.398 -4.358 267 H THR 36 H THR 36 17.068 15.052 -1.495 268 HA THR 36 HA THR 36 17.512 12.844 -3.080 269 HB THR 36 HB THR 36 18.013 13.064 -0.105 270 HG1 THR 36 HG1 THR 36 20.030 13.367 -2.017 271 HG21 THR 36 HG21 THR 36 18.366 10.822 -0.467 272 HG22 THR 36 HG22 THR 36 19.954 11.460 -0.895 273 HG23 THR 36 HG23 THR 36 18.796 11.053 -2.161 274 H GLU 37 H GLU 37 15.411 13.118 -0.244 275 HA GLU 37 HA GLU 37 14.718 10.459 0.094 276 HB2 GLU 37 HB2 GLU 37 12.678 11.264 1.164 277 HB3 GLU 37 HB3 GLU 37 14.058 12.241 1.646 278 HG2 GLU 37 HG2 GLU 37 13.357 13.877 -0.150 279 HG3 GLU 37 HG3 GLU 37 11.856 12.959 -0.261 280 H LEU 38 H LEU 38 13.494 12.813 -2.215 281 HA LEU 38 HA LEU 38 11.455 11.033 -3.216 282 HB2 LEU 38 HB2 LEU 38 11.886 13.770 -3.281 283 HB3 LEU 38 HB3 LEU 38 12.147 13.257 -4.947 284 HG LEU 38 HG LEU 38 9.668 12.451 -3.467 285 HD11 LEU 38 HD11 LEU 38 10.408 15.132 -4.426 286 HD12 LEU 38 HD12 LEU 38 9.217 14.641 -3.222 287 HD13 LEU 38 HD13 LEU 38 8.825 14.546 -4.939 288 HD21 LEU 38 HD21 LEU 38 8.855 11.877 -5.514 289 HD22 LEU 38 HD22 LEU 38 10.573 11.622 -5.819 290 HD23 LEU 38 HD23 LEU 38 9.793 13.110 -6.358 291 H LEU 39 H LEU 39 14.689 12.047 -4.126 292 HA LEU 39 HA LEU 39 14.769 11.063 -6.737 293 HB2 LEU 39 HB2 LEU 39 16.522 12.327 -5.093 294 HB3 LEU 39 HB3 LEU 39 17.222 10.711 -5.157 295 HG LEU 39 HG LEU 39 16.701 12.545 -7.495 296 HD11 LEU 39 HD11 LEU 39 18.822 13.201 -7.333 297 HD12 LEU 39 HD12 LEU 39 19.395 11.555 -7.071 298 HD13 LEU 39 HD13 LEU 39 18.805 12.508 -5.711 299 HD21 LEU 39 HD21 LEU 39 18.307 10.409 -8.286 300 HD22 LEU 39 HD22 LEU 39 16.633 10.713 -8.751 301 HD23 LEU 39 HD23 LEU 39 16.991 9.679 -7.367 302 H ASN 40 H ASN 40 15.770 9.459 -3.715 303 HA ASN 40 HA ASN 40 16.443 6.994 -4.862 304 HB2 ASN 40 HB2 ASN 40 15.582 7.783 -2.084 305 HB3 ASN 40 HB3 ASN 40 15.970 6.114 -2.493 306 HD21 ASN 40 HD21 ASN 40 17.180 9.008 -1.401 307 HD22 ASN 40 HD22 ASN 40 18.864 8.703 -1.633 308 H LYS 41 H LYS 41 13.370 8.318 -3.838 309 HA LYS 41 HA LYS 41 11.851 5.970 -3.771 310 HB2 LYS 41 HB2 LYS 41 11.051 8.139 -2.925 311 HB3 LYS 41 HB3 LYS 41 10.974 8.751 -4.572 312 HG2 LYS 41 HG2 LYS 41 9.030 7.716 -5.005 313 HG3 LYS 41 HG3 LYS 41 9.478 6.269 -4.099 314 HD2 LYS 41 HD2 LYS 41 7.767 7.120 -2.805 315 HD3 LYS 41 HD3 LYS 41 9.187 7.818 -2.022 316 HE2 LYS 41 HE2 LYS 41 8.815 9.825 -3.570 317 HE3 LYS 41 HE3 LYS 41 7.221 9.136 -3.871 318 HZ1 LYS 41 HZ1 LYS 41 6.543 10.130 -2.029 319 HZ2 LYS 41 HZ2 LYS 41 8.109 10.648 -1.655 320 HZ3 LYS 41 HZ3 LYS 41 7.571 9.134 -1.126 321 H TRP 42 H TRP 42 12.738 8.080 -6.452 322 HA TRP 42 HA TRP 42 11.069 6.971 -8.411 323 HB2 TRP 42 HB2 TRP 42 13.803 8.228 -8.733 324 HB3 TRP 42 HB3 TRP 42 12.657 7.938 -10.039 325 HD1 TRP 42 HD1 TRP 42 10.104 8.957 -8.164 326 HE1 TRP 42 HE1 TRP 42 9.786 11.501 -7.932 327 HE3 TRP 42 HE3 TRP 42 14.807 10.485 -9.461 328 HZ2 TRP 42 HZ2 TRP 42 11.325 13.844 -8.257 329 HZ3 TRP 42 HZ3 TRP 42 15.302 12.895 -9.476 330 HH2 TRP 42 HH2 TRP 42 13.596 14.538 -8.886 331 H LYS 43 H LYS 43 14.471 6.235 -7.647 332 HA LYS 43 HA LYS 43 14.678 4.100 -9.500 333 HB2 LYS 43 HB2 LYS 43 16.729 3.504 -8.163 334 HB3 LYS 43 HB3 LYS 43 16.692 5.150 -8.781 335 HG2 LYS 43 HG2 LYS 43 16.023 5.978 -6.599 336 HG3 LYS 43 HG3 LYS 43 15.995 4.330 -5.968 337 HD2 LYS 43 HD2 LYS 43 18.460 5.552 -7.185 338 HD3 LYS 43 HD3 LYS 43 18.071 5.713 -5.471 339 HE2 LYS 43 HE2 LYS 43 17.884 3.167 -5.454 340 HE3 LYS 43 HE3 LYS 43 18.673 3.214 -7.030 341 HZ1 LYS 43 HZ1 LYS 43 19.770 3.739 -4.389 342 HZ2 LYS 43 HZ2 LYS 43 20.318 4.749 -5.630 343 HZ3 LYS 43 HZ3 LYS 43 20.510 3.073 -5.758 344 H GLN 44 H GLN 44 13.601 4.320 -6.189 345 HA GLN 44 HA GLN 44 13.769 1.609 -5.481 346 HB2 GLN 44 HB2 GLN 44 13.380 3.384 -3.841 347 HB3 GLN 44 HB3 GLN 44 11.803 3.708 -4.550 348 HG2 GLN 44 HG2 GLN 44 11.106 2.387 -2.871 349 HG3 GLN 44 HG3 GLN 44 11.506 1.108 -4.015 350 HE21 GLN 44 HE21 GLN 44 11.493 0.153 -1.673 351 HE22 GLN 44 HE22 GLN 44 13.055 0.022 -0.948 352 H HIS 45 H HIS 45 11.115 3.472 -6.929 353 HA HIS 45 HA HIS 45 9.812 0.919 -7.613 354 HB2 HIS 45 HB2 HIS 45 8.409 3.580 -7.410 355 HB3 HIS 45 HB3 HIS 45 7.687 1.975 -7.470 356 HD1 HIS 45 HD1 HIS 45 7.994 0.491 -5.275 357 HD2 HIS 45 HD2 HIS 45 8.986 4.508 -4.897 358 HE1 HIS 45 HE1 HIS 45 8.075 0.934 -2.800 359 H LYS 46 H LYS 46 11.858 1.970 -9.205 360 HA LYS 46 HA LYS 46 11.146 3.636 -11.289 361 HB2 LYS 46 HB2 LYS 46 13.424 2.854 -10.990 362 HB3 LYS 46 HB3 LYS 46 12.937 1.201 -11.341 363 HG2 LYS 46 HG2 LYS 46 12.619 1.649 -13.608 364 HG3 LYS 46 HG3 LYS 46 12.560 3.393 -13.348 365 HD2 LYS 46 HD2 LYS 46 14.775 3.583 -13.549 366 HD3 LYS 46 HD3 LYS 46 15.060 2.248 -12.430 367 HE2 LYS 46 HE2 LYS 46 14.046 1.416 -15.045 368 HE3 LYS 46 HE3 LYS 46 15.613 2.222 -15.111 369 HZ1 LYS 46 HZ1 LYS 46 16.529 0.639 -13.625 370 HZ2 LYS 46 HZ2 LYS 46 15.708 -0.235 -14.818 371 HZ3 LYS 46 HZ3 LYS 46 15.017 -0.039 -13.287 372 H GLN 47 H GLN 47 10.938 0.073 -11.273 373 HA GLN 47 HA GLN 47 9.688 -0.222 -13.740 374 HB2 GLN 47 HB2 GLN 47 10.449 -1.901 -11.634 375 HB3 GLN 47 HB3 GLN 47 8.722 -2.169 -11.827 376 HG2 GLN 47 HG2 GLN 47 10.666 -2.281 -14.114 377 HG3 GLN 47 HG3 GLN 47 10.226 -3.686 -13.144 378 HE21 GLN 47 HE21 GLN 47 8.941 -1.171 -15.242 379 HE22 GLN 47 HE22 GLN 47 7.575 -2.072 -15.794 380 H GLU 48 H GLU 48 8.342 0.524 -10.585 381 HA GLU 48 HA GLU 48 5.618 0.149 -11.317 382 HB2 GLU 48 HB2 GLU 48 6.597 1.967 -9.124 383 HB3 GLU 48 HB3 GLU 48 5.072 1.097 -9.214 384 HG2 GLU 48 HG2 GLU 48 6.654 -1.003 -9.241 385 HG3 GLU 48 HG3 GLU 48 7.776 0.119 -8.472 386 H LEU 49 H LEU 49 7.814 2.900 -11.333 387 HA LEU 49 HA LEU 49 5.809 4.827 -11.990 388 HB2 LEU 49 HB2 LEU 49 8.812 4.913 -12.220 389 HB3 LEU 49 HB3 LEU 49 7.751 6.291 -12.505 390 HG LEU 49 HG LEU 49 7.547 4.931 -9.874 391 HD11 LEU 49 HD11 LEU 49 10.043 5.306 -10.629 392 HD12 LEU 49 HD12 LEU 49 9.510 5.689 -8.992 393 HD13 LEU 49 HD13 LEU 49 9.682 6.975 -10.187 394 HD21 LEU 49 HD21 LEU 49 6.588 7.272 -11.062 395 HD22 LEU 49 HD22 LEU 49 7.797 7.798 -9.891 396 HD23 LEU 49 HD23 LEU 49 6.444 6.792 -9.371 397 H ILE 50 H ILE 50 8.273 3.074 -13.846 398 HA ILE 50 HA ILE 50 7.938 4.241 -16.323 399 HB ILE 50 HB ILE 50 8.489 1.339 -15.698 400 HG12 ILE 50 HG12 ILE 50 10.482 3.401 -16.602 401 HG13 ILE 50 HG13 ILE 50 10.056 3.249 -14.901 402 HG21 ILE 50 HG21 ILE 50 8.009 2.663 -18.212 403 HG22 ILE 50 HG22 ILE 50 9.642 2.003 -18.148 404 HG23 ILE 50 HG23 ILE 50 8.254 0.950 -17.873 405 HD11 ILE 50 HD11 ILE 50 11.148 1.025 -16.607 406 HD12 ILE 50 HD12 ILE 50 12.095 2.019 -15.498 407 HD13 ILE 50 HD13 ILE 50 10.824 0.967 -14.874 408 H ASP 51 H ASP 51 6.179 1.437 -15.010 409 HA ASP 51 HA ASP 51 4.512 0.990 -17.203 410 HB2 ASP 51 HB2 ASP 51 4.857 -0.455 -15.105 411 HB3 ASP 51 HB3 ASP 51 3.631 0.563 -14.354 412 H PHE 52 H PHE 52 4.347 3.363 -14.661 413 HA PHE 52 HA PHE 52 1.620 4.107 -15.157 414 HB2 PHE 52 HB2 PHE 52 2.490 4.496 -12.955 415 HB3 PHE 52 HB3 PHE 52 3.843 5.424 -13.593 416 HD1 PHE 52 HD1 PHE 52 3.721 7.693 -13.339 417 HD2 PHE 52 HD2 PHE 52 0.113 5.476 -13.774 418 HE1 PHE 52 HE1 PHE 52 2.420 9.765 -13.082 419 HE2 PHE 52 HE2 PHE 52 -1.193 7.545 -13.518 420 HZ PHE 52 HZ PHE 52 -0.040 9.694 -13.173 421 H LEU 53 H LEU 53 4.774 5.609 -15.843 422 HA LEU 53 HA LEU 53 3.729 7.797 -17.289 423 HB2 LEU 53 HB2 LEU 53 6.426 6.505 -17.123 424 HB3 LEU 53 HB3 LEU 53 6.123 7.813 -18.264 425 HG LEU 53 HG LEU 53 7.137 8.784 -16.358 426 HD11 LEU 53 HD11 LEU 53 4.448 9.517 -15.514 427 HD12 LEU 53 HD12 LEU 53 4.665 9.562 -17.263 428 HD13 LEU 53 HD13 LEU 53 5.727 10.506 -16.218 429 HD21 LEU 53 HD21 LEU 53 5.073 7.332 -14.705 430 HD22 LEU 53 HD22 LEU 53 6.241 8.499 -14.087 431 HD23 LEU 53 HD23 LEU 53 6.799 6.975 -14.778 432 H ASN 54 H ASN 54 4.613 4.537 -18.200 433 HA ASN 54 HA ASN 54 4.579 4.986 -21.017 434 HB2 ASN 54 HB2 ASN 54 5.573 3.002 -19.545 435 HB3 ASN 54 HB3 ASN 54 4.005 2.282 -19.898 436 HD21 ASN 54 HD21 ASN 54 7.114 2.559 -20.928 437 HD22 ASN 54 HD22 ASN 54 6.905 2.131 -22.589 438 H GLN 55 H GLN 55 2.244 3.600 -18.723 439 HA GLN 55 HA GLN 55 0.227 3.246 -20.730 440 HB2 GLN 55 HB2 GLN 55 -1.161 2.442 -18.983 441 HB3 GLN 55 HB3 GLN 55 0.463 1.873 -18.618 442 HG2 GLN 55 HG2 GLN 55 -0.218 2.602 -16.564 443 HG3 GLN 55 HG3 GLN 55 0.588 4.044 -17.178 444 HE21 GLN 55 HE21 GLN 55 -0.479 5.786 -16.604 445 HE22 GLN 55 HE22 GLN 55 -2.195 5.979 -16.599 446 H LEU 56 H LEU 56 1.403 5.930 -19.166 447 HA LEU 56 HA LEU 56 -1.092 7.342 -18.844 448 HB2 LEU 56 HB2 LEU 56 0.699 7.856 -17.336 449 HB3 LEU 56 HB3 LEU 56 1.784 8.218 -18.677 450 HG LEU 56 HG LEU 56 0.245 10.148 -19.233 451 HD11 LEU 56 HD11 LEU 56 -1.450 10.788 -17.857 452 HD12 LEU 56 HD12 LEU 56 -0.721 10.056 -16.429 453 HD13 LEU 56 HD13 LEU 56 -1.537 9.043 -17.620 454 HD21 LEU 56 HD21 LEU 56 2.228 9.870 -17.160 455 HD22 LEU 56 HD22 LEU 56 1.077 11.146 -16.765 456 HD23 LEU 56 HD23 LEU 56 1.962 11.197 -18.290 457 H ASP 57 H ASP 57 1.445 7.088 -21.238 458 HA ASP 57 HA ASP 57 0.040 9.062 -22.911 459 HB2 ASP 57 HB2 ASP 57 2.671 9.065 -22.234 460 HB3 ASP 57 HB3 ASP 57 2.725 8.159 -23.744 461 H SER 58 H SER 58 1.237 5.790 -22.728 462 HA SER 58 HA SER 58 0.362 5.250 -25.471 463 HB2 SER 58 HB2 SER 58 1.769 3.366 -23.569 464 HB3 SER 58 HB3 SER 58 1.570 3.174 -25.311 465 HG SER 58 HG SER 58 2.864 5.078 -25.552 466 H GLU 59 H GLU 59 -0.322 4.422 -22.128 467 HA GLU 59 HA GLU 59 -1.929 3.089 -21.175 468 HB2 GLU 59 HB2 GLU 59 -4.170 3.753 -21.745 469 HB3 GLU 59 HB3 GLU 59 -3.131 5.169 -21.826 470 HG2 GLU 59 HG2 GLU 59 -3.114 5.125 -24.199 471 HG3 GLU 59 HG3 GLU 59 -3.896 3.546 -24.235 472 H GLU 60 H GLU 60 -0.420 1.732 -23.197 473 HA GLU 60 HA GLU 60 -2.359 -0.349 -23.856 474 HB2 GLU 60 HB2 GLU 60 -1.702 -0.529 -26.141 475 HB3 GLU 60 HB3 GLU 60 -2.100 1.159 -25.852 476 HG2 GLU 60 HG2 GLU 60 0.088 1.846 -26.010 477 HG3 GLU 60 HG3 GLU 60 0.728 0.256 -25.598 478 H GLN 61 H GLN 61 0.234 0.335 -22.212 479 HA GLN 61 HA GLN 61 1.722 -2.094 -22.956 480 HB2 GLN 61 HB2 GLN 61 2.549 0.568 -22.031 481 HB3 GLN 61 HB3 GLN 61 3.353 -0.761 -21.206 482 HG2 GLN 61 HG2 GLN 61 3.197 -0.802 -24.175 483 HG3 GLN 61 HG3 GLN 61 4.345 0.282 -23.393 484 HE21 GLN 61 HE21 GLN 61 6.227 -0.516 -22.725 485 HE22 GLN 61 HE22 GLN 61 6.644 -2.192 -22.687 486 H THR 62 H THR 62 -0.690 -2.139 -21.399 487 HA THR 62 HA THR 62 -0.291 -2.244 -18.642 488 HB THR 62 HB THR 62 -2.135 -4.165 -20.035 489 HG1 THR 62 HG1 THR 62 -2.195 -1.370 -20.046 490 HG21 THR 62 HG21 THR 62 -3.463 -2.898 -17.978 491 HG22 THR 62 HG22 THR 62 -1.818 -3.048 -17.360 492 HG23 THR 62 HG23 THR 62 -2.696 -4.483 -17.889 493 H LYS 63 H LYS 63 -0.233 -4.172 -17.254 494 HA LYS 63 HA LYS 63 1.255 -6.412 -18.445 495 HB2 LYS 63 HB2 LYS 63 1.909 -5.340 -15.712 496 HB3 LYS 63 HB3 LYS 63 2.858 -6.426 -16.718 497 HG2 LYS 63 HG2 LYS 63 2.498 -4.011 -18.154 498 HG3 LYS 63 HG3 LYS 63 3.013 -3.603 -16.516 499 HD2 LYS 63 HD2 LYS 63 4.936 -3.898 -17.990 500 HD3 LYS 63 HD3 LYS 63 4.910 -5.137 -16.732 501 HE2 LYS 63 HE2 LYS 63 5.458 -5.938 -19.062 502 HE3 LYS 63 HE3 LYS 63 4.148 -6.788 -18.243 503 HZ1 LYS 63 HZ1 LYS 63 3.810 -4.637 -20.263 504 HZ2 LYS 63 HZ2 LYS 63 2.557 -5.464 -19.484 505 HZ3 LYS 63 HZ3 LYS 63 3.588 -6.291 -20.540 Start of MODEL 2 1 H1 GLY 1 H GLY 1 1.623 1.429 0.747 2 HA2 GLY 1 HA2 GLY 1 3.272 -0.184 -1.106 3 HA3 GLY 1 HA3 GLY 1 1.550 0.189 -1.364 4 H ILE 2 H ILE 2 2.233 1.193 -3.448 5 HA ILE 2 HA ILE 2 2.825 4.012 -3.033 6 HB ILE 2 HB ILE 2 5.065 2.803 -3.178 7 HG12 ILE 2 HG12 ILE 2 6.159 4.258 -4.599 8 HG13 ILE 2 HG13 ILE 2 4.727 4.592 -5.572 9 HG21 ILE 2 HG21 ILE 2 5.803 1.975 -5.444 10 HG22 ILE 2 HG22 ILE 2 4.528 0.986 -4.722 11 HG23 ILE 2 HG23 ILE 2 4.167 2.136 -6.022 12 HD11 ILE 2 HD11 ILE 2 5.310 6.490 -4.116 13 HD12 ILE 2 HD12 ILE 2 3.744 5.861 -3.667 14 HD13 ILE 2 HD13 ILE 2 5.165 5.451 -2.675 15 H ASP 3 H ASP 3 2.399 5.345 -4.783 16 HA ASP 3 HA ASP 3 0.733 4.141 -6.921 17 HB2 ASP 3 HB2 ASP 3 0.364 6.703 -5.414 18 HB3 ASP 3 HB3 ASP 3 -0.387 6.369 -6.931 19 H ALA 4 H ALA 4 1.801 4.459 -8.598 20 HA ALA 4 HA ALA 4 4.234 6.002 -8.855 21 HB1 ALA 4 HB1 ALA 4 2.367 4.875 -10.955 22 HB2 ALA 4 HB2 ALA 4 3.968 5.584 -11.297 23 HB3 ALA 4 HB3 ALA 4 3.836 4.097 -10.324 24 H ALA 5 H ALA 5 0.802 6.696 -9.531 25 HA ALA 5 HA ALA 5 1.175 9.169 -10.898 26 HB1 ALA 5 HB1 ALA 5 -1.018 7.883 -10.681 27 HB2 ALA 5 HB2 ALA 5 -1.113 8.496 -9.006 28 HB3 ALA 5 HB3 ALA 5 -1.139 9.625 -10.367 29 H GLN 6 H GLN 6 1.068 8.349 -7.403 30 HA GLN 6 HA GLN 6 1.029 11.091 -6.516 31 HB2 GLN 6 HB2 GLN 6 1.694 8.449 -5.176 32 HB3 GLN 6 HB3 GLN 6 1.934 9.961 -4.342 33 HG2 GLN 6 HG2 GLN 6 -0.752 9.233 -5.591 34 HG3 GLN 6 HG3 GLN 6 -0.300 8.782 -3.952 35 HE21 GLN 6 HE21 GLN 6 -1.030 11.619 -6.071 36 HE22 GLN 6 HE22 GLN 6 -1.005 12.745 -4.725 37 H ILE 7 H ILE 7 3.654 8.734 -7.259 38 HA ILE 7 HA ILE 7 5.724 10.448 -6.323 39 HB ILE 7 HB ILE 7 5.853 8.370 -8.474 40 HG12 ILE 7 HG12 ILE 7 6.572 8.058 -5.541 41 HG13 ILE 7 HG13 ILE 7 5.073 7.483 -6.242 42 HG21 ILE 7 HG21 ILE 7 7.990 9.663 -6.698 43 HG22 ILE 7 HG22 ILE 7 8.345 8.361 -7.826 44 HG23 ILE 7 HG23 ILE 7 7.843 9.914 -8.454 45 HD11 ILE 7 HD11 ILE 7 6.807 5.703 -6.003 46 HD12 ILE 7 HD12 ILE 7 6.202 5.886 -7.665 47 HD13 ILE 7 HD13 ILE 7 7.805 6.480 -7.170 48 H VAL 8 H VAL 8 4.049 10.247 -9.468 49 HA VAL 8 HA VAL 8 5.817 12.078 -10.820 50 HB VAL 8 HB VAL 8 2.966 11.114 -11.371 51 HG11 VAL 8 HG11 VAL 8 3.267 11.935 -13.688 52 HG12 VAL 8 HG12 VAL 8 3.243 13.271 -12.533 53 HG13 VAL 8 HG13 VAL 8 4.792 12.717 -13.211 54 HG21 VAL 8 HG21 VAL 8 4.833 9.416 -11.479 55 HG22 VAL 8 HG22 VAL 8 4.053 9.704 -13.036 56 HG23 VAL 8 HG23 VAL 8 5.616 10.434 -12.707 57 H ASP 9 H ASP 9 2.842 12.425 -8.908 58 HA ASP 9 HA ASP 9 2.326 15.177 -9.432 59 HB2 ASP 9 HB2 ASP 9 0.656 13.544 -8.688 60 HB3 ASP 9 HB3 ASP 9 1.558 13.292 -7.194 61 H GLU 10 H GLU 10 4.059 13.516 -6.734 62 HA GLU 10 HA GLU 10 4.624 16.010 -5.347 63 HB2 GLU 10 HB2 GLU 10 5.977 14.660 -3.868 64 HB3 GLU 10 HB3 GLU 10 4.421 13.872 -4.170 65 HG2 GLU 10 HG2 GLU 10 5.601 12.508 -5.942 66 HG3 GLU 10 HG3 GLU 10 7.107 13.160 -5.403 67 H ALA 11 H ALA 11 6.330 14.024 -7.804 68 HA ALA 11 HA ALA 11 8.803 15.451 -7.502 69 HB1 ALA 11 HB1 ALA 11 7.687 14.084 -10.026 70 HB2 ALA 11 HB2 ALA 11 9.383 14.496 -9.724 71 HB3 ALA 11 HB3 ALA 11 8.593 13.252 -8.748 72 H LEU 12 H LEU 12 5.873 15.891 -9.562 73 HA LEU 12 HA LEU 12 6.855 18.160 -10.994 74 HB2 LEU 12 HB2 LEU 12 4.096 17.092 -10.362 75 HB3 LEU 12 HB3 LEU 12 4.272 18.645 -11.175 76 HG LEU 12 HG LEU 12 5.485 16.058 -12.231 77 HD11 LEU 12 HD11 LEU 12 2.932 17.488 -13.050 78 HD12 LEU 12 HD12 LEU 12 3.021 15.947 -12.174 79 HD13 LEU 12 HD13 LEU 12 3.619 16.052 -13.834 80 HD21 LEU 12 HD21 LEU 12 6.657 18.018 -13.108 81 HD22 LEU 12 HD22 LEU 12 5.121 18.832 -13.457 82 HD23 LEU 12 HD23 LEU 12 5.598 17.389 -14.378 83 H GLU 13 H GLU 13 5.371 17.865 -7.799 84 HA GLU 13 HA GLU 13 4.765 20.655 -7.445 85 HB2 GLU 13 HB2 GLU 13 5.220 18.305 -5.594 86 HB3 GLU 13 HB3 GLU 13 5.207 19.918 -4.906 87 HG2 GLU 13 HG2 GLU 13 2.934 18.894 -6.646 88 HG3 GLU 13 HG3 GLU 13 3.035 18.653 -4.892 89 H GLN 14 H GLN 14 7.718 18.742 -7.124 90 HA GLN 14 HA GLN 14 9.217 20.928 -5.861 91 HB2 GLN 14 HB2 GLN 14 9.982 18.234 -7.012 92 HB3 GLN 14 HB3 GLN 14 11.074 19.255 -6.071 93 HG2 GLN 14 HG2 GLN 14 9.775 18.944 -4.086 94 HG3 GLN 14 HG3 GLN 14 8.425 18.233 -4.938 95 HE21 GLN 14 HE21 GLN 14 8.899 16.687 -3.080 96 HE22 GLN 14 HE22 GLN 14 9.921 15.318 -3.450 97 H GLY 15 H GLY 15 8.294 20.122 -9.070 98 HA2 GLY 15 HA2 GLY 15 8.779 21.462 -10.943 99 HA3 GLY 15 HA3 GLY 15 10.323 21.974 -10.214 100 H ILE 16 H ILE 16 9.242 18.558 -10.413 101 HA ILE 16 HA ILE 16 11.386 18.123 -12.406 102 HB ILE 16 HB ILE 16 10.697 16.283 -10.104 103 HG12 ILE 16 HG12 ILE 16 13.447 17.404 -10.101 104 HG13 ILE 16 HG13 ILE 16 12.235 18.606 -9.776 105 HG21 ILE 16 HG21 ILE 16 11.450 15.043 -12.001 106 HG22 ILE 16 HG22 ILE 16 12.793 16.158 -12.311 107 HG23 ILE 16 HG23 ILE 16 12.802 15.114 -10.885 108 HD11 ILE 16 HD11 ILE 16 12.831 16.082 -8.266 109 HD12 ILE 16 HD12 ILE 16 12.762 17.731 -7.628 110 HD13 ILE 16 HD13 ILE 16 11.264 16.884 -8.054 111 H THR 17 H THR 17 10.574 17.458 -14.185 112 HA THR 17 HA THR 17 7.915 16.212 -14.341 113 HB THR 17 HB THR 17 10.102 17.153 -16.248 114 HG1 THR 17 HG1 THR 17 7.385 17.890 -15.973 115 HG21 THR 17 HG21 THR 17 8.634 16.554 -18.148 116 HG22 THR 17 HG22 THR 17 7.609 15.617 -17.008 117 HG23 THR 17 HG23 THR 17 9.293 15.159 -17.277 118 H LEU 18 H LEU 18 7.595 14.057 -14.874 119 HA LEU 18 HA LEU 18 9.957 12.226 -15.015 120 HB2 LEU 18 HB2 LEU 18 7.146 11.822 -13.881 121 HB3 LEU 18 HB3 LEU 18 8.241 10.515 -14.286 122 HG LEU 18 HG LEU 18 8.263 12.349 -11.922 123 HD11 LEU 18 HD11 LEU 18 9.096 10.195 -10.882 124 HD12 LEU 18 HD12 LEU 18 8.948 9.433 -12.512 125 HD13 LEU 18 HD13 LEU 18 7.536 10.072 -11.675 126 HD21 LEU 18 HD21 LEU 18 10.842 11.260 -13.100 127 HD22 LEU 18 HD22 LEU 18 10.676 11.978 -11.468 128 HD23 LEU 18 HD23 LEU 18 10.400 12.975 -12.903 129 H PHE 19 H PHE 19 9.816 10.537 -16.520 130 HA PHE 19 HA PHE 19 7.623 10.094 -18.288 131 HB2 PHE 19 HB2 PHE 19 8.531 10.967 -20.371 132 HB3 PHE 19 HB3 PHE 19 8.172 12.254 -19.276 133 HD1 PHE 19 HD1 PHE 19 10.711 10.829 -21.422 134 HD2 PHE 19 HD2 PHE 19 10.118 13.299 -17.936 135 HE1 PHE 19 HE1 PHE 19 12.840 12.017 -21.871 136 HE2 PHE 19 HE2 PHE 19 12.260 14.407 -18.351 137 HZ PHE 19 HZ PHE 19 13.643 13.795 -20.314 138 H VAL 20 H VAL 20 8.557 8.738 -20.293 139 HA VAL 20 HA VAL 20 10.972 7.212 -19.421 140 HB VAL 20 HB VAL 20 8.296 6.095 -20.350 141 HG11 VAL 20 HG11 VAL 20 10.230 4.768 -21.244 142 HG12 VAL 20 HG12 VAL 20 10.793 4.529 -19.576 143 HG13 VAL 20 HG13 VAL 20 9.217 3.888 -20.109 144 HG21 VAL 20 HG21 VAL 20 9.772 5.552 -17.732 145 HG22 VAL 20 HG22 VAL 20 8.500 6.755 -17.891 146 HG23 VAL 20 HG23 VAL 20 8.126 5.062 -18.211 147 H VAL 21 H VAL 21 12.238 6.445 -21.076 148 HA VAL 21 HA VAL 21 11.519 7.172 -23.871 149 HB VAL 21 HB VAL 21 14.082 7.940 -22.431 150 HG11 VAL 21 HG11 VAL 21 14.694 7.133 -24.634 151 HG12 VAL 21 HG12 VAL 21 13.362 8.050 -25.385 152 HG13 VAL 21 HG13 VAL 21 14.752 8.900 -24.673 153 HG21 VAL 21 HG21 VAL 21 11.932 9.637 -23.691 154 HG22 VAL 21 HG22 VAL 21 12.388 9.520 -21.972 155 HG23 VAL 21 HG23 VAL 21 13.518 10.225 -23.131 156 H ASN 22 H ASN 22 11.544 5.291 -24.875 157 HA ASN 22 HA ASN 22 11.936 3.198 -25.489 158 HB2 ASN 22 HB2 ASN 22 14.839 3.843 -24.920 159 HB3 ASN 22 HB3 ASN 22 14.263 2.432 -25.786 160 HD21 ASN 22 HD21 ASN 22 14.158 6.063 -25.981 161 HD22 ASN 22 HD22 ASN 22 14.119 6.099 -27.696 162 H ASN 23 H ASN 23 10.874 3.297 -23.091 163 HA ASN 23 HA ASN 23 10.341 2.255 -21.255 164 HB2 ASN 23 HB2 ASN 23 10.771 0.249 -22.832 165 HB3 ASN 23 HB3 ASN 23 12.158 -0.064 -21.782 166 HD21 ASN 23 HD21 ASN 23 8.638 0.709 -21.667 167 HD22 ASN 23 HD22 ASN 23 8.259 -0.364 -20.319 168 H ARG 24 H ARG 24 13.176 3.723 -21.451 169 HA ARG 24 HA ARG 24 14.181 2.863 -18.796 170 HB2 ARG 24 HB2 ARG 24 15.539 4.664 -20.795 171 HB3 ARG 24 HB3 ARG 24 16.198 3.939 -19.314 172 HG2 ARG 24 HG2 ARG 24 15.709 1.689 -20.319 173 HG3 ARG 24 HG3 ARG 24 15.551 2.519 -21.869 174 HD2 ARG 24 HD2 ARG 24 17.936 3.091 -20.097 175 HD3 ARG 24 HD3 ARG 24 17.849 1.603 -20.978 176 HE ARG 24 HE ARG 24 17.311 3.589 -22.868 177 HH11 ARG 24 HH11 ARG 24 19.957 2.614 -20.741 178 HH12 ARG 24 HH12 ARG 24 21.218 3.369 -21.623 179 HH21 ARG 24 HH21 ARG 24 18.928 4.510 -24.173 180 HH22 ARG 24 HH22 ARG 24 20.598 4.544 -23.675 181 H LEU 25 H LEU 25 13.749 4.035 -17.069 182 HA LEU 25 HA LEU 25 11.901 6.194 -17.155 183 HB2 LEU 25 HB2 LEU 25 12.685 4.412 -15.271 184 HB3 LEU 25 HB3 LEU 25 13.615 5.799 -14.723 185 HG LEU 25 HG LEU 25 10.591 5.625 -15.119 186 HD11 LEU 25 HD11 LEU 25 11.338 4.438 -13.169 187 HD12 LEU 25 HD12 LEU 25 10.632 5.965 -12.627 188 HD13 LEU 25 HD13 LEU 25 12.378 5.798 -12.659 189 HD21 LEU 25 HD21 LEU 25 11.164 7.925 -15.573 190 HD22 LEU 25 HD22 LEU 25 12.219 7.987 -14.131 191 HD23 LEU 25 HD23 LEU 25 10.457 7.803 -13.982 192 H GLN 26 H GLN 26 12.160 8.366 -17.425 193 HA GLN 26 HA GLN 26 14.802 9.612 -16.926 194 HB2 GLN 26 HB2 GLN 26 12.809 10.010 -19.197 195 HB3 GLN 26 HB3 GLN 26 14.194 11.073 -18.906 196 HG2 GLN 26 HG2 GLN 26 14.490 8.085 -19.452 197 HG3 GLN 26 HG3 GLN 26 14.483 9.313 -20.691 198 HE21 GLN 26 HE21 GLN 26 16.262 8.208 -17.749 199 HE22 GLN 26 HE22 GLN 26 17.766 8.987 -18.222 200 H TYR 27 H TYR 27 14.559 12.059 -16.777 201 HA TYR 27 HA TYR 27 12.085 13.065 -15.828 202 HB2 TYR 27 HB2 TYR 27 12.859 13.716 -13.607 203 HB3 TYR 27 HB3 TYR 27 12.793 11.982 -13.767 204 HD1 TYR 27 HD1 TYR 27 14.961 10.649 -14.041 205 HD2 TYR 27 HD2 TYR 27 14.864 14.806 -12.870 206 HE1 TYR 27 HE1 TYR 27 17.217 10.434 -13.111 207 HE2 TYR 27 HE2 TYR 27 17.088 14.577 -11.846 208 HH TYR 27 HH TYR 27 19.071 11.722 -12.529 209 H GLU 28 H GLU 28 12.323 15.484 -15.538 210 HA GLU 28 HA GLU 28 14.817 16.560 -16.553 211 HB2 GLU 28 HB2 GLU 28 13.453 16.222 -18.553 212 HB3 GLU 28 HB3 GLU 28 12.055 16.971 -17.759 213 HG2 GLU 28 HG2 GLU 28 13.149 18.529 -19.273 214 HG3 GLU 28 HG3 GLU 28 13.228 19.067 -17.599 215 H THR 29 H THR 29 15.408 18.291 -15.416 216 HA THR 29 HA THR 29 13.546 20.074 -14.241 217 HB THR 29 HB THR 29 13.375 18.220 -12.638 218 HG1 THR 29 HG1 THR 29 13.106 20.089 -11.750 219 HG21 THR 29 HG21 THR 29 16.319 18.596 -11.998 220 HG22 THR 29 HG22 THR 29 15.749 17.290 -13.053 221 HG23 THR 29 HG23 THR 29 15.210 17.347 -11.384 222 H SER 30 H SER 30 14.732 21.883 -13.345 223 HA SER 30 HA SER 30 17.646 21.997 -13.892 224 HB2 SER 30 HB2 SER 30 15.648 24.136 -14.718 225 HB3 SER 30 HB3 SER 30 17.372 24.062 -15.132 226 HG SER 30 HG SER 30 16.861 22.140 -16.366 227 H ARG 31 H ARG 31 16.574 21.601 -11.400 228 HA ARG 31 HA ARG 31 16.941 24.238 -10.064 229 HB2 ARG 31 HB2 ARG 31 15.237 23.510 -8.434 230 HB3 ARG 31 HB3 ARG 31 14.604 23.623 -10.065 231 HG2 ARG 31 HG2 ARG 31 13.812 21.572 -9.880 232 HG3 ARG 31 HG3 ARG 31 15.444 20.943 -9.879 233 HD2 ARG 31 HD2 ARG 31 14.343 20.004 -8.004 234 HD3 ARG 31 HD3 ARG 31 15.565 21.136 -7.418 235 HE ARG 31 HE ARG 31 12.650 21.776 -7.670 236 HH11 ARG 31 HH11 ARG 31 15.591 21.846 -5.617 237 HH12 ARG 31 HH12 ARG 31 14.763 22.509 -4.271 238 HH21 ARG 31 HH21 ARG 31 11.651 22.876 -6.006 239 HH22 ARG 31 HH22 ARG 31 12.461 23.175 -4.498 240 H ASP 32 H ASP 32 17.948 24.185 -8.031 241 HA ASP 32 HA ASP 32 19.934 22.042 -7.743 242 HB2 ASP 32 HB2 ASP 32 19.483 24.692 -6.318 243 HB3 ASP 32 HB3 ASP 32 20.807 23.592 -5.948 244 H SER 33 H SER 33 20.447 21.547 -5.390 245 HA SER 33 HA SER 33 20.010 20.064 -3.778 246 HB2 SER 33 HB2 SER 33 18.327 22.415 -2.859 247 HB3 SER 33 HB3 SER 33 19.045 21.159 -1.831 248 HG SER 33 HG SER 33 21.107 21.817 -2.759 249 H ILE 34 H ILE 34 18.614 18.954 -5.703 250 HA ILE 34 HA ILE 34 15.848 18.672 -5.301 251 HB ILE 34 HB ILE 34 18.018 17.079 -6.612 252 HG12 ILE 34 HG12 ILE 34 15.197 17.719 -7.592 253 HG13 ILE 34 HG13 ILE 34 16.502 18.923 -7.593 254 HG21 ILE 34 HG21 ILE 34 16.933 15.206 -5.471 255 HG22 ILE 34 HG22 ILE 34 15.348 15.741 -5.995 256 HG23 ILE 34 HG23 ILE 34 16.525 15.170 -7.192 257 HD11 ILE 34 HD11 ILE 34 16.484 18.054 -9.730 258 HD12 ILE 34 HD12 ILE 34 17.855 17.247 -8.956 259 HD13 ILE 34 HD13 ILE 34 16.310 16.368 -9.192 260 HA PRO 35 HA PRO 35 15.722 16.564 -1.422 261 HB2 PRO 35 HB2 PRO 35 13.311 15.241 -1.685 262 HB3 PRO 35 HB3 PRO 35 13.463 16.989 -1.253 263 HG2 PRO 35 HG2 PRO 35 12.892 15.650 -3.855 264 HG3 PRO 35 HG3 PRO 35 12.156 17.141 -3.244 265 HD2 PRO 35 HD2 PRO 35 14.095 17.208 -5.105 266 HD3 PRO 35 HD3 PRO 35 14.010 18.442 -3.831 267 H THR 36 H THR 36 17.283 15.001 -1.400 268 HA THR 36 HA THR 36 17.665 12.912 -3.236 269 HB THR 36 HB THR 36 18.542 12.980 -0.332 270 HG1 THR 36 HG1 THR 36 19.381 14.612 -2.496 271 HG21 THR 36 HG21 THR 36 20.693 12.129 -1.288 272 HG22 THR 36 HG22 THR 36 19.908 12.005 -2.879 273 HG23 THR 36 HG23 THR 36 19.336 11.020 -1.508 274 H GLU 37 H GLU 37 15.462 13.136 -0.583 275 HA GLU 37 HA GLU 37 14.970 10.358 -0.088 276 HB2 GLU 37 HB2 GLU 37 12.887 11.296 1.010 277 HB3 GLU 37 HB3 GLU 37 14.433 11.906 1.586 278 HG2 GLU 37 HG2 GLU 37 14.081 13.976 0.160 279 HG3 GLU 37 HG3 GLU 37 12.475 13.365 -0.231 280 H LEU 38 H LEU 38 13.210 12.812 -2.103 281 HA LEU 38 HA LEU 38 11.419 10.813 -3.138 282 HB2 LEU 38 HB2 LEU 38 11.059 13.372 -2.929 283 HB3 LEU 38 HB3 LEU 38 11.970 13.502 -4.393 284 HG LEU 38 HG LEU 38 9.187 13.032 -3.978 285 HD11 LEU 38 HD11 LEU 38 10.880 13.347 -6.455 286 HD12 LEU 38 HD12 LEU 38 9.784 14.499 -5.674 287 HD13 LEU 38 HD13 LEU 38 9.107 13.157 -6.535 288 HD21 LEU 38 HD21 LEU 38 8.565 11.284 -5.410 289 HD22 LEU 38 HD22 LEU 38 9.494 10.651 -4.063 290 HD23 LEU 38 HD23 LEU 38 10.245 10.785 -5.685 291 H LEU 39 H LEU 39 14.488 12.283 -4.185 292 HA LEU 39 HA LEU 39 14.694 11.246 -6.787 293 HB2 LEU 39 HB2 LEU 39 16.306 12.721 -5.187 294 HB3 LEU 39 HB3 LEU 39 17.147 11.189 -5.046 295 HG LEU 39 HG LEU 39 16.518 12.790 -7.517 296 HD11 LEU 39 HD11 LEU 39 18.374 13.567 -6.044 297 HD12 LEU 39 HD12 LEU 39 18.975 13.056 -7.629 298 HD13 LEU 39 HD13 LEU 39 19.157 11.992 -6.209 299 HD21 LEU 39 HD21 LEU 39 17.725 11.303 -8.939 300 HD22 LEU 39 HD22 LEU 39 16.503 10.324 -8.127 301 HD23 LEU 39 HD23 LEU 39 18.198 10.260 -7.592 302 H ASN 40 H ASN 40 15.495 9.877 -3.662 303 HA ASN 40 HA ASN 40 16.428 7.262 -4.500 304 HB2 ASN 40 HB2 ASN 40 15.547 8.419 -1.868 305 HB3 ASN 40 HB3 ASN 40 15.347 6.686 -2.081 306 HD21 ASN 40 HD21 ASN 40 17.481 8.729 -0.718 307 HD22 ASN 40 HD22 ASN 40 18.987 7.933 -1.170 308 H LYS 41 H LYS 41 13.176 8.472 -3.510 309 HA LYS 41 HA LYS 41 11.845 5.996 -3.687 310 HB2 LYS 41 HB2 LYS 41 10.800 7.884 -2.624 311 HB3 LYS 41 HB3 LYS 41 10.783 8.806 -4.132 312 HG2 LYS 41 HG2 LYS 41 9.081 7.580 -5.076 313 HG3 LYS 41 HG3 LYS 41 9.496 6.135 -4.127 314 HD2 LYS 41 HD2 LYS 41 7.375 6.827 -3.467 315 HD3 LYS 41 HD3 LYS 41 8.490 7.072 -2.130 316 HE2 LYS 41 HE2 LYS 41 8.530 9.455 -2.492 317 HE3 LYS 41 HE3 LYS 41 7.768 9.291 -4.080 318 HZ1 LYS 41 HZ1 LYS 41 6.275 10.091 -2.447 319 HZ2 LYS 41 HZ2 LYS 41 6.381 8.694 -1.525 320 HZ3 LYS 41 HZ3 LYS 41 5.718 8.761 -3.059 321 H TRP 42 H TRP 42 12.691 8.280 -6.342 322 HA TRP 42 HA TRP 42 11.164 6.994 -8.321 323 HB2 TRP 42 HB2 TRP 42 13.913 8.230 -8.700 324 HB3 TRP 42 HB3 TRP 42 12.728 7.917 -9.947 325 HD1 TRP 42 HD1 TRP 42 10.300 9.200 -8.018 326 HE1 TRP 42 HE1 TRP 42 10.106 11.749 -7.931 327 HE3 TRP 42 HE3 TRP 42 14.932 10.353 -9.792 328 HZ2 TRP 42 HZ2 TRP 42 11.839 14.006 -8.399 329 HZ3 TRP 42 HZ3 TRP 42 15.606 12.766 -10.011 330 HH2 TRP 42 HH2 TRP 42 14.127 14.545 -9.211 331 H LYS 43 H LYS 43 14.538 6.298 -7.248 332 HA LYS 43 HA LYS 43 14.797 4.129 -9.197 333 HB2 LYS 43 HB2 LYS 43 16.927 3.622 -8.061 334 HB3 LYS 43 HB3 LYS 43 16.797 5.264 -8.675 335 HG2 LYS 43 HG2 LYS 43 16.430 6.192 -6.524 336 HG3 LYS 43 HG3 LYS 43 16.282 4.574 -5.759 337 HD2 LYS 43 HD2 LYS 43 18.801 5.650 -7.053 338 HD3 LYS 43 HD3 LYS 43 18.448 5.704 -5.317 339 HE2 LYS 43 HE2 LYS 43 18.280 3.233 -5.250 340 HE3 LYS 43 HE3 LYS 43 18.675 3.158 -6.973 341 HZ1 LYS 43 HZ1 LYS 43 20.603 2.782 -5.707 342 HZ2 LYS 43 HZ2 LYS 43 20.417 4.146 -4.805 343 HZ3 LYS 43 HZ3 LYS 43 20.797 4.255 -6.420 344 H GLN 44 H GLN 44 13.561 4.396 -5.949 345 HA GLN 44 HA GLN 44 13.790 1.649 -5.158 346 HB2 GLN 44 HB2 GLN 44 13.313 3.474 -3.542 347 HB3 GLN 44 HB3 GLN 44 11.808 3.828 -4.368 348 HG2 GLN 44 HG2 GLN 44 11.062 2.678 -2.523 349 HG3 GLN 44 HG3 GLN 44 11.015 1.471 -3.770 350 HE21 GLN 44 HE21 GLN 44 11.814 -0.486 -3.171 351 HE22 GLN 44 HE22 GLN 44 13.033 -0.782 -1.957 352 H HIS 45 H HIS 45 11.201 3.506 -6.895 353 HA HIS 45 HA HIS 45 9.864 0.896 -7.505 354 HB2 HIS 45 HB2 HIS 45 8.635 3.656 -7.348 355 HB3 HIS 45 HB3 HIS 45 7.796 2.123 -7.546 356 HD1 HIS 45 HD1 HIS 45 7.851 0.446 -5.340 357 HD2 HIS 45 HD2 HIS 45 9.007 4.440 -4.961 358 HE1 HIS 45 HE1 HIS 45 7.875 0.928 -2.839 359 H LYS 46 H LYS 46 12.038 1.706 -9.130 360 HA LYS 46 HA LYS 46 11.454 3.303 -11.323 361 HB2 LYS 46 HB2 LYS 46 13.680 2.182 -10.778 362 HB3 LYS 46 HB3 LYS 46 13.054 0.714 -11.548 363 HG2 LYS 46 HG2 LYS 46 12.534 2.323 -13.555 364 HG3 LYS 46 HG3 LYS 46 13.585 3.447 -12.749 365 HD2 LYS 46 HD2 LYS 46 15.358 1.525 -12.814 366 HD3 LYS 46 HD3 LYS 46 14.242 0.727 -13.920 367 HE2 LYS 46 HE2 LYS 46 15.807 1.880 -15.284 368 HE3 LYS 46 HE3 LYS 46 14.340 2.845 -15.348 369 HZ1 LYS 46 HZ1 LYS 46 16.727 3.373 -13.688 370 HZ2 LYS 46 HZ2 LYS 46 15.390 4.280 -13.588 371 HZ3 LYS 46 HZ3 LYS 46 16.239 4.253 -15.002 372 H GLN 47 H GLN 47 10.968 -0.320 -11.361 373 HA GLN 47 HA GLN 47 9.702 -0.256 -13.903 374 HB2 GLN 47 HB2 GLN 47 10.300 -2.239 -11.880 375 HB3 GLN 47 HB3 GLN 47 8.674 -2.494 -12.441 376 HG2 GLN 47 HG2 GLN 47 10.874 -2.055 -14.489 377 HG3 GLN 47 HG3 GLN 47 10.754 -3.593 -13.652 378 HE21 GLN 47 HE21 GLN 47 8.761 -1.350 -15.722 379 HE22 GLN 47 HE22 GLN 47 7.637 -2.624 -16.172 380 H GLU 48 H GLU 48 8.339 0.250 -10.705 381 HA GLU 48 HA GLU 48 5.588 -0.031 -11.565 382 HB2 GLU 48 HB2 GLU 48 6.263 1.676 -9.179 383 HB3 GLU 48 HB3 GLU 48 4.923 0.561 -9.440 384 HG2 GLU 48 HG2 GLU 48 6.773 -1.308 -9.433 385 HG3 GLU 48 HG3 GLU 48 7.794 -0.030 -8.736 386 H LEU 49 H LEU 49 7.804 2.745 -11.222 387 HA LEU 49 HA LEU 49 5.882 4.760 -11.995 388 HB2 LEU 49 HB2 LEU 49 8.921 4.640 -12.179 389 HB3 LEU 49 HB3 LEU 49 8.018 6.052 -12.647 390 HG LEU 49 HG LEU 49 7.498 4.920 -9.895 391 HD11 LEU 49 HD11 LEU 49 9.856 6.735 -10.509 392 HD12 LEU 49 HD12 LEU 49 10.001 4.976 -10.285 393 HD13 LEU 49 HD13 LEU 49 9.392 5.977 -8.956 394 HD21 LEU 49 HD21 LEU 49 7.336 7.351 -9.457 395 HD22 LEU 49 HD22 LEU 49 6.158 6.832 -10.658 396 HD23 LEU 49 HD23 LEU 49 7.627 7.710 -11.146 397 H ILE 50 H ILE 50 8.310 2.844 -13.748 398 HA ILE 50 HA ILE 50 7.920 4.119 -16.275 399 HB ILE 50 HB ILE 50 8.700 1.245 -15.581 400 HG12 ILE 50 HG12 ILE 50 10.512 3.368 -16.806 401 HG13 ILE 50 HG13 ILE 50 10.238 3.330 -15.065 402 HG21 ILE 50 HG21 ILE 50 7.763 1.137 -17.841 403 HG22 ILE 50 HG22 ILE 50 8.689 2.551 -18.341 404 HG23 ILE 50 HG23 ILE 50 9.520 1.023 -17.976 405 HD11 ILE 50 HD11 ILE 50 12.273 2.113 -15.695 406 HD12 ILE 50 HD12 ILE 50 11.092 1.059 -14.894 407 HD13 ILE 50 HD13 ILE 50 11.326 0.983 -16.659 408 H ASP 51 H ASP 51 6.320 1.246 -14.902 409 HA ASP 51 HA ASP 51 4.591 0.655 -16.979 410 HB2 ASP 51 HB2 ASP 51 5.098 -0.399 -14.636 411 HB3 ASP 51 HB3 ASP 51 3.793 0.600 -14.051 412 H PHE 52 H PHE 52 4.266 3.115 -14.482 413 HA PHE 52 HA PHE 52 1.612 3.937 -15.273 414 HB2 PHE 52 HB2 PHE 52 2.362 4.225 -13.026 415 HB3 PHE 52 HB3 PHE 52 3.699 5.250 -13.526 416 HD1 PHE 52 HD1 PHE 52 3.432 7.597 -13.844 417 HD2 PHE 52 HD2 PHE 52 -0.062 5.118 -13.414 418 HE1 PHE 52 HE1 PHE 52 1.995 9.629 -13.635 419 HE2 PHE 52 HE2 PHE 52 -1.460 7.152 -13.164 420 HZ PHE 52 HZ PHE 52 -0.389 9.408 -13.221 421 H LEU 53 H LEU 53 4.825 5.606 -15.609 422 HA LEU 53 HA LEU 53 3.859 7.791 -17.142 423 HB2 LEU 53 HB2 LEU 53 6.551 6.413 -16.929 424 HB3 LEU 53 HB3 LEU 53 6.304 7.722 -18.064 425 HG LEU 53 HG LEU 53 7.347 8.731 -16.341 426 HD11 LEU 53 HD11 LEU 53 4.442 9.383 -15.724 427 HD12 LEU 53 HD12 LEU 53 5.346 9.998 -17.128 428 HD13 LEU 53 HD13 LEU 53 5.851 10.429 -15.494 429 HD21 LEU 53 HD21 LEU 53 5.542 7.415 -14.323 430 HD22 LEU 53 HD22 LEU 53 6.739 8.664 -13.956 431 HD23 LEU 53 HD23 LEU 53 7.258 7.103 -14.620 432 H ASN 54 H ASN 54 4.497 4.476 -18.086 433 HA ASN 54 HA ASN 54 4.653 5.110 -20.929 434 HB2 ASN 54 HB2 ASN 54 5.574 3.014 -19.513 435 HB3 ASN 54 HB3 ASN 54 4.035 2.312 -19.972 436 HD21 ASN 54 HD21 ASN 54 7.095 2.396 -20.737 437 HD22 ASN 54 HD22 ASN 54 7.049 2.273 -22.504 438 H GLN 55 H GLN 55 2.235 3.341 -18.827 439 HA GLN 55 HA GLN 55 0.270 3.380 -20.850 440 HB2 GLN 55 HB2 GLN 55 -1.268 2.571 -19.230 441 HB3 GLN 55 HB3 GLN 55 0.315 1.828 -18.982 442 HG2 GLN 55 HG2 GLN 55 -0.412 2.213 -16.836 443 HG3 GLN 55 HG3 GLN 55 0.692 3.532 -17.160 444 HE21 GLN 55 HE21 GLN 55 0.041 5.529 -16.511 445 HE22 GLN 55 HE22 GLN 55 -1.632 5.940 -16.163 446 H LEU 56 H LEU 56 1.270 5.945 -18.740 447 HA LEU 56 HA LEU 56 -1.068 7.525 -18.616 448 HB2 LEU 56 HB2 LEU 56 0.890 7.861 -17.208 449 HB3 LEU 56 HB3 LEU 56 1.907 8.148 -18.623 450 HG LEU 56 HG LEU 56 0.707 10.293 -19.034 451 HD11 LEU 56 HD11 LEU 56 -1.455 9.762 -17.952 452 HD12 LEU 56 HD12 LEU 56 -0.741 11.190 -17.216 453 HD13 LEU 56 HD13 LEU 56 -0.658 9.616 -16.377 454 HD21 LEU 56 HD21 LEU 56 1.947 9.867 -16.282 455 HD22 LEU 56 HD22 LEU 56 1.741 11.443 -17.093 456 HD23 LEU 56 HD23 LEU 56 2.794 10.225 -17.802 457 H ASP 57 H ASP 57 1.168 6.961 -21.259 458 HA ASP 57 HA ASP 57 -0.310 9.006 -22.877 459 HB2 ASP 57 HB2 ASP 57 2.263 9.316 -21.980 460 HB3 ASP 57 HB3 ASP 57 2.565 8.497 -23.497 461 H SER 58 H SER 58 1.568 5.947 -22.910 462 HA SER 58 HA SER 58 0.950 5.357 -25.690 463 HB2 SER 58 HB2 SER 58 3.026 4.677 -24.249 464 HB3 SER 58 HB3 SER 58 1.970 3.420 -23.580 465 HG SER 58 HG SER 58 2.714 2.378 -25.253 466 H GLU 59 H GLU 59 -0.315 4.533 -22.464 467 HA GLU 59 HA GLU 59 -1.908 3.386 -21.614 468 HB2 GLU 59 HB2 GLU 59 -3.036 5.244 -23.200 469 HB3 GLU 59 HB3 GLU 59 -3.798 3.793 -23.860 470 HG2 GLU 59 HG2 GLU 59 -4.296 3.131 -21.421 471 HG3 GLU 59 HG3 GLU 59 -3.739 4.733 -20.961 472 H GLU 60 H GLU 60 -0.428 1.945 -24.122 473 HA GLU 60 HA GLU 60 -2.198 -0.400 -24.300 474 HB2 GLU 60 HB2 GLU 60 0.491 0.334 -25.513 475 HB3 GLU 60 HB3 GLU 60 -0.234 -1.272 -25.685 476 HG2 GLU 60 HG2 GLU 60 -2.225 -0.289 -26.744 477 HG3 GLU 60 HG3 GLU 60 -1.537 1.330 -26.573 478 H GLN 61 H GLN 61 1.272 0.010 -23.530 479 HA GLN 61 HA GLN 61 1.396 -2.500 -22.175 480 HB2 GLN 61 HB2 GLN 61 3.712 -1.820 -21.614 481 HB3 GLN 61 HB3 GLN 61 3.303 -1.875 -23.320 482 HG2 GLN 61 HG2 GLN 61 2.916 0.833 -22.207 483 HG3 GLN 61 HG3 GLN 61 4.536 0.224 -21.938 484 HE21 GLN 61 HE21 GLN 61 5.948 0.014 -23.680 485 HE22 GLN 61 HE22 GLN 61 5.542 0.630 -25.293 486 H THR 62 H THR 62 -0.029 -2.601 -20.480 487 HA THR 62 HA THR 62 0.395 -0.778 -18.186 488 HB THR 62 HB THR 62 -1.763 -1.941 -17.410 489 HG1 THR 62 HG1 THR 62 -2.353 -3.530 -18.647 490 HG21 THR 62 HG21 THR 62 -3.155 -0.495 -18.844 491 HG22 THR 62 HG22 THR 62 -1.810 -0.283 -19.979 492 HG23 THR 62 HG23 THR 62 -1.699 0.344 -18.315 493 H LYS 63 H LYS 63 2.124 -3.242 -19.187 494 HA LYS 63 HA LYS 63 2.905 -4.135 -16.612 495 HB2 LYS 63 HB2 LYS 63 2.639 -6.538 -17.007 496 HB3 LYS 63 HB3 LYS 63 1.066 -5.749 -16.893 497 HG2 LYS 63 HG2 LYS 63 0.883 -5.744 -19.356 498 HG3 LYS 63 HG3 LYS 63 2.430 -6.577 -19.502 499 HD2 LYS 63 HD2 LYS 63 -0.083 -7.623 -18.140 500 HD3 LYS 63 HD3 LYS 63 0.488 -8.088 -19.729 501 HE2 LYS 63 HE2 LYS 63 1.947 -8.650 -17.126 502 HE3 LYS 63 HE3 LYS 63 1.010 -9.801 -18.074 503 HZ1 LYS 63 HZ1 LYS 63 3.532 -8.491 -18.858 504 HZ2 LYS 63 HZ2 LYS 63 2.587 -9.322 -19.933 505 HZ3 LYS 63 HZ3 LYS 63 3.251 -10.104 -18.655 Start of MODEL 3 1 H1 GLY 1 H GLY 1 0.896 -1.011 -0.027 2 HA2 GLY 1 HA2 GLY 1 3.075 -0.956 -1.115 3 HA3 GLY 1 HA3 GLY 1 1.795 -0.688 -2.317 4 H ILE 2 H ILE 2 2.230 0.988 -3.658 5 HA ILE 2 HA ILE 2 2.987 3.563 -2.752 6 HB ILE 2 HB ILE 2 5.285 2.588 -2.949 7 HG12 ILE 2 HG12 ILE 2 6.299 4.082 -4.394 8 HG13 ILE 2 HG13 ILE 2 4.824 4.378 -5.332 9 HG21 ILE 2 HG21 ILE 2 5.202 0.757 -4.454 10 HG22 ILE 2 HG22 ILE 2 4.259 1.628 -5.635 11 HG23 ILE 2 HG23 ILE 2 5.941 2.000 -5.466 12 HD11 ILE 2 HD11 ILE 2 5.401 6.242 -3.829 13 HD12 ILE 2 HD12 ILE 2 3.827 5.569 -3.425 14 HD13 ILE 2 HD13 ILE 2 5.248 5.167 -2.421 15 H ASP 3 H ASP 3 2.468 5.087 -4.535 16 HA ASP 3 HA ASP 3 0.863 3.837 -6.684 17 HB2 ASP 3 HB2 ASP 3 0.276 6.492 -5.440 18 HB3 ASP 3 HB3 ASP 3 -0.777 5.450 -6.384 19 H ALA 4 H ALA 4 1.860 4.289 -8.543 20 HA ALA 4 HA ALA 4 4.145 5.907 -8.763 21 HB1 ALA 4 HB1 ALA 4 2.229 4.866 -10.867 22 HB2 ALA 4 HB2 ALA 4 3.813 5.606 -11.215 23 HB3 ALA 4 HB3 ALA 4 3.725 4.087 -10.316 24 H ALA 5 H ALA 5 0.721 6.761 -9.485 25 HA ALA 5 HA ALA 5 1.281 9.291 -10.674 26 HB1 ALA 5 HB1 ALA 5 -0.966 8.126 -10.741 27 HB2 ALA 5 HB2 ALA 5 -1.173 8.575 -9.029 28 HB3 ALA 5 HB3 ALA 5 -1.036 9.828 -10.258 29 H GLN 6 H GLN 6 0.900 8.310 -7.320 30 HA GLN 6 HA GLN 6 0.847 10.951 -6.207 31 HB2 GLN 6 HB2 GLN 6 1.669 8.239 -5.100 32 HB3 GLN 6 HB3 GLN 6 1.743 9.678 -4.132 33 HG2 GLN 6 HG2 GLN 6 -0.858 8.899 -5.500 34 HG3 GLN 6 HG3 GLN 6 -0.354 8.139 -3.997 35 HE21 GLN 6 HE21 GLN 6 -1.158 11.305 -5.427 36 HE22 GLN 6 HE22 GLN 6 -1.445 12.120 -3.924 37 H ILE 7 H ILE 7 3.526 8.726 -7.108 38 HA ILE 7 HA ILE 7 5.578 10.411 -6.008 39 HB ILE 7 HB ILE 7 5.773 8.302 -8.154 40 HG12 ILE 7 HG12 ILE 7 6.434 7.974 -5.225 41 HG13 ILE 7 HG13 ILE 7 4.910 7.450 -5.941 42 HG21 ILE 7 HG21 ILE 7 7.745 9.743 -8.211 43 HG22 ILE 7 HG22 ILE 7 7.845 9.767 -6.436 44 HG23 ILE 7 HG23 ILE 7 8.248 8.304 -7.343 45 HD11 ILE 7 HD11 ILE 7 7.512 6.394 -7.120 46 HD12 ILE 7 HD12 ILE 7 6.836 5.721 -5.679 47 HD13 ILE 7 HD13 ILE 7 5.877 5.727 -7.180 48 H VAL 8 H VAL 8 4.073 10.171 -9.251 49 HA VAL 8 HA VAL 8 5.943 11.980 -10.498 50 HB VAL 8 HB VAL 8 3.114 11.105 -11.225 51 HG11 VAL 8 HG11 VAL 8 3.435 13.200 -12.376 52 HG12 VAL 8 HG12 VAL 8 5.091 12.768 -12.847 53 HG13 VAL 8 HG13 VAL 8 3.700 11.904 -13.541 54 HG21 VAL 8 HG21 VAL 8 4.318 9.751 -12.935 55 HG22 VAL 8 HG22 VAL 8 5.855 10.332 -12.292 56 HG23 VAL 8 HG23 VAL 8 4.806 9.303 -11.296 57 H ASP 9 H ASP 9 2.790 12.430 -8.863 58 HA ASP 9 HA ASP 9 2.461 15.176 -9.446 59 HB2 ASP 9 HB2 ASP 9 0.698 13.671 -8.628 60 HB3 ASP 9 HB3 ASP 9 1.554 13.511 -7.087 61 H GLU 10 H GLU 10 3.871 13.619 -6.477 62 HA GLU 10 HA GLU 10 4.613 16.145 -5.361 63 HB2 GLU 10 HB2 GLU 10 6.023 14.887 -3.809 64 HB3 GLU 10 HB3 GLU 10 4.423 14.168 -3.966 65 HG2 GLU 10 HG2 GLU 10 5.400 12.544 -5.615 66 HG3 GLU 10 HG3 GLU 10 6.980 13.183 -5.280 67 H ALA 11 H ALA 11 6.268 14.065 -7.744 68 HA ALA 11 HA ALA 11 8.846 15.333 -7.390 69 HB1 ALA 11 HB1 ALA 11 9.367 14.313 -9.602 70 HB2 ALA 11 HB2 ALA 11 8.572 13.135 -8.529 71 HB3 ALA 11 HB3 ALA 11 7.656 13.918 -9.835 72 H LEU 12 H LEU 12 5.984 15.871 -9.476 73 HA LEU 12 HA LEU 12 7.082 18.038 -10.965 74 HB2 LEU 12 HB2 LEU 12 4.231 17.231 -10.314 75 HB3 LEU 12 HB3 LEU 12 4.592 18.599 -11.353 76 HG LEU 12 HG LEU 12 5.661 15.806 -11.956 77 HD11 LEU 12 HD11 LEU 12 3.119 17.113 -13.029 78 HD12 LEU 12 HD12 LEU 12 3.186 15.771 -11.874 79 HD13 LEU 12 HD13 LEU 12 3.792 15.533 -13.512 80 HD21 LEU 12 HD21 LEU 12 5.919 16.643 -14.237 81 HD22 LEU 12 HD22 LEU 12 6.842 17.640 -13.131 82 HD23 LEU 12 HD23 LEU 12 5.283 18.232 -13.763 83 H GLU 13 H GLU 13 5.476 17.894 -7.784 84 HA GLU 13 HA GLU 13 5.078 20.683 -7.459 85 HB2 GLU 13 HB2 GLU 13 5.473 18.387 -5.508 86 HB3 GLU 13 HB3 GLU 13 5.291 20.065 -4.965 87 HG2 GLU 13 HG2 GLU 13 3.180 20.190 -6.302 88 HG3 GLU 13 HG3 GLU 13 3.278 18.462 -6.581 89 H GLN 14 H GLN 14 8.065 18.878 -7.408 90 HA GLN 14 HA GLN 14 9.464 21.137 -6.022 91 HB2 GLN 14 HB2 GLN 14 11.017 18.855 -7.034 92 HB3 GLN 14 HB3 GLN 14 11.228 19.761 -5.562 93 HG2 GLN 14 HG2 GLN 14 9.267 17.517 -6.083 94 HG3 GLN 14 HG3 GLN 14 10.776 17.395 -5.224 95 HE21 GLN 14 HE21 GLN 14 7.928 16.915 -4.428 96 HE22 GLN 14 HE22 GLN 14 8.095 17.421 -2.744 97 H GLY 15 H GLY 15 8.414 20.267 -9.058 98 HA2 GLY 15 HA2 GLY 15 8.800 21.420 -11.040 99 HA3 GLY 15 HA3 GLY 15 10.378 21.960 -10.452 100 H ILE 16 H ILE 16 9.651 18.489 -10.095 101 HA ILE 16 HA ILE 16 11.551 17.998 -12.309 102 HB ILE 16 HB ILE 16 10.876 16.124 -10.042 103 HG12 ILE 16 HG12 ILE 16 13.639 17.147 -10.021 104 HG13 ILE 16 HG13 ILE 16 12.510 18.463 -9.812 105 HG21 ILE 16 HG21 ILE 16 12.981 16.093 -12.257 106 HG22 ILE 16 HG22 ILE 16 13.002 14.997 -10.877 107 HG23 ILE 16 HG23 ILE 16 11.654 14.942 -11.998 108 HD11 ILE 16 HD11 ILE 16 12.997 17.684 -7.640 109 HD12 ILE 16 HD12 ILE 16 11.366 17.037 -8.004 110 HD13 ILE 16 HD13 ILE 16 12.793 15.994 -8.092 111 H THR 17 H THR 17 10.912 17.186 -14.082 112 HA THR 17 HA THR 17 8.221 16.118 -14.471 113 HB THR 17 HB THR 17 10.619 16.839 -16.192 114 HG1 THR 17 HG1 THR 17 9.542 18.623 -16.653 115 HG21 THR 17 HG21 THR 17 7.867 16.061 -17.191 116 HG22 THR 17 HG22 THR 17 9.292 15.014 -17.216 117 HG23 THR 17 HG23 THR 17 9.321 16.517 -18.153 118 H LEU 18 H LEU 18 7.762 13.968 -14.713 119 HA LEU 18 HA LEU 18 10.029 12.048 -14.850 120 HB2 LEU 18 HB2 LEU 18 7.183 11.851 -13.748 121 HB3 LEU 18 HB3 LEU 18 8.161 10.467 -14.116 122 HG LEU 18 HG LEU 18 8.161 12.124 -11.726 123 HD11 LEU 18 HD11 LEU 18 7.878 9.649 -11.863 124 HD12 LEU 18 HD12 LEU 18 9.217 10.098 -10.791 125 HD13 LEU 18 HD13 LEU 18 9.533 9.483 -12.438 126 HD21 LEU 18 HD21 LEU 18 10.206 13.146 -12.689 127 HD22 LEU 18 HD22 LEU 18 10.884 11.517 -12.914 128 HD23 LEU 18 HD23 LEU 18 10.582 12.139 -11.275 129 H PHE 19 H PHE 19 9.981 10.476 -16.396 130 HA PHE 19 HA PHE 19 7.802 10.038 -18.202 131 HB2 PHE 19 HB2 PHE 19 8.879 10.874 -20.243 132 HB3 PHE 19 HB3 PHE 19 8.521 12.176 -19.151 133 HD1 PHE 19 HD1 PHE 19 11.192 10.429 -20.962 134 HD2 PHE 19 HD2 PHE 19 10.355 13.282 -17.843 135 HE1 PHE 19 HE1 PHE 19 13.519 11.276 -21.090 136 HE2 PHE 19 HE2 PHE 19 12.633 14.174 -18.039 137 HZ PHE 19 HZ PHE 19 14.262 13.158 -19.596 138 H VAL 20 H VAL 20 8.924 8.747 -20.148 139 HA VAL 20 HA VAL 20 11.176 7.088 -19.210 140 HB VAL 20 HB VAL 20 8.575 6.055 -20.322 141 HG11 VAL 20 HG11 VAL 20 10.557 4.700 -20.983 142 HG12 VAL 20 HG12 VAL 20 10.854 4.369 -19.249 143 HG13 VAL 20 HG13 VAL 20 9.366 3.813 -20.047 144 HG21 VAL 20 HG21 VAL 20 9.597 5.495 -17.501 145 HG22 VAL 20 HG22 VAL 20 8.354 6.691 -17.886 146 HG23 VAL 20 HG23 VAL 20 8.035 5.005 -18.227 147 H VAL 21 H VAL 21 12.508 6.694 -20.991 148 HA VAL 21 HA VAL 21 11.459 7.257 -23.697 149 HB VAL 21 HB VAL 21 12.449 9.300 -23.059 150 HG11 VAL 21 HG11 VAL 21 14.942 7.801 -22.179 151 HG12 VAL 21 HG12 VAL 21 14.819 9.559 -22.379 152 HG13 VAL 21 HG13 VAL 21 13.825 8.749 -21.166 153 HG21 VAL 21 HG21 VAL 21 14.528 7.855 -24.736 154 HG22 VAL 21 HG22 VAL 21 12.948 8.419 -25.342 155 HG23 VAL 21 HG23 VAL 21 14.124 9.580 -24.739 156 H ASN 22 H ASN 22 12.224 5.732 -25.195 157 HA ASN 22 HA ASN 22 12.960 3.646 -25.809 158 HB2 ASN 22 HB2 ASN 22 15.445 4.769 -24.438 159 HB3 ASN 22 HB3 ASN 22 15.450 3.279 -25.354 160 HD21 ASN 22 HD21 ASN 22 16.388 6.401 -25.776 161 HD22 ASN 22 HD22 ASN 22 16.082 6.535 -27.470 162 H ASN 23 H ASN 23 11.412 3.649 -23.406 163 HA ASN 23 HA ASN 23 10.699 2.412 -21.721 164 HB2 ASN 23 HB2 ASN 23 10.848 0.629 -23.469 165 HB3 ASN 23 HB3 ASN 23 12.391 0.150 -22.739 166 HD21 ASN 23 HD21 ASN 23 8.904 0.739 -21.931 167 HD22 ASN 23 HD22 ASN 23 8.813 -0.415 -20.647 168 H ARG 24 H ARG 24 12.945 4.106 -21.165 169 HA ARG 24 HA ARG 24 14.045 2.798 -18.731 170 HB2 ARG 24 HB2 ARG 24 15.514 4.619 -20.679 171 HB3 ARG 24 HB3 ARG 24 16.142 4.072 -19.118 172 HG2 ARG 24 HG2 ARG 24 16.023 1.721 -19.841 173 HG3 ARG 24 HG3 ARG 24 15.308 2.201 -21.382 174 HD2 ARG 24 HD2 ARG 24 17.334 3.593 -21.839 175 HD3 ARG 24 HD3 ARG 24 18.104 2.819 -20.433 176 HE ARG 24 HE ARG 24 17.196 0.688 -21.885 177 HH11 ARG 24 HH11 ARG 24 19.136 3.520 -22.870 178 HH12 ARG 24 HH12 ARG 24 19.962 2.632 -24.121 179 HH21 ARG 24 HH21 ARG 24 18.248 -0.401 -23.494 180 HH22 ARG 24 HH22 ARG 24 19.515 0.319 -24.441 181 H LEU 25 H LEU 25 13.618 3.939 -16.948 182 HA LEU 25 HA LEU 25 11.930 6.269 -17.017 183 HB2 LEU 25 HB2 LEU 25 12.146 4.361 -15.225 184 HB3 LEU 25 HB3 LEU 25 13.514 5.259 -14.597 185 HG LEU 25 HG LEU 25 10.690 6.324 -14.943 186 HD11 LEU 25 HD11 LEU 25 10.442 6.174 -12.572 187 HD12 LEU 25 HD12 LEU 25 12.096 5.597 -12.349 188 HD13 LEU 25 HD13 LEU 25 10.885 4.587 -13.195 189 HD21 LEU 25 HD21 LEU 25 12.074 8.294 -14.895 190 HD22 LEU 25 HD22 LEU 25 13.137 7.614 -13.624 191 HD23 LEU 25 HD23 LEU 25 11.470 8.123 -13.280 192 H GLN 26 H GLN 26 12.634 8.389 -17.290 193 HA GLN 26 HA GLN 26 15.242 9.183 -16.209 194 HB2 GLN 26 HB2 GLN 26 14.377 9.953 -19.014 195 HB3 GLN 26 HB3 GLN 26 15.861 10.401 -18.178 196 HG2 GLN 26 HG2 GLN 26 16.066 7.671 -18.069 197 HG3 GLN 26 HG3 GLN 26 15.118 7.831 -19.551 198 HE21 GLN 26 HE21 GLN 26 16.444 10.264 -20.593 199 HE22 GLN 26 HE22 GLN 26 18.029 9.738 -21.036 200 H TYR 27 H TYR 27 15.270 11.712 -16.011 201 HA TYR 27 HA TYR 27 12.566 12.900 -15.821 202 HB2 TYR 27 HB2 TYR 27 13.008 13.710 -13.556 203 HB3 TYR 27 HB3 TYR 27 12.855 11.964 -13.634 204 HD1 TYR 27 HD1 TYR 27 14.501 10.562 -12.843 205 HD2 TYR 27 HD2 TYR 27 15.303 14.776 -13.244 206 HE1 TYR 27 HE1 TYR 27 16.682 10.279 -11.593 207 HE2 TYR 27 HE2 TYR 27 17.415 14.520 -11.989 208 HH TYR 27 HH TYR 27 18.674 11.297 -10.992 209 H GLU 28 H GLU 28 12.701 15.236 -15.494 210 HA GLU 28 HA GLU 28 15.272 16.492 -16.240 211 HB2 GLU 28 HB2 GLU 28 14.160 15.957 -18.289 212 HB3 GLU 28 HB3 GLU 28 12.629 16.645 -17.733 213 HG2 GLU 28 HG2 GLU 28 13.296 18.791 -18.036 214 HG3 GLU 28 HG3 GLU 28 15.010 18.441 -17.663 215 H THR 29 H THR 29 15.484 18.593 -15.315 216 HA THR 29 HA THR 29 13.247 20.083 -14.317 217 HB THR 29 HB THR 29 13.480 18.291 -12.589 218 HG1 THR 29 HG1 THR 29 12.713 20.207 -11.903 219 HG21 THR 29 HG21 THR 29 15.838 17.774 -12.698 220 HG22 THR 29 HG22 THR 29 15.337 18.232 -11.068 221 HG23 THR 29 HG23 THR 29 16.239 19.390 -12.053 222 H SER 30 H SER 30 14.070 22.166 -13.325 223 HA SER 30 HA SER 30 16.903 22.809 -13.980 224 HB2 SER 30 HB2 SER 30 14.475 24.418 -14.810 225 HB3 SER 30 HB3 SER 30 16.178 24.885 -15.024 226 HG SER 30 HG SER 30 15.478 23.959 -16.928 227 H ARG 31 H ARG 31 17.090 22.493 -11.683 228 HA ARG 31 HA ARG 31 16.821 24.925 -10.179 229 HB2 ARG 31 HB2 ARG 31 15.618 23.952 -8.258 230 HB3 ARG 31 HB3 ARG 31 14.607 24.051 -9.673 231 HG2 ARG 31 HG2 ARG 31 14.741 21.717 -10.105 232 HG3 ARG 31 HG3 ARG 31 16.051 21.455 -8.944 233 HD2 ARG 31 HD2 ARG 31 13.334 22.536 -8.133 234 HD3 ARG 31 HD3 ARG 31 13.681 20.800 -8.214 235 HE ARG 31 HE ARG 31 15.728 21.769 -6.639 236 HH11 ARG 31 HH11 ARG 31 12.260 22.413 -6.355 237 HH12 ARG 31 HH12 ARG 31 12.175 22.016 -4.667 238 HH21 ARG 31 HH21 ARG 31 15.675 21.320 -4.403 239 HH22 ARG 31 HH22 ARG 31 14.162 21.423 -3.559 240 H ASP 32 H ASP 32 17.422 23.885 -7.684 241 HA ASP 32 HA ASP 32 19.892 22.311 -8.029 242 HB2 ASP 32 HB2 ASP 32 21.025 23.692 -6.452 243 HB3 ASP 32 HB3 ASP 32 20.351 24.780 -7.652 244 H SER 33 H SER 33 20.521 21.436 -5.895 245 HA SER 33 HA SER 33 20.096 19.666 -4.614 246 HB2 SER 33 HB2 SER 33 20.495 21.831 -3.337 247 HB3 SER 33 HB3 SER 33 18.784 21.777 -2.885 248 HG SER 33 HG SER 33 20.617 20.668 -1.610 249 H ILE 34 H ILE 34 18.631 18.418 -5.890 250 HA ILE 34 HA ILE 34 15.754 18.626 -5.559 251 HB ILE 34 HB ILE 34 17.705 16.551 -6.611 252 HG12 ILE 34 HG12 ILE 34 15.456 18.044 -8.050 253 HG13 ILE 34 HG13 ILE 34 17.091 18.688 -7.884 254 HG21 ILE 34 HG21 ILE 34 15.914 15.091 -7.390 255 HG22 ILE 34 HG22 ILE 34 15.852 15.198 -5.636 256 HG23 ILE 34 HG23 ILE 34 14.689 16.104 -6.607 257 HD11 ILE 34 HD11 ILE 34 17.880 16.455 -8.932 258 HD12 ILE 34 HD12 ILE 34 16.159 16.283 -9.426 259 HD13 ILE 34 HD13 ILE 34 17.135 17.683 -9.952 260 HA PRO 35 HA PRO 35 15.599 16.678 -1.570 261 HB2 PRO 35 HB2 PRO 35 13.117 15.457 -1.704 262 HB3 PRO 35 HB3 PRO 35 13.394 17.212 -1.381 263 HG2 PRO 35 HG2 PRO 35 12.674 15.863 -3.987 264 HG3 PRO 35 HG3 PRO 35 11.994 17.359 -3.269 265 HD2 PRO 35 HD2 PRO 35 13.892 17.469 -5.177 266 HD3 PRO 35 HD3 PRO 35 13.921 18.602 -3.803 267 H THR 36 H THR 36 17.104 15.099 -1.512 268 HA THR 36 HA THR 36 17.494 12.966 -3.232 269 HB THR 36 HB THR 36 19.091 13.971 -1.669 270 HG1 THR 36 HG1 THR 36 19.589 11.989 -2.502 271 HG21 THR 36 HG21 THR 36 19.186 13.407 0.667 272 HG22 THR 36 HG22 THR 36 17.762 12.362 0.540 273 HG23 THR 36 HG23 THR 36 17.605 14.113 0.346 274 H GLU 37 H GLU 37 15.345 13.027 -0.401 275 HA GLU 37 HA GLU 37 14.819 10.261 -0.163 276 HB2 GLU 37 HB2 GLU 37 12.552 11.148 0.727 277 HB3 GLU 37 HB3 GLU 37 14.015 11.595 1.587 278 HG2 GLU 37 HG2 GLU 37 14.016 13.829 0.668 279 HG3 GLU 37 HG3 GLU 37 12.741 13.440 -0.477 280 H LEU 38 H LEU 38 13.125 12.745 -2.070 281 HA LEU 38 HA LEU 38 11.231 11.040 -3.307 282 HB2 LEU 38 HB2 LEU 38 11.555 13.711 -2.960 283 HB3 LEU 38 HB3 LEU 38 12.153 13.592 -4.610 284 HG LEU 38 HG LEU 38 9.417 12.640 -3.607 285 HD11 LEU 38 HD11 LEU 38 9.751 15.110 -3.534 286 HD12 LEU 38 HD12 LEU 38 8.571 14.650 -4.753 287 HD13 LEU 38 HD13 LEU 38 10.216 15.093 -5.253 288 HD21 LEU 38 HD21 LEU 38 8.873 12.564 -6.067 289 HD22 LEU 38 HD22 LEU 38 10.079 11.371 -5.585 290 HD23 LEU 38 HD23 LEU 38 10.587 12.879 -6.396 291 H LEU 39 H LEU 39 14.441 12.251 -4.232 292 HA LEU 39 HA LEU 39 14.586 11.271 -6.870 293 HB2 LEU 39 HB2 LEU 39 16.215 12.757 -5.360 294 HB3 LEU 39 HB3 LEU 39 17.018 11.219 -5.058 295 HG LEU 39 HG LEU 39 16.579 12.629 -7.712 296 HD11 LEU 39 HD11 LEU 39 18.416 13.430 -6.174 297 HD12 LEU 39 HD12 LEU 39 18.949 12.876 -7.766 298 HD13 LEU 39 HD13 LEU 39 19.170 11.810 -6.373 299 HD21 LEU 39 HD21 LEU 39 17.820 9.888 -7.216 300 HD22 LEU 39 HD22 LEU 39 17.992 10.819 -8.724 301 HD23 LEU 39 HD23 LEU 39 16.409 10.249 -8.221 302 H ASN 40 H ASN 40 15.598 9.779 -3.825 303 HA ASN 40 HA ASN 40 16.377 7.231 -4.840 304 HB2 ASN 40 HB2 ASN 40 15.507 8.127 -2.070 305 HB3 ASN 40 HB3 ASN 40 15.898 6.448 -2.433 306 HD21 ASN 40 HD21 ASN 40 17.331 9.070 -1.043 307 HD22 ASN 40 HD22 ASN 40 18.972 8.730 -1.485 308 H LYS 41 H LYS 41 13.189 8.468 -3.759 309 HA LYS 41 HA LYS 41 11.811 6.013 -3.770 310 HB2 LYS 41 HB2 LYS 41 10.964 8.158 -2.866 311 HB3 LYS 41 HB3 LYS 41 10.704 8.756 -4.507 312 HG2 LYS 41 HG2 LYS 41 8.944 7.287 -4.939 313 HG3 LYS 41 HG3 LYS 41 9.475 6.152 -3.695 314 HD2 LYS 41 HD2 LYS 41 7.453 7.241 -2.975 315 HD3 LYS 41 HD3 LYS 41 8.813 7.661 -1.917 316 HE2 LYS 41 HE2 LYS 41 9.009 9.787 -3.502 317 HE3 LYS 41 HE3 LYS 41 7.331 9.372 -3.920 318 HZ1 LYS 41 HZ1 LYS 41 6.824 9.556 -1.517 319 HZ2 LYS 41 HZ2 LYS 41 7.337 10.928 -2.167 320 HZ3 LYS 41 HZ3 LYS 41 8.381 10.058 -1.236 321 H TRP 42 H TRP 42 12.560 8.206 -6.487 322 HA TRP 42 HA TRP 42 11.018 6.913 -8.447 323 HB2 TRP 42 HB2 TRP 42 13.733 8.191 -8.823 324 HB3 TRP 42 HB3 TRP 42 12.545 7.862 -10.106 325 HD1 TRP 42 HD1 TRP 42 10.100 9.084 -8.120 326 HE1 TRP 42 HE1 TRP 42 9.885 11.618 -8.013 327 HE3 TRP 42 HE3 TRP 42 14.740 10.311 -9.790 328 HZ2 TRP 42 HZ2 TRP 42 11.656 13.915 -8.289 329 HZ3 TRP 42 HZ3 TRP 42 15.505 12.688 -9.748 330 HH2 TRP 42 HH2 TRP 42 14.028 14.452 -8.930 331 H LYS 43 H LYS 43 14.451 6.243 -7.544 332 HA LYS 43 HA LYS 43 14.559 3.999 -9.391 333 HB2 LYS 43 HB2 LYS 43 16.694 3.440 -8.321 334 HB3 LYS 43 HB3 LYS 43 16.595 5.083 -8.938 335 HG2 LYS 43 HG2 LYS 43 16.374 6.047 -6.770 336 HG3 LYS 43 HG3 LYS 43 16.241 4.450 -5.991 337 HD2 LYS 43 HD2 LYS 43 18.679 5.304 -7.598 338 HD3 LYS 43 HD3 LYS 43 18.528 5.592 -5.852 339 HE2 LYS 43 HE2 LYS 43 18.379 3.293 -5.335 340 HE3 LYS 43 HE3 LYS 43 18.051 2.817 -6.997 341 HZ1 LYS 43 HZ1 LYS 43 20.289 2.306 -6.324 342 HZ2 LYS 43 HZ2 LYS 43 20.630 3.894 -6.066 343 HZ3 LYS 43 HZ3 LYS 43 20.296 3.365 -7.584 344 H GLN 44 H GLN 44 13.612 4.316 -5.994 345 HA GLN 44 HA GLN 44 13.760 1.597 -5.266 346 HB2 GLN 44 HB2 GLN 44 13.335 3.501 -3.688 347 HB3 GLN 44 HB3 GLN 44 11.742 3.703 -4.402 348 HG2 GLN 44 HG2 GLN 44 11.288 2.537 -2.478 349 HG3 GLN 44 HG3 GLN 44 11.230 1.282 -3.690 350 HE21 GLN 44 HE21 GLN 44 11.551 0.515 -1.071 351 HE22 GLN 44 HE22 GLN 44 13.211 0.002 -0.763 352 H HIS 45 H HIS 45 11.149 3.426 -6.950 353 HA HIS 45 HA HIS 45 9.745 0.843 -7.490 354 HB2 HIS 45 HB2 HIS 45 8.622 3.656 -7.263 355 HB3 HIS 45 HB3 HIS 45 7.714 2.162 -7.428 356 HD1 HIS 45 HD1 HIS 45 7.962 0.438 -5.276 357 HD2 HIS 45 HD2 HIS 45 9.207 4.414 -4.835 358 HE1 HIS 45 HE1 HIS 45 8.133 0.878 -2.732 359 H LYS 46 H LYS 46 11.923 1.699 -9.166 360 HA LYS 46 HA LYS 46 11.262 3.221 -11.339 361 HB2 LYS 46 HB2 LYS 46 13.492 1.970 -10.814 362 HB3 LYS 46 HB3 LYS 46 12.855 0.696 -11.862 363 HG2 LYS 46 HG2 LYS 46 12.621 2.345 -13.700 364 HG3 LYS 46 HG3 LYS 46 13.082 3.636 -12.597 365 HD2 LYS 46 HD2 LYS 46 15.000 3.290 -13.853 366 HD3 LYS 46 HD3 LYS 46 15.297 2.578 -12.288 367 HE2 LYS 46 HE2 LYS 46 16.071 0.857 -13.434 368 HE3 LYS 46 HE3 LYS 46 14.397 0.348 -13.594 369 HZ1 LYS 46 HZ1 LYS 46 16.062 0.594 -15.578 370 HZ2 LYS 46 HZ2 LYS 46 15.574 2.147 -15.613 371 HZ3 LYS 46 HZ3 LYS 46 14.476 0.921 -15.860 372 H GLN 47 H GLN 47 10.604 -0.378 -11.303 373 HA GLN 47 HA GLN 47 9.470 -0.328 -13.892 374 HB2 GLN 47 HB2 GLN 47 9.996 -2.304 -12.025 375 HB3 GLN 47 HB3 GLN 47 8.233 -2.309 -12.076 376 HG2 GLN 47 HG2 GLN 47 9.977 -2.397 -14.564 377 HG3 GLN 47 HG3 GLN 47 9.514 -3.838 -13.674 378 HE21 GLN 47 HE21 GLN 47 7.601 -0.933 -14.957 379 HE22 GLN 47 HE22 GLN 47 6.437 -1.951 -15.694 380 H GLU 48 H GLU 48 7.950 -0.050 -10.739 381 HA GLU 48 HA GLU 48 5.279 0.064 -11.461 382 HB2 GLU 48 HB2 GLU 48 6.289 1.791 -9.209 383 HB3 GLU 48 HB3 GLU 48 4.849 0.772 -9.298 384 HG2 GLU 48 HG2 GLU 48 6.510 -1.240 -9.317 385 HG3 GLU 48 HG3 GLU 48 7.736 -0.046 -8.861 386 H LEU 49 H LEU 49 7.550 2.789 -11.126 387 HA LEU 49 HA LEU 49 5.761 4.840 -12.008 388 HB2 LEU 49 HB2 LEU 49 8.765 4.579 -12.167 389 HB3 LEU 49 HB3 LEU 49 7.918 6.070 -12.559 390 HG LEU 49 HG LEU 49 7.422 4.764 -9.861 391 HD11 LEU 49 HD11 LEU 49 9.311 5.775 -8.922 392 HD12 LEU 49 HD12 LEU 49 9.714 6.660 -10.431 393 HD13 LEU 49 HD13 LEU 49 9.891 4.894 -10.345 394 HD21 LEU 49 HD21 LEU 49 7.197 7.163 -9.230 395 HD22 LEU 49 HD22 LEU 49 6.001 6.670 -10.424 396 HD23 LEU 49 HD23 LEU 49 7.413 7.632 -10.911 397 H ILE 50 H ILE 50 8.151 2.836 -13.798 398 HA ILE 50 HA ILE 50 7.775 4.199 -16.277 399 HB ILE 50 HB ILE 50 8.455 1.260 -15.792 400 HG12 ILE 50 HG12 ILE 50 10.468 3.246 -16.844 401 HG13 ILE 50 HG13 ILE 50 10.107 3.259 -15.110 402 HG21 ILE 50 HG21 ILE 50 8.388 2.735 -18.434 403 HG22 ILE 50 HG22 ILE 50 9.339 1.251 -18.212 404 HG23 ILE 50 HG23 ILE 50 7.590 1.242 -18.009 405 HD11 ILE 50 HD11 ILE 50 10.865 0.691 -16.583 406 HD12 ILE 50 HD12 ILE 50 12.046 1.760 -15.776 407 HD13 ILE 50 HD13 ILE 50 10.776 0.962 -14.842 408 H ASP 51 H ASP 51 6.167 1.341 -14.972 409 HA ASP 51 HA ASP 51 4.485 0.785 -17.111 410 HB2 ASP 51 HB2 ASP 51 4.956 -0.391 -14.786 411 HB3 ASP 51 HB3 ASP 51 3.577 0.576 -14.235 412 H PHE 52 H PHE 52 4.135 3.124 -14.492 413 HA PHE 52 HA PHE 52 1.465 3.942 -15.135 414 HB2 PHE 52 HB2 PHE 52 2.263 4.177 -12.953 415 HB3 PHE 52 HB3 PHE 52 3.642 5.149 -13.453 416 HD1 PHE 52 HD1 PHE 52 3.527 7.426 -13.030 417 HD2 PHE 52 HD2 PHE 52 -0.130 5.290 -13.850 418 HE1 PHE 52 HE1 PHE 52 2.204 9.531 -12.748 419 HE2 PHE 52 HE2 PHE 52 -1.399 7.420 -13.646 420 HZ PHE 52 HZ PHE 52 -0.184 9.549 -13.093 421 H LEU 53 H LEU 53 4.649 5.556 -15.722 422 HA LEU 53 HA LEU 53 3.652 7.726 -17.244 423 HB2 LEU 53 HB2 LEU 53 6.338 6.359 -16.948 424 HB3 LEU 53 HB3 LEU 53 6.141 7.575 -18.182 425 HG LEU 53 HG LEU 53 7.126 8.709 -16.412 426 HD11 LEU 53 HD11 LEU 53 5.625 10.483 -15.908 427 HD12 LEU 53 HD12 LEU 53 4.204 9.469 -16.207 428 HD13 LEU 53 HD13 LEU 53 5.270 9.916 -17.550 429 HD21 LEU 53 HD21 LEU 53 5.024 7.624 -14.555 430 HD22 LEU 53 HD22 LEU 53 6.231 8.855 -14.139 431 HD23 LEU 53 HD23 LEU 53 6.747 7.220 -14.569 432 H ASN 54 H ASN 54 4.336 4.402 -18.082 433 HA ASN 54 HA ASN 54 4.270 4.795 -20.964 434 HB2 ASN 54 HB2 ASN 54 5.248 2.765 -19.477 435 HB3 ASN 54 HB3 ASN 54 3.675 2.113 -19.688 436 HD21 ASN 54 HD21 ASN 54 6.645 2.471 -20.909 437 HD22 ASN 54 HD22 ASN 54 6.472 1.996 -22.587 438 H GLN 55 H GLN 55 1.927 3.327 -18.595 439 HA GLN 55 HA GLN 55 -0.130 3.231 -20.564 440 HB2 GLN 55 HB2 GLN 55 -1.585 2.486 -18.837 441 HB3 GLN 55 HB3 GLN 55 0.001 1.728 -18.693 442 HG2 GLN 55 HG2 GLN 55 -0.484 2.161 -16.488 443 HG3 GLN 55 HG3 GLN 55 0.484 3.551 -16.931 444 HE21 GLN 55 HE21 GLN 55 -0.352 5.613 -16.706 445 HE22 GLN 55 HE22 GLN 55 -2.026 5.924 -16.250 446 H LEU 56 H LEU 56 1.146 5.979 -19.224 447 HA LEU 56 HA LEU 56 -1.409 7.492 -19.017 448 HB2 LEU 56 HB2 LEU 56 0.278 8.031 -17.364 449 HB3 LEU 56 HB3 LEU 56 1.527 8.176 -18.596 450 HG LEU 56 HG LEU 56 0.437 10.197 -19.499 451 HD11 LEU 56 HD11 LEU 56 -1.361 11.306 -18.151 452 HD12 LEU 56 HD12 LEU 56 -1.477 9.854 -17.128 453 HD13 LEU 56 HD13 LEU 56 -1.919 9.787 -18.851 454 HD21 LEU 56 HD21 LEU 56 0.888 10.481 -16.522 455 HD22 LEU 56 HD22 LEU 56 1.126 11.697 -17.786 456 HD23 LEU 56 HD23 LEU 56 2.192 10.279 -17.703 457 H ASP 57 H ASP 57 1.642 7.387 -20.879 458 HA ASP 57 HA ASP 57 0.620 9.333 -22.799 459 HB2 ASP 57 HB2 ASP 57 3.061 8.916 -21.730 460 HB3 ASP 57 HB3 ASP 57 3.248 7.931 -23.160 461 H SER 58 H SER 58 1.316 5.819 -22.793 462 HA SER 58 HA SER 58 0.401 5.649 -25.614 463 HB2 SER 58 HB2 SER 58 1.871 3.598 -23.930 464 HB3 SER 58 HB3 SER 58 1.522 3.511 -25.667 465 HG SER 58 HG SER 58 3.642 4.242 -25.278 466 H GLU 59 H GLU 59 -0.615 4.886 -22.378 467 HA GLU 59 HA GLU 59 -2.183 3.639 -21.440 468 HB2 GLU 59 HB2 GLU 59 -3.269 5.640 -22.901 469 HB3 GLU 59 HB3 GLU 59 -4.126 4.262 -23.614 470 HG2 GLU 59 HG2 GLU 59 -4.524 3.548 -21.107 471 HG3 GLU 59 HG3 GLU 59 -4.006 5.182 -20.722 472 H GLU 60 H GLU 60 -0.688 1.989 -23.585 473 HA GLU 60 HA GLU 60 -2.765 -0.155 -23.742 474 HB2 GLU 60 HB2 GLU 60 -1.740 -0.808 -25.810 475 HB3 GLU 60 HB3 GLU 60 -2.181 0.909 -25.843 476 HG2 GLU 60 HG2 GLU 60 0.192 1.529 -25.439 477 HG3 GLU 60 HG3 GLU 60 0.633 -0.173 -25.312 478 H GLN 61 H GLN 61 0.308 0.258 -22.158 479 HA GLN 61 HA GLN 61 0.458 -2.671 -21.934 480 HB2 GLN 61 HB2 GLN 61 2.839 -2.605 -22.320 481 HB3 GLN 61 HB3 GLN 61 1.899 -2.101 -23.723 482 HG2 GLN 61 HG2 GLN 61 2.443 0.295 -23.155 483 HG3 GLN 61 HG3 GLN 61 3.556 -0.315 -21.917 484 HE21 GLN 61 HE21 GLN 61 4.641 1.251 -23.639 485 HE22 GLN 61 HE22 GLN 61 5.414 0.486 -25.041 486 H THR 62 H THR 62 -0.141 -2.878 -19.878 487 HA THR 62 HA THR 62 1.522 -1.564 -17.844 488 HB THR 62 HB THR 62 -0.504 -0.272 -17.961 489 HG1 THR 62 HG1 THR 62 0.436 -1.057 -15.884 490 HG21 THR 62 HG21 THR 62 -2.081 -1.887 -18.967 491 HG22 THR 62 HG22 THR 62 -2.710 -1.156 -17.492 492 HG23 THR 62 HG23 THR 62 -2.090 -2.820 -17.448 493 H LYS 63 H LYS 63 1.860 -2.857 -15.987 494 HA LYS 63 HA LYS 63 0.770 -5.542 -15.794 495 HB2 LYS 63 HB2 LYS 63 3.123 -6.546 -15.756 496 HB3 LYS 63 HB3 LYS 63 2.390 -6.236 -17.328 497 HG2 LYS 63 HG2 LYS 63 3.725 -4.268 -17.694 498 HG3 LYS 63 HG3 LYS 63 4.350 -4.283 -16.030 499 HD2 LYS 63 HD2 LYS 63 5.533 -6.371 -16.438 500 HD3 LYS 63 HD3 LYS 63 4.806 -6.497 -18.060 501 HE2 LYS 63 HE2 LYS 63 5.841 -4.341 -18.691 502 HE3 LYS 63 HE3 LYS 63 6.584 -4.212 -17.096 503 HZ1 LYS 63 HZ1 LYS 63 8.015 -5.117 -18.893 504 HZ2 LYS 63 HZ2 LYS 63 7.056 -6.446 -18.950 505 HZ3 LYS 63 HZ3 LYS 63 7.887 -6.118 -17.553 Start of MODEL 4 1 H1 GLY 1 H GLY 1 0.515 -0.300 0.006 2 HA2 GLY 1 HA2 GLY 1 2.792 0.438 0.576 3 HA3 GLY 1 HA3 GLY 1 2.737 -0.290 -1.049 4 H ILE 2 H ILE 2 2.484 1.165 -2.925 5 HA ILE 2 HA ILE 2 3.081 3.985 -2.485 6 HB ILE 2 HB ILE 2 5.317 2.859 -2.739 7 HG12 ILE 2 HG12 ILE 2 6.256 4.197 -4.342 8 HG13 ILE 2 HG13 ILE 2 4.733 4.431 -5.221 9 HG21 ILE 2 HG21 ILE 2 4.066 1.724 -5.257 10 HG22 ILE 2 HG22 ILE 2 5.791 1.950 -5.134 11 HG23 ILE 2 HG23 ILE 2 4.950 0.894 -3.982 12 HD11 ILE 2 HD11 ILE 2 5.492 6.405 -3.879 13 HD12 ILE 2 HD12 ILE 2 3.856 5.868 -3.491 14 HD13 ILE 2 HD13 ILE 2 5.224 5.458 -2.405 15 H ASP 3 H ASP 3 2.552 5.238 -4.500 16 HA ASP 3 HA ASP 3 0.782 3.831 -6.383 17 HB2 ASP 3 HB2 ASP 3 0.267 6.636 -5.498 18 HB3 ASP 3 HB3 ASP 3 -0.833 5.454 -6.141 19 H ALA 4 H ALA 4 1.912 4.043 -8.253 20 HA ALA 4 HA ALA 4 4.225 5.587 -8.647 21 HB1 ALA 4 HB1 ALA 4 3.810 5.189 -11.103 22 HB2 ALA 4 HB2 ALA 4 3.787 3.727 -10.124 23 HB3 ALA 4 HB3 ALA 4 2.252 4.446 -10.673 24 H ALA 5 H ALA 5 0.857 6.408 -9.467 25 HA ALA 5 HA ALA 5 1.475 8.848 -10.819 26 HB1 ALA 5 HB1 ALA 5 -1.006 8.203 -9.211 27 HB2 ALA 5 HB2 ALA 5 -0.870 9.320 -10.586 28 HB3 ALA 5 HB3 ALA 5 -0.712 7.579 -10.861 29 H GLN 6 H GLN 6 0.939 8.134 -7.326 30 HA GLN 6 HA GLN 6 0.867 10.881 -6.536 31 HB2 GLN 6 HB2 GLN 6 1.602 8.311 -5.080 32 HB3 GLN 6 HB3 GLN 6 1.813 9.834 -4.293 33 HG2 GLN 6 HG2 GLN 6 -0.897 9.088 -5.455 34 HG3 GLN 6 HG3 GLN 6 -0.354 8.542 -3.871 35 HE21 GLN 6 HE21 GLN 6 -1.122 11.550 -5.718 36 HE22 GLN 6 HE22 GLN 6 -1.264 12.530 -4.280 37 H ILE 7 H ILE 7 3.518 8.680 -7.348 38 HA ILE 7 HA ILE 7 5.558 10.359 -6.185 39 HB ILE 7 HB ILE 7 5.806 8.276 -8.320 40 HG12 ILE 7 HG12 ILE 7 6.344 7.825 -5.371 41 HG13 ILE 7 HG13 ILE 7 4.900 7.275 -6.207 42 HG21 ILE 7 HG21 ILE 7 8.230 8.220 -7.649 43 HG22 ILE 7 HG22 ILE 7 7.755 9.845 -8.068 44 HG23 ILE 7 HG23 ILE 7 7.867 9.365 -6.346 45 HD11 ILE 7 HD11 ILE 7 6.454 5.413 -6.109 46 HD12 ILE 7 HD12 ILE 7 6.321 5.934 -7.780 47 HD13 ILE 7 HD13 ILE 7 7.742 6.347 -6.803 48 H VAL 8 H VAL 8 4.054 10.054 -9.446 49 HA VAL 8 HA VAL 8 5.836 11.913 -10.710 50 HB VAL 8 HB VAL 8 2.965 11.102 -11.407 51 HG11 VAL 8 HG11 VAL 8 4.977 12.667 -13.097 52 HG12 VAL 8 HG12 VAL 8 3.425 12.005 -13.655 53 HG13 VAL 8 HG13 VAL 8 3.446 13.289 -12.453 54 HG21 VAL 8 HG21 VAL 8 4.534 9.245 -11.547 55 HG22 VAL 8 HG22 VAL 8 4.219 9.813 -13.193 56 HG23 VAL 8 HG23 VAL 8 5.723 10.261 -12.388 57 H ASP 9 H ASP 9 2.753 12.359 -8.966 58 HA ASP 9 HA ASP 9 2.392 15.096 -9.401 59 HB2 ASP 9 HB2 ASP 9 0.692 13.597 -8.423 60 HB3 ASP 9 HB3 ASP 9 1.645 13.460 -6.944 61 H GLU 10 H GLU 10 3.835 13.621 -6.433 62 HA GLU 10 HA GLU 10 4.517 16.083 -5.264 63 HB2 GLU 10 HB2 GLU 10 6.108 14.778 -3.847 64 HB3 GLU 10 HB3 GLU 10 4.538 13.969 -3.974 65 HG2 GLU 10 HG2 GLU 10 5.506 12.564 -5.783 66 HG3 GLU 10 HG3 GLU 10 7.022 13.393 -5.566 67 H ALA 11 H ALA 11 6.315 14.243 -7.751 68 HA ALA 11 HA ALA 11 8.768 15.745 -7.385 69 HB1 ALA 11 HB1 ALA 11 9.340 14.742 -9.626 70 HB2 ALA 11 HB2 ALA 11 8.730 13.526 -8.513 71 HB3 ALA 11 HB3 ALA 11 7.675 14.161 -9.780 72 H LEU 12 H LEU 12 5.844 16.111 -9.418 73 HA LEU 12 HA LEU 12 6.845 18.268 -11.000 74 HB2 LEU 12 HB2 LEU 12 4.007 17.487 -10.206 75 HB3 LEU 12 HB3 LEU 12 4.338 18.814 -11.304 76 HG LEU 12 HG LEU 12 5.339 16.028 -11.843 77 HD11 LEU 12 HD11 LEU 12 2.915 15.895 -11.610 78 HD12 LEU 12 HD12 LEU 12 3.416 15.651 -13.289 79 HD13 LEU 12 HD13 LEU 12 2.719 17.208 -12.786 80 HD21 LEU 12 HD21 LEU 12 4.853 18.401 -13.689 81 HD22 LEU 12 HD22 LEU 12 5.399 16.788 -14.193 82 HD23 LEU 12 HD23 LEU 12 6.441 17.780 -13.171 83 H GLU 13 H GLU 13 5.419 18.119 -7.788 84 HA GLU 13 HA GLU 13 4.818 20.923 -7.480 85 HB2 GLU 13 HB2 GLU 13 5.533 18.760 -5.490 86 HB3 GLU 13 HB3 GLU 13 5.023 20.376 -5.008 87 HG2 GLU 13 HG2 GLU 13 2.845 19.975 -6.191 88 HG3 GLU 13 HG3 GLU 13 3.342 18.299 -6.449 89 H GLN 14 H GLN 14 7.834 19.208 -7.541 90 HA GLN 14 HA GLN 14 9.318 21.404 -6.158 91 HB2 GLN 14 HB2 GLN 14 10.107 18.662 -7.107 92 HB3 GLN 14 HB3 GLN 14 11.168 19.737 -6.182 93 HG2 GLN 14 HG2 GLN 14 9.825 19.395 -4.188 94 HG3 GLN 14 HG3 GLN 14 8.570 18.527 -5.114 95 HE21 GLN 14 HE21 GLN 14 9.008 16.988 -3.280 96 HE22 GLN 14 HE22 GLN 14 10.147 15.749 -3.766 97 H GLY 15 H GLY 15 8.322 20.389 -9.241 98 HA2 GLY 15 HA2 GLY 15 8.802 21.560 -11.216 99 HA3 GLY 15 HA3 GLY 15 10.368 22.069 -10.583 100 H ILE 16 H ILE 16 9.574 18.647 -10.164 101 HA ILE 16 HA ILE 16 11.494 18.040 -12.342 102 HB ILE 16 HB ILE 16 10.737 16.358 -9.963 103 HG12 ILE 16 HG12 ILE 16 13.556 17.228 -10.029 104 HG13 ILE 16 HG13 ILE 16 12.487 18.603 -9.895 105 HG21 ILE 16 HG21 ILE 16 11.457 15.010 -11.880 106 HG22 ILE 16 HG22 ILE 16 12.885 16.031 -12.118 107 HG23 ILE 16 HG23 ILE 16 12.739 15.001 -10.686 108 HD11 ILE 16 HD11 ILE 16 12.768 16.266 -7.995 109 HD12 ILE 16 HD12 ILE 16 12.939 17.983 -7.648 110 HD13 ILE 16 HD13 ILE 16 11.330 17.290 -7.993 111 H THR 17 H THR 17 10.757 17.260 -14.120 112 HA THR 17 HA THR 17 8.036 16.144 -14.298 113 HB THR 17 HB THR 17 10.094 17.455 -16.074 114 HG1 THR 17 HG1 THR 17 7.255 17.441 -16.068 115 HG21 THR 17 HG21 THR 17 9.949 15.450 -17.279 116 HG22 THR 17 HG22 THR 17 8.966 16.636 -18.125 117 HG23 THR 17 HG23 THR 17 8.177 15.357 -17.144 118 H LEU 18 H LEU 18 7.671 13.977 -14.594 119 HA LEU 18 HA LEU 18 9.987 12.123 -14.874 120 HB2 LEU 18 HB2 LEU 18 7.199 11.810 -13.669 121 HB3 LEU 18 HB3 LEU 18 8.218 10.468 -14.076 122 HG LEU 18 HG LEU 18 8.262 12.191 -11.685 123 HD11 LEU 18 HD11 LEU 18 7.832 9.787 -11.693 124 HD12 LEU 18 HD12 LEU 18 9.295 10.133 -10.753 125 HD13 LEU 18 HD13 LEU 18 9.411 9.453 -12.406 126 HD21 LEU 18 HD21 LEU 18 10.310 13.110 -12.728 127 HD22 LEU 18 HD22 LEU 18 10.927 11.445 -12.899 128 HD23 LEU 18 HD23 LEU 18 10.663 12.152 -11.281 129 H PHE 19 H PHE 19 9.925 10.578 -16.441 130 HA PHE 19 HA PHE 19 7.629 10.025 -18.114 131 HB2 PHE 19 HB2 PHE 19 8.588 10.935 -20.205 132 HB3 PHE 19 HB3 PHE 19 8.140 12.177 -19.073 133 HD1 PHE 19 HD1 PHE 19 10.801 10.819 -21.049 134 HD2 PHE 19 HD2 PHE 19 9.984 13.296 -17.646 135 HE1 PHE 19 HE1 PHE 19 13.072 11.866 -21.248 136 HE2 PHE 19 HE2 PHE 19 12.161 14.411 -17.902 137 HZ PHE 19 HZ PHE 19 13.749 13.669 -19.657 138 H VAL 20 H VAL 20 8.603 8.721 -20.192 139 HA VAL 20 HA VAL 20 10.955 7.128 -19.351 140 HB VAL 20 HB VAL 20 8.366 5.884 -20.413 141 HG11 VAL 20 HG11 VAL 20 9.365 3.767 -20.086 142 HG12 VAL 20 HG12 VAL 20 10.456 4.701 -21.077 143 HG13 VAL 20 HG13 VAL 20 10.820 4.477 -19.346 144 HG21 VAL 20 HG21 VAL 20 9.525 5.555 -17.618 145 HG22 VAL 20 HG22 VAL 20 8.223 6.683 -17.993 146 HG23 VAL 20 HG23 VAL 20 7.961 4.975 -18.270 147 H VAL 21 H VAL 21 12.298 6.661 -21.053 148 HA VAL 21 HA VAL 21 11.278 7.121 -23.830 149 HB VAL 21 HB VAL 21 13.957 8.166 -22.875 150 HG11 VAL 21 HG11 VAL 21 13.980 9.335 -25.053 151 HG12 VAL 21 HG12 VAL 21 13.809 7.597 -25.298 152 HG13 VAL 21 HG13 VAL 21 12.391 8.657 -25.458 153 HG21 VAL 21 HG21 VAL 21 11.357 9.683 -23.251 154 HG22 VAL 21 HG22 VAL 21 12.400 9.570 -21.805 155 HG23 VAL 21 HG23 VAL 21 12.949 10.459 -23.229 156 H ASN 22 H ASN 22 11.769 5.369 -25.047 157 HA ASN 22 HA ASN 22 12.433 3.266 -25.562 158 HB2 ASN 22 HB2 ASN 22 15.174 4.385 -24.861 159 HB3 ASN 22 HB3 ASN 22 14.848 2.894 -25.739 160 HD21 ASN 22 HD21 ASN 22 15.391 6.232 -26.186 161 HD22 ASN 22 HD22 ASN 22 14.772 6.311 -27.823 162 H ASN 23 H ASN 23 11.221 3.193 -23.191 163 HA ASN 23 HA ASN 23 10.858 2.180 -21.307 164 HB2 ASN 23 HB2 ASN 23 11.029 0.284 -22.806 165 HB3 ASN 23 HB3 ASN 23 12.735 0.057 -22.358 166 HD21 ASN 23 HD21 ASN 23 9.389 0.415 -20.672 167 HD22 ASN 23 HD22 ASN 23 9.864 -0.703 -19.460 168 H ARG 24 H ARG 24 13.219 4.103 -21.260 169 HA ARG 24 HA ARG 24 14.461 3.119 -18.720 170 HB2 ARG 24 HB2 ARG 24 15.538 5.128 -20.746 171 HB3 ARG 24 HB3 ARG 24 16.269 4.700 -19.191 172 HG2 ARG 24 HG2 ARG 24 16.252 2.276 -19.943 173 HG3 ARG 24 HG3 ARG 24 15.963 2.882 -21.586 174 HD2 ARG 24 HD2 ARG 24 18.166 4.155 -19.942 175 HD3 ARG 24 HD3 ARG 24 18.367 2.509 -20.499 176 HE ARG 24 HE ARG 24 17.546 4.448 -22.559 177 HH11 ARG 24 HH11 ARG 24 20.308 3.141 -20.783 178 HH12 ARG 24 HH12 ARG 24 21.375 3.056 -22.139 179 HH21 ARG 24 HH21 ARG 24 18.989 4.402 -24.412 180 HH22 ARG 24 HH22 ARG 24 20.670 4.104 -24.180 181 H LEU 25 H LEU 25 14.060 4.273 -16.915 182 HA LEU 25 HA LEU 25 11.953 6.272 -17.027 183 HB2 LEU 25 HB2 LEU 25 12.414 4.490 -15.199 184 HB3 LEU 25 HB3 LEU 25 13.753 5.497 -14.656 185 HG LEU 25 HG LEU 25 10.815 6.275 -14.765 186 HD11 LEU 25 HD11 LEU 25 10.934 6.130 -12.305 187 HD12 LEU 25 HD12 LEU 25 12.595 5.509 -12.419 188 HD13 LEU 25 HD13 LEU 25 11.222 4.594 -13.105 189 HD21 LEU 25 HD21 LEU 25 13.200 7.836 -13.639 190 HD22 LEU 25 HD22 LEU 25 11.501 8.178 -13.234 191 HD23 LEU 25 HD23 LEU 25 12.020 8.381 -14.875 192 H GLN 26 H GLN 26 12.338 8.435 -17.451 193 HA GLN 26 HA GLN 26 14.990 9.565 -16.741 194 HB2 GLN 26 HB2 GLN 26 13.328 9.940 -19.252 195 HB3 GLN 26 HB3 GLN 26 14.762 10.892 -18.857 196 HG2 GLN 26 HG2 GLN 26 14.796 7.847 -19.215 197 HG3 GLN 26 HG3 GLN 26 15.073 8.981 -20.499 198 HE21 GLN 26 HE21 GLN 26 16.327 7.992 -17.224 199 HE22 GLN 26 HE22 GLN 26 17.931 8.657 -17.473 200 H TYR 27 H TYR 27 14.956 11.892 -16.400 201 HA TYR 27 HA TYR 27 12.399 13.091 -15.849 202 HB2 TYR 27 HB2 TYR 27 12.876 13.686 -13.554 203 HB3 TYR 27 HB3 TYR 27 12.796 11.938 -13.744 204 HD1 TYR 27 HD1 TYR 27 14.559 10.548 -13.033 205 HD2 TYR 27 HD2 TYR 27 15.094 14.833 -13.218 206 HE1 TYR 27 HE1 TYR 27 16.682 10.345 -11.737 207 HE2 TYR 27 HE2 TYR 27 17.144 14.658 -11.899 208 HH TYR 27 HH TYR 27 18.553 13.261 -10.782 209 H GLU 28 H GLU 28 12.634 15.373 -15.536 210 HA GLU 28 HA GLU 28 15.285 16.545 -16.101 211 HB2 GLU 28 HB2 GLU 28 14.524 16.276 -18.302 212 HB3 GLU 28 HB3 GLU 28 12.853 16.686 -17.882 213 HG2 GLU 28 HG2 GLU 28 13.289 18.956 -17.659 214 HG3 GLU 28 HG3 GLU 28 15.047 18.727 -17.506 215 H THR 29 H THR 29 15.494 18.613 -15.316 216 HA THR 29 HA THR 29 13.385 20.214 -14.391 217 HB THR 29 HB THR 29 13.387 18.486 -12.612 218 HG1 THR 29 HG1 THR 29 12.733 20.439 -12.022 219 HG21 THR 29 HG21 THR 29 15.174 18.325 -10.996 220 HG22 THR 29 HG22 THR 29 16.221 19.321 -12.007 221 HG23 THR 29 HG23 THR 29 15.660 17.720 -12.580 222 H SER 30 H SER 30 14.394 22.155 -13.283 223 HA SER 30 HA SER 30 17.224 22.723 -13.987 224 HB2 SER 30 HB2 SER 30 14.791 24.357 -14.726 225 HB3 SER 30 HB3 SER 30 16.482 24.891 -14.895 226 HG SER 30 HG SER 30 16.823 23.213 -16.386 227 H ARG 31 H ARG 31 17.505 22.378 -11.759 228 HA ARG 31 HA ARG 31 17.146 24.641 -10.029 229 HB2 ARG 31 HB2 ARG 31 15.815 23.530 -8.300 230 HB3 ARG 31 HB3 ARG 31 14.891 23.580 -9.795 231 HG2 ARG 31 HG2 ARG 31 15.596 21.238 -10.299 232 HG3 ARG 31 HG3 ARG 31 16.425 21.159 -8.742 233 HD2 ARG 31 HD2 ARG 31 13.532 21.014 -9.363 234 HD3 ARG 31 HD3 ARG 31 14.465 20.116 -8.177 235 HE ARG 31 HE ARG 31 13.017 22.608 -7.948 236 HH11 ARG 31 HH11 ARG 31 15.644 21.079 -6.083 237 HH12 ARG 31 HH12 ARG 31 14.713 21.074 -4.616 238 HH21 ARG 31 HH21 ARG 31 11.945 22.796 -6.029 239 HH22 ARG 31 HH22 ARG 31 12.628 22.170 -4.560 240 H ASP 32 H ASP 32 17.725 23.379 -7.614 241 HA ASP 32 HA ASP 32 19.878 21.458 -7.942 242 HB2 ASP 32 HB2 ASP 32 21.520 22.732 -6.790 243 HB3 ASP 32 HB3 ASP 32 20.997 23.674 -8.174 244 H SER 33 H SER 33 20.678 21.163 -5.443 245 HA SER 33 HA SER 33 20.111 20.038 -3.577 246 HB2 SER 33 HB2 SER 33 20.003 22.549 -3.100 247 HB3 SER 33 HB3 SER 33 18.245 22.392 -3.104 248 HG SER 33 HG SER 33 19.970 20.848 -1.434 249 H ILE 34 H ILE 34 18.876 18.681 -5.553 250 HA ILE 34 HA ILE 34 16.024 18.577 -5.289 251 HB ILE 34 HB ILE 34 18.071 16.754 -6.547 252 HG12 ILE 34 HG12 ILE 34 15.526 18.022 -7.673 253 HG13 ILE 34 HG13 ILE 34 17.093 18.829 -7.672 254 HG21 ILE 34 HG21 ILE 34 16.487 15.116 -5.539 255 HG22 ILE 34 HG22 ILE 34 15.125 15.959 -6.278 256 HG23 ILE 34 HG23 ILE 34 16.340 15.143 -7.281 257 HD11 ILE 34 HD11 ILE 34 17.931 16.699 -8.930 258 HD12 ILE 34 HD12 ILE 34 16.185 16.407 -9.220 259 HD13 ILE 34 HD13 ILE 34 16.964 17.895 -9.799 260 HA PRO 35 HA PRO 35 15.830 16.451 -1.388 261 HB2 PRO 35 HB2 PRO 35 13.292 15.307 -1.719 262 HB3 PRO 35 HB3 PRO 35 13.615 17.017 -1.198 263 HG2 PRO 35 HG2 PRO 35 12.977 15.917 -3.930 264 HG3 PRO 35 HG3 PRO 35 12.342 17.414 -3.173 265 HD2 PRO 35 HD2 PRO 35 14.236 17.492 -4.991 266 HD3 PRO 35 HD3 PRO 35 14.294 18.574 -3.579 267 H THR 36 H THR 36 17.262 14.770 -1.333 268 HA THR 36 HA THR 36 17.421 12.710 -3.221 269 HB THR 36 HB THR 36 19.171 13.480 -1.603 270 HG1 THR 36 HG1 THR 36 19.560 10.968 -1.126 271 HG21 THR 36 HG21 THR 36 19.330 12.470 0.575 272 HG22 THR 36 HG22 THR 36 17.840 11.536 0.327 273 HG23 THR 36 HG23 THR 36 17.771 13.299 0.474 274 H GLU 37 H GLU 37 15.218 12.986 -0.434 275 HA GLU 37 HA GLU 37 14.546 10.240 -0.187 276 HB2 GLU 37 HB2 GLU 37 12.408 11.048 0.773 277 HB3 GLU 37 HB3 GLU 37 13.832 11.791 1.495 278 HG2 GLU 37 HG2 GLU 37 13.451 13.870 0.239 279 HG3 GLU 37 HG3 GLU 37 12.077 13.151 -0.607 280 H LEU 38 H LEU 38 13.256 12.806 -2.330 281 HA LEU 38 HA LEU 38 11.326 11.098 -3.593 282 HB2 LEU 38 HB2 LEU 38 12.039 13.948 -3.714 283 HB3 LEU 38 HB3 LEU 38 12.121 13.283 -5.330 284 HG LEU 38 HG LEU 38 9.766 12.190 -4.681 285 HD11 LEU 38 HD11 LEU 38 9.646 12.604 -2.414 286 HD12 LEU 38 HD12 LEU 38 8.546 13.778 -3.151 287 HD13 LEU 38 HD13 LEU 38 10.131 14.308 -2.553 288 HD21 LEU 38 HD21 LEU 38 8.834 14.582 -5.348 289 HD22 LEU 38 HD22 LEU 38 9.853 13.658 -6.470 290 HD23 LEU 38 HD23 LEU 38 10.565 14.930 -5.569 291 H LEU 39 H LEU 39 14.605 12.208 -4.411 292 HA LEU 39 HA LEU 39 14.854 11.036 -6.920 293 HB2 LEU 39 HB2 LEU 39 16.500 12.465 -5.306 294 HB3 LEU 39 HB3 LEU 39 17.268 10.883 -5.145 295 HG LEU 39 HG LEU 39 16.709 12.474 -7.676 296 HD11 LEU 39 HD11 LEU 39 19.114 12.649 -7.838 297 HD12 LEU 39 HD12 LEU 39 19.330 11.595 -6.419 298 HD13 LEU 39 HD13 LEU 39 18.600 13.206 -6.246 299 HD21 LEU 39 HD21 LEU 39 17.939 10.721 -8.933 300 HD22 LEU 39 HD22 LEU 39 16.441 10.102 -8.275 301 HD23 LEU 39 HD23 LEU 39 17.959 9.703 -7.470 302 H ASN 40 H ASN 40 15.614 9.664 -3.786 303 HA ASN 40 HA ASN 40 16.351 7.023 -4.495 304 HB2 ASN 40 HB2 ASN 40 15.222 8.212 -1.940 305 HB3 ASN 40 HB3 ASN 40 15.358 6.473 -2.119 306 HD21 ASN 40 HD21 ASN 40 17.200 9.408 -1.757 307 HD22 ASN 40 HD22 ASN 40 18.734 8.657 -1.390 308 H LYS 41 H LYS 41 13.134 8.392 -3.597 309 HA LYS 41 HA LYS 41 11.650 6.039 -3.772 310 HB2 LYS 41 HB2 LYS 41 10.947 8.271 -2.870 311 HB3 LYS 41 HB3 LYS 41 10.690 8.858 -4.500 312 HG2 LYS 41 HG2 LYS 41 8.770 7.637 -4.806 313 HG3 LYS 41 HG3 LYS 41 9.347 6.267 -3.883 314 HD2 LYS 41 HD2 LYS 41 7.558 7.226 -2.645 315 HD3 LYS 41 HD3 LYS 41 9.067 7.599 -1.750 316 HE2 LYS 41 HE2 LYS 41 9.029 9.770 -3.272 317 HE3 LYS 41 HE3 LYS 41 7.382 9.249 -3.575 318 HZ1 LYS 41 HZ1 LYS 41 7.285 10.861 -1.934 319 HZ2 LYS 41 HZ2 LYS 41 8.454 10.213 -0.993 320 HZ3 LYS 41 HZ3 LYS 41 6.993 9.461 -1.132 321 H TRP 42 H TRP 42 12.512 8.336 -6.428 322 HA TRP 42 HA TRP 42 11.017 7.060 -8.392 323 HB2 TRP 42 HB2 TRP 42 13.726 8.346 -8.838 324 HB3 TRP 42 HB3 TRP 42 12.463 8.110 -10.043 325 HD1 TRP 42 HD1 TRP 42 10.184 9.298 -7.798 326 HE1 TRP 42 HE1 TRP 42 10.039 11.760 -7.487 327 HE3 TRP 42 HE3 TRP 42 14.727 10.512 -9.721 328 HZ2 TRP 42 HZ2 TRP 42 11.797 14.087 -7.860 329 HZ3 TRP 42 HZ3 TRP 42 15.511 12.904 -9.668 330 HH2 TRP 42 HH2 TRP 42 14.088 14.654 -8.692 331 H LYS 43 H LYS 43 14.448 6.476 -7.491 332 HA LYS 43 HA LYS 43 14.696 4.306 -9.402 333 HB2 LYS 43 HB2 LYS 43 16.888 3.853 -8.314 334 HB3 LYS 43 HB3 LYS 43 16.677 5.522 -8.835 335 HG2 LYS 43 HG2 LYS 43 16.281 6.277 -6.584 336 HG3 LYS 43 HG3 LYS 43 16.292 4.594 -5.973 337 HD2 LYS 43 HD2 LYS 43 18.678 4.464 -6.884 338 HD3 LYS 43 HD3 LYS 43 18.607 6.234 -7.032 339 HE2 LYS 43 HE2 LYS 43 18.300 6.501 -4.675 340 HE3 LYS 43 HE3 LYS 43 18.012 4.769 -4.433 341 HZ1 LYS 43 HZ1 LYS 43 20.592 5.898 -5.342 342 HZ2 LYS 43 HZ2 LYS 43 20.264 4.317 -4.921 343 HZ3 LYS 43 HZ3 LYS 43 20.230 5.473 -3.797 344 H GLN 44 H GLN 44 13.448 4.431 -6.201 345 HA GLN 44 HA GLN 44 13.882 1.695 -5.408 346 HB2 GLN 44 HB2 GLN 44 13.395 3.572 -3.826 347 HB3 GLN 44 HB3 GLN 44 11.812 3.759 -4.552 348 HG2 GLN 44 HG2 GLN 44 11.310 2.604 -2.668 349 HG3 GLN 44 HG3 GLN 44 11.367 1.299 -3.836 350 HE21 GLN 44 HE21 GLN 44 11.601 0.890 -1.101 351 HE22 GLN 44 HE22 GLN 44 13.223 0.383 -0.658 352 H HIS 45 H HIS 45 11.079 3.469 -6.760 353 HA HIS 45 HA HIS 45 9.736 0.907 -7.447 354 HB2 HIS 45 HB2 HIS 45 8.553 3.705 -7.192 355 HB3 HIS 45 HB3 HIS 45 7.695 2.186 -7.359 356 HD1 HIS 45 HD1 HIS 45 7.792 0.561 -5.165 357 HD2 HIS 45 HD2 HIS 45 9.272 4.455 -4.829 358 HE1 HIS 45 HE1 HIS 45 8.047 1.022 -2.639 359 H LYS 46 H LYS 46 11.900 1.775 -9.063 360 HA LYS 46 HA LYS 46 11.357 3.323 -11.278 361 HB2 LYS 46 HB2 LYS 46 13.563 2.433 -10.958 362 HB3 LYS 46 HB3 LYS 46 12.990 0.751 -11.163 363 HG2 LYS 46 HG2 LYS 46 12.604 0.987 -13.438 364 HG3 LYS 46 HG3 LYS 46 12.624 2.761 -13.385 365 HD2 LYS 46 HD2 LYS 46 14.970 2.852 -13.215 366 HD3 LYS 46 HD3 LYS 46 15.133 1.133 -12.912 367 HE2 LYS 46 HE2 LYS 46 14.080 2.310 -15.506 368 HE3 LYS 46 HE3 LYS 46 15.751 1.829 -15.229 369 HZ1 LYS 46 HZ1 LYS 46 15.142 -0.402 -15.032 370 HZ2 LYS 46 HZ2 LYS 46 14.409 0.128 -16.382 371 HZ3 LYS 46 HZ3 LYS 46 13.537 -0.132 -15.002 372 H GLN 47 H GLN 47 10.665 -0.240 -11.165 373 HA GLN 47 HA GLN 47 9.549 -0.206 -13.778 374 HB2 GLN 47 HB2 GLN 47 10.126 -2.151 -11.811 375 HB3 GLN 47 HB3 GLN 47 8.394 -2.305 -12.106 376 HG2 GLN 47 HG2 GLN 47 10.388 -2.096 -14.385 377 HG3 GLN 47 HG3 GLN 47 10.108 -3.624 -13.555 378 HE21 GLN 47 HE21 GLN 47 7.704 -1.035 -14.772 379 HE22 GLN 47 HE22 GLN 47 6.892 -2.201 -15.746 380 H GLU 48 H GLU 48 8.083 0.120 -10.643 381 HA GLU 48 HA GLU 48 5.374 0.084 -11.445 382 HB2 GLU 48 HB2 GLU 48 6.267 1.911 -9.207 383 HB3 GLU 48 HB3 GLU 48 4.767 0.975 -9.379 384 HG2 GLU 48 HG2 GLU 48 6.328 -1.124 -9.157 385 HG3 GLU 48 HG3 GLU 48 7.527 0.052 -8.578 386 H LEU 49 H LEU 49 7.579 2.835 -11.114 387 HA LEU 49 HA LEU 49 5.791 4.884 -11.998 388 HB2 LEU 49 HB2 LEU 49 8.840 4.602 -12.128 389 HB3 LEU 49 HB3 LEU 49 8.020 6.050 -12.641 390 HG LEU 49 HG LEU 49 7.424 4.934 -9.877 391 HD11 LEU 49 HD11 LEU 49 9.906 5.059 -10.255 392 HD12 LEU 49 HD12 LEU 49 9.253 6.047 -8.939 393 HD13 LEU 49 HD13 LEU 49 9.716 6.814 -10.491 394 HD21 LEU 49 HD21 LEU 49 7.314 7.643 -11.286 395 HD22 LEU 49 HD22 LEU 49 7.280 7.475 -9.542 396 HD23 LEU 49 HD23 LEU 49 5.991 6.740 -10.509 397 H ILE 50 H ILE 50 8.246 2.966 -13.762 398 HA ILE 50 HA ILE 50 7.789 4.282 -16.230 399 HB ILE 50 HB ILE 50 8.535 1.369 -15.758 400 HG12 ILE 50 HG12 ILE 50 10.517 3.432 -16.765 401 HG13 ILE 50 HG13 ILE 50 10.153 3.408 -15.037 402 HG21 ILE 50 HG21 ILE 50 7.739 1.319 -17.911 403 HG22 ILE 50 HG22 ILE 50 8.496 2.834 -18.359 404 HG23 ILE 50 HG23 ILE 50 9.489 1.378 -18.099 405 HD11 ILE 50 HD11 ILE 50 10.772 1.057 -14.862 406 HD12 ILE 50 HD12 ILE 50 11.080 0.955 -16.611 407 HD13 ILE 50 HD13 ILE 50 12.085 1.991 -15.600 408 H ASP 51 H ASP 51 6.239 1.307 -14.986 409 HA ASP 51 HA ASP 51 4.597 0.822 -17.168 410 HB2 ASP 51 HB2 ASP 51 5.071 -0.421 -14.890 411 HB3 ASP 51 HB3 ASP 51 3.639 0.442 -14.331 412 H PHE 52 H PHE 52 4.164 3.084 -14.486 413 HA PHE 52 HA PHE 52 1.482 3.863 -15.152 414 HB2 PHE 52 HB2 PHE 52 2.263 4.180 -12.913 415 HB3 PHE 52 HB3 PHE 52 3.608 5.167 -13.449 416 HD1 PHE 52 HD1 PHE 52 3.425 7.460 -13.126 417 HD2 PHE 52 HD2 PHE 52 -0.168 5.188 -13.860 418 HE1 PHE 52 HE1 PHE 52 2.078 9.567 -13.193 419 HE2 PHE 52 HE2 PHE 52 -1.482 7.300 -13.867 420 HZ PHE 52 HZ PHE 52 -0.287 9.508 -13.540 421 H LEU 53 H LEU 53 4.631 5.564 -15.640 422 HA LEU 53 HA LEU 53 3.560 7.755 -17.143 423 HB2 LEU 53 HB2 LEU 53 6.299 6.461 -16.942 424 HB3 LEU 53 HB3 LEU 53 6.004 7.749 -18.096 425 HG LEU 53 HG LEU 53 7.088 8.747 -16.333 426 HD11 LEU 53 HD11 LEU 53 5.162 10.052 -17.171 427 HD12 LEU 53 HD12 LEU 53 5.618 10.450 -15.514 428 HD13 LEU 53 HD13 LEU 53 4.185 9.454 -15.810 429 HD21 LEU 53 HD21 LEU 53 5.190 7.498 -14.364 430 HD22 LEU 53 HD22 LEU 53 6.429 8.706 -13.979 431 HD23 LEU 53 HD23 LEU 53 6.905 7.122 -14.599 432 H ASN 54 H ASN 54 4.354 4.444 -18.031 433 HA ASN 54 HA ASN 54 4.487 5.009 -20.882 434 HB2 ASN 54 HB2 ASN 54 5.401 2.875 -19.435 435 HB3 ASN 54 HB3 ASN 54 3.904 2.203 -20.006 436 HD21 ASN 54 HD21 ASN 54 7.053 3.495 -20.699 437 HD22 ASN 54 HD22 ASN 54 7.062 3.284 -22.465 438 H GLN 55 H GLN 55 2.078 3.356 -18.710 439 HA GLN 55 HA GLN 55 0.151 3.176 -20.814 440 HB2 GLN 55 HB2 GLN 55 -1.387 2.408 -19.187 441 HB3 GLN 55 HB3 GLN 55 0.188 1.728 -18.826 442 HG2 GLN 55 HG2 GLN 55 -0.615 2.318 -16.719 443 HG3 GLN 55 HG3 GLN 55 0.470 3.607 -17.126 444 HE21 GLN 55 HE21 GLN 55 -0.303 5.594 -16.526 445 HE22 GLN 55 HE22 GLN 55 -1.988 6.078 -16.561 446 H LEU 56 H LEU 56 1.145 5.906 -18.896 447 HA LEU 56 HA LEU 56 -1.281 7.380 -18.902 448 HB2 LEU 56 HB2 LEU 56 1.310 7.795 -17.973 449 HB3 LEU 56 HB3 LEU 56 1.262 8.916 -19.306 450 HG LEU 56 HG LEU 56 -0.637 8.795 -16.928 451 HD11 LEU 56 HD11 LEU 56 1.622 9.632 -16.415 452 HD12 LEU 56 HD12 LEU 56 0.427 10.928 -16.294 453 HD13 LEU 56 HD13 LEU 56 1.480 10.843 -17.714 454 HD21 LEU 56 HD21 LEU 56 -0.630 10.675 -19.321 455 HD22 LEU 56 HD22 LEU 56 -1.461 11.046 -17.811 456 HD23 LEU 56 HD23 LEU 56 -1.960 9.631 -18.758 457 H ASP 57 H ASP 57 1.321 7.030 -21.293 458 HA ASP 57 HA ASP 57 -0.140 8.782 -23.235 459 HB2 ASP 57 HB2 ASP 57 2.207 9.274 -22.702 460 HB3 ASP 57 HB3 ASP 57 2.696 7.691 -23.295 461 H SER 58 H SER 58 1.619 5.625 -23.155 462 HA SER 58 HA SER 58 0.737 4.819 -25.736 463 HB2 SER 58 HB2 SER 58 2.673 3.984 -24.049 464 HB3 SER 58 HB3 SER 58 1.438 2.810 -23.599 465 HG SER 58 HG SER 58 2.841 3.222 -25.971 466 H GLU 59 H GLU 59 -0.750 4.584 -22.523 467 HA GLU 59 HA GLU 59 -2.551 3.485 -21.710 468 HB2 GLU 59 HB2 GLU 59 -4.639 4.132 -22.662 469 HB3 GLU 59 HB3 GLU 59 -3.515 5.476 -22.616 470 HG2 GLU 59 HG2 GLU 59 -3.150 5.346 -25.020 471 HG3 GLU 59 HG3 GLU 59 -4.080 3.856 -25.122 472 H GLU 60 H GLU 60 -0.790 1.764 -23.189 473 HA GLU 60 HA GLU 60 -2.670 -0.489 -23.676 474 HB2 GLU 60 HB2 GLU 60 -0.414 0.546 -25.391 475 HB3 GLU 60 HB3 GLU 60 -0.995 -1.108 -25.542 476 HG2 GLU 60 HG2 GLU 60 -2.785 1.319 -25.927 477 HG3 GLU 60 HG3 GLU 60 -1.889 0.526 -27.228 478 H GLN 61 H GLN 61 0.491 0.543 -22.326 479 HA GLN 61 HA GLN 61 1.597 -2.028 -22.360 480 HB2 GLN 61 HB2 GLN 61 2.550 0.429 -21.477 481 HB3 GLN 61 HB3 GLN 61 2.406 -0.490 -19.964 482 HG2 GLN 61 HG2 GLN 61 3.551 -2.433 -21.216 483 HG3 GLN 61 HG3 GLN 61 3.858 -1.263 -22.517 484 HE21 GLN 61 HE21 GLN 61 6.067 -2.350 -21.904 485 HE22 GLN 61 HE22 GLN 61 7.004 -1.436 -20.733 486 H THR 62 H THR 62 -0.690 -0.626 -20.076 487 HA THR 62 HA THR 62 -1.286 -3.260 -18.972 488 HB THR 62 HB THR 62 -0.560 -0.794 -17.319 489 HG1 THR 62 HG1 THR 62 1.162 -1.881 -16.804 490 HG21 THR 62 HG21 THR 62 -2.570 -1.877 -16.372 491 HG22 THR 62 HG22 THR 62 -1.171 -2.225 -15.370 492 HG23 THR 62 HG23 THR 62 -1.787 -3.468 -16.479 493 H LYS 63 H LYS 63 -3.439 -3.429 -18.843 494 HA LYS 63 HA LYS 63 -5.289 -1.170 -18.841 495 HB2 LYS 63 HB2 LYS 63 -5.250 -3.294 -21.023 496 HB3 LYS 63 HB3 LYS 63 -6.484 -2.070 -20.813 497 HG2 LYS 63 HG2 LYS 63 -4.921 -0.277 -21.328 498 HG3 LYS 63 HG3 LYS 63 -3.606 -1.448 -21.569 499 HD2 LYS 63 HD2 LYS 63 -6.215 -1.528 -23.126 500 HD3 LYS 63 HD3 LYS 63 -4.783 -0.679 -23.672 501 HE2 LYS 63 HE2 LYS 63 -3.447 -2.762 -23.617 502 HE3 LYS 63 HE3 LYS 63 -4.857 -3.650 -23.025 503 HZ1 LYS 63 HZ1 LYS 63 -4.621 -2.299 -25.645 504 HZ2 LYS 63 HZ2 LYS 63 -6.012 -2.974 -25.068 505 HZ3 LYS 63 HZ3 LYS 63 -4.707 -3.925 -25.374 Start of MODEL 5 1 H1 GLY 1 H GLY 1 0.668 0.037 -0.493 2 HA2 GLY 1 HA2 GLY 1 3.530 -0.695 -0.732 3 HA3 GLY 1 HA3 GLY 1 2.354 -0.729 -2.059 4 H ILE 2 H ILE 2 2.634 0.929 -3.439 5 HA ILE 2 HA ILE 2 2.952 3.715 -2.543 6 HB ILE 2 HB ILE 2 5.274 2.703 -2.855 7 HG12 ILE 2 HG12 ILE 2 6.281 4.234 -4.258 8 HG13 ILE 2 HG13 ILE 2 4.821 4.577 -5.174 9 HG21 ILE 2 HG21 ILE 2 4.923 0.957 -4.462 10 HG22 ILE 2 HG22 ILE 2 4.221 2.069 -5.652 11 HG23 ILE 2 HG23 ILE 2 5.921 2.148 -5.294 12 HD11 ILE 2 HD11 ILE 2 5.340 5.353 -2.279 13 HD12 ILE 2 HD12 ILE 2 5.420 6.423 -3.699 14 HD13 ILE 2 HD13 ILE 2 3.873 5.741 -3.216 15 H ASP 3 H ASP 3 2.668 5.175 -4.452 16 HA ASP 3 HA ASP 3 0.831 3.953 -6.437 17 HB2 ASP 3 HB2 ASP 3 0.594 6.584 -5.033 18 HB3 ASP 3 HB3 ASP 3 -0.408 6.039 -6.344 19 H ALA 4 H ALA 4 1.774 4.262 -8.256 20 HA ALA 4 HA ALA 4 4.227 5.706 -8.625 21 HB1 ALA 4 HB1 ALA 4 2.217 4.810 -10.735 22 HB2 ALA 4 HB2 ALA 4 3.942 5.093 -10.999 23 HB3 ALA 4 HB3 ALA 4 3.428 3.731 -10.011 24 H ALA 5 H ALA 5 0.829 6.558 -9.141 25 HA ALA 5 HA ALA 5 1.256 9.032 -10.534 26 HB1 ALA 5 HB1 ALA 5 -1.062 8.363 -8.666 27 HB2 ALA 5 HB2 ALA 5 -1.056 9.499 -10.023 28 HB3 ALA 5 HB3 ALA 5 -0.948 7.755 -10.330 29 H GLN 6 H GLN 6 1.054 8.191 -7.052 30 HA GLN 6 HA GLN 6 0.971 10.876 -6.069 31 HB2 GLN 6 HB2 GLN 6 1.888 8.266 -4.820 32 HB3 GLN 6 HB3 GLN 6 1.891 9.746 -3.928 33 HG2 GLN 6 HG2 GLN 6 -0.663 8.735 -5.266 34 HG3 GLN 6 HG3 GLN 6 -0.166 8.247 -3.644 35 HE21 GLN 6 HE21 GLN 6 -1.106 11.139 -5.600 36 HE22 GLN 6 HE22 GLN 6 -1.309 12.169 -4.207 37 H ILE 7 H ILE 7 3.653 8.783 -7.042 38 HA ILE 7 HA ILE 7 5.657 10.563 -5.967 39 HB ILE 7 HB ILE 7 5.918 8.379 -8.038 40 HG12 ILE 7 HG12 ILE 7 6.604 8.131 -5.102 41 HG13 ILE 7 HG13 ILE 7 5.051 7.613 -5.747 42 HG21 ILE 7 HG21 ILE 7 7.909 9.934 -6.315 43 HG22 ILE 7 HG22 ILE 7 8.363 8.439 -7.127 44 HG23 ILE 7 HG23 ILE 7 7.860 9.841 -8.092 45 HD11 ILE 7 HD11 ILE 7 5.943 5.859 -7.005 46 HD12 ILE 7 HD12 ILE 7 7.592 6.498 -6.990 47 HD13 ILE 7 HD13 ILE 7 6.930 5.848 -5.524 48 H VAL 8 H VAL 8 3.983 10.221 -9.112 49 HA VAL 8 HA VAL 8 5.729 12.041 -10.539 50 HB VAL 8 HB VAL 8 2.916 10.979 -11.045 51 HG11 VAL 8 HG11 VAL 8 3.190 11.836 -13.403 52 HG12 VAL 8 HG12 VAL 8 2.959 13.129 -12.216 53 HG13 VAL 8 HG13 VAL 8 4.581 12.775 -12.849 54 HG21 VAL 8 HG21 VAL 8 4.979 9.510 -11.211 55 HG22 VAL 8 HG22 VAL 8 4.006 9.642 -12.699 56 HG23 VAL 8 HG23 VAL 8 5.533 10.536 -12.540 57 H ASP 9 H ASP 9 2.662 12.395 -8.760 58 HA ASP 9 HA ASP 9 2.113 15.114 -9.295 59 HB2 ASP 9 HB2 ASP 9 0.446 13.755 -8.242 60 HB3 ASP 9 HB3 ASP 9 1.566 13.270 -6.965 61 H GLU 10 H GLU 10 3.773 13.784 -6.360 62 HA GLU 10 HA GLU 10 4.555 16.321 -5.409 63 HB2 GLU 10 HB2 GLU 10 6.188 15.092 -3.993 64 HB3 GLU 10 HB3 GLU 10 4.585 14.373 -4.001 65 HG2 GLU 10 HG2 GLU 10 5.390 12.763 -5.753 66 HG3 GLU 10 HG3 GLU 10 6.996 13.367 -5.492 67 H ALA 11 H ALA 11 6.207 14.167 -7.760 68 HA ALA 11 HA ALA 11 8.648 15.621 -7.664 69 HB1 ALA 11 HB1 ALA 11 8.436 13.331 -8.719 70 HB2 ALA 11 HB2 ALA 11 7.489 14.048 -10.034 71 HB3 ALA 11 HB3 ALA 11 9.187 14.501 -9.814 72 H LEU 12 H LEU 12 5.660 15.897 -9.656 73 HA LEU 12 HA LEU 12 6.602 18.000 -11.346 74 HB2 LEU 12 HB2 LEU 12 3.851 16.991 -10.528 75 HB3 LEU 12 HB3 LEU 12 4.013 18.408 -11.548 76 HG LEU 12 HG LEU 12 5.182 15.688 -12.269 77 HD11 LEU 12 HD11 LEU 12 2.747 15.572 -12.138 78 HD12 LEU 12 HD12 LEU 12 3.245 15.561 -13.839 79 HD13 LEU 12 HD13 LEU 12 2.598 17.046 -13.111 80 HD21 LEU 12 HD21 LEU 12 4.823 18.269 -13.867 81 HD22 LEU 12 HD22 LEU 12 5.256 16.718 -14.583 82 HD23 LEU 12 HD23 LEU 12 6.356 17.488 -13.445 83 H GLU 13 H GLU 13 5.123 17.989 -8.146 84 HA GLU 13 HA GLU 13 4.551 20.838 -8.058 85 HB2 GLU 13 HB2 GLU 13 4.844 18.684 -5.932 86 HB3 GLU 13 HB3 GLU 13 4.476 20.362 -5.522 87 HG2 GLU 13 HG2 GLU 13 2.764 18.611 -7.349 88 HG3 GLU 13 HG3 GLU 13 2.453 18.907 -5.646 89 H GLN 14 H GLN 14 7.374 18.922 -7.724 90 HA GLN 14 HA GLN 14 9.012 21.039 -6.451 91 HB2 GLN 14 HB2 GLN 14 9.449 18.162 -7.293 92 HB3 GLN 14 HB3 GLN 14 10.770 19.179 -6.739 93 HG2 GLN 14 HG2 GLN 14 9.743 19.324 -4.543 94 HG3 GLN 14 HG3 GLN 14 8.359 18.373 -5.131 95 HE21 GLN 14 HE21 GLN 14 9.006 16.885 -3.286 96 HE22 GLN 14 HE22 GLN 14 10.248 15.728 -3.674 97 H GLY 15 H GLY 15 7.886 20.196 -9.532 98 HA2 GLY 15 HA2 GLY 15 8.391 21.193 -11.585 99 HA3 GLY 15 HA3 GLY 15 9.822 21.951 -10.867 100 H ILE 16 H ILE 16 9.071 18.456 -10.803 101 HA ILE 16 HA ILE 16 11.353 17.976 -12.622 102 HB ILE 16 HB ILE 16 10.574 16.324 -10.211 103 HG12 ILE 16 HG12 ILE 16 13.326 17.471 -10.229 104 HG13 ILE 16 HG13 ILE 16 12.065 18.681 -10.049 105 HG21 ILE 16 HG21 ILE 16 11.451 14.954 -12.012 106 HG22 ILE 16 HG22 ILE 16 12.824 16.052 -12.261 107 HG23 ILE 16 HG23 ILE 16 12.700 15.085 -10.782 108 HD11 ILE 16 HD11 ILE 16 12.664 17.975 -7.867 109 HD12 ILE 16 HD12 ILE 16 11.054 17.297 -8.250 110 HD13 ILE 16 HD13 ILE 16 12.496 16.263 -8.291 111 H THR 17 H THR 17 10.439 17.412 -14.419 112 HA THR 17 HA THR 17 7.873 15.969 -14.419 113 HB THR 17 HB THR 17 9.717 17.207 -16.491 114 HG1 THR 17 HG1 THR 17 8.076 18.603 -16.639 115 HG21 THR 17 HG21 THR 17 8.084 16.413 -18.217 116 HG22 THR 17 HG22 THR 17 7.347 15.370 -16.957 117 HG23 THR 17 HG23 THR 17 9.019 15.113 -17.464 118 H LEU 18 H LEU 18 7.660 13.846 -14.877 119 HA LEU 18 HA LEU 18 10.102 12.154 -15.112 120 HB2 LEU 18 HB2 LEU 18 7.293 11.556 -14.064 121 HB3 LEU 18 HB3 LEU 18 8.539 10.355 -14.352 122 HG LEU 18 HG LEU 18 8.202 12.266 -12.079 123 HD11 LEU 18 HD11 LEU 18 9.485 9.517 -12.448 124 HD12 LEU 18 HD12 LEU 18 7.810 9.824 -11.968 125 HD13 LEU 18 HD13 LEU 18 9.128 10.301 -10.877 126 HD21 LEU 18 HD21 LEU 18 10.303 13.146 -12.948 127 HD22 LEU 18 HD22 LEU 18 10.961 11.507 -13.098 128 HD23 LEU 18 HD23 LEU 18 10.626 12.203 -11.483 129 H PHE 19 H PHE 19 10.033 10.454 -16.584 130 HA PHE 19 HA PHE 19 7.869 9.965 -18.370 131 HB2 PHE 19 HB2 PHE 19 8.886 10.841 -20.441 132 HB3 PHE 19 HB3 PHE 19 8.362 12.087 -19.362 133 HD1 PHE 19 HD1 PHE 19 11.171 10.758 -21.205 134 HD2 PHE 19 HD2 PHE 19 10.060 13.360 -17.979 135 HE1 PHE 19 HE1 PHE 19 13.403 11.881 -21.320 136 HE2 PHE 19 HE2 PHE 19 12.205 14.491 -18.127 137 HZ PHE 19 HZ PHE 19 13.945 13.733 -19.747 138 H VAL 20 H VAL 20 8.813 8.624 -20.306 139 HA VAL 20 HA VAL 20 11.159 7.017 -19.399 140 HB VAL 20 HB VAL 20 8.471 6.046 -20.408 141 HG11 VAL 20 HG11 VAL 20 10.347 4.611 -21.193 142 HG12 VAL 20 HG12 VAL 20 10.868 4.392 -19.497 143 HG13 VAL 20 HG13 VAL 20 9.294 3.776 -20.063 144 HG21 VAL 20 HG21 VAL 20 8.424 6.717 -17.995 145 HG22 VAL 20 HG22 VAL 20 8.075 5.029 -18.284 146 HG23 VAL 20 HG23 VAL 20 9.686 5.529 -17.663 147 H VAL 21 H VAL 21 12.618 6.746 -21.010 148 HA VAL 21 HA VAL 21 11.751 7.260 -23.838 149 HB VAL 21 HB VAL 21 14.437 7.939 -22.597 150 HG11 VAL 21 HG11 VAL 21 14.591 7.376 -25.003 151 HG12 VAL 21 HG12 VAL 21 13.307 8.547 -25.356 152 HG13 VAL 21 HG13 VAL 21 14.869 9.106 -24.736 153 HG21 VAL 21 HG21 VAL 21 13.751 10.319 -23.038 154 HG22 VAL 21 HG22 VAL 21 12.102 9.734 -23.327 155 HG23 VAL 21 HG23 VAL 21 12.879 9.507 -21.736 156 H ASN 22 H ASN 22 11.956 5.482 -25.055 157 HA ASN 22 HA ASN 22 12.420 3.360 -25.695 158 HB2 ASN 22 HB2 ASN 22 15.228 4.123 -24.815 159 HB3 ASN 22 HB3 ASN 22 14.818 2.727 -25.816 160 HD21 ASN 22 HD21 ASN 22 16.059 5.744 -26.182 161 HD22 ASN 22 HD22 ASN 22 15.369 6.138 -27.742 162 H ASN 23 H ASN 23 11.254 3.485 -23.236 163 HA ASN 23 HA ASN 23 10.635 2.245 -21.491 164 HB2 ASN 23 HB2 ASN 23 10.989 0.389 -23.193 165 HB3 ASN 23 HB3 ASN 23 12.510 0.050 -22.358 166 HD21 ASN 23 HD21 ASN 23 9.053 0.693 -21.516 167 HD22 ASN 23 HD22 ASN 23 8.892 -0.674 -20.437 168 H ARG 24 H ARG 24 13.143 4.026 -21.320 169 HA ARG 24 HA ARG 24 14.299 2.891 -18.816 170 HB2 ARG 24 HB2 ARG 24 15.625 4.872 -20.698 171 HB3 ARG 24 HB3 ARG 24 16.331 4.052 -19.292 172 HG2 ARG 24 HG2 ARG 24 15.539 2.667 -21.853 173 HG3 ARG 24 HG3 ARG 24 17.151 3.165 -21.361 174 HD2 ARG 24 HD2 ARG 24 17.385 1.180 -20.535 175 HD3 ARG 24 HD3 ARG 24 16.467 1.731 -19.154 176 HE ARG 24 HE ARG 24 14.428 0.802 -20.283 177 HH11 ARG 24 HH11 ARG 24 17.620 -0.665 -20.877 178 HH12 ARG 24 HH12 ARG 24 16.985 -2.230 -21.206 179 HH21 ARG 24 HH21 ARG 24 13.568 -1.283 -20.780 180 HH22 ARG 24 HH22 ARG 24 14.629 -2.586 -21.134 181 H LEU 25 H LEU 25 13.839 4.063 -17.021 182 HA LEU 25 HA LEU 25 12.047 6.301 -17.149 183 HB2 LEU 25 HB2 LEU 25 12.521 4.458 -15.270 184 HB3 LEU 25 HB3 LEU 25 13.666 5.615 -14.661 185 HG LEU 25 HG LEU 25 10.662 6.049 -15.119 186 HD11 LEU 25 HD11 LEU 25 12.310 5.768 -12.575 187 HD12 LEU 25 HD12 LEU 25 11.055 4.664 -13.209 188 HD13 LEU 25 HD13 LEU 25 10.609 6.257 -12.631 189 HD21 LEU 25 HD21 LEU 25 12.746 8.029 -14.142 190 HD22 LEU 25 HD22 LEU 25 11.028 8.170 -13.720 191 HD23 LEU 25 HD23 LEU 25 11.493 8.224 -15.395 192 H GLN 26 H GLN 26 12.474 8.498 -17.269 193 HA GLN 26 HA GLN 26 15.159 9.555 -16.624 194 HB2 GLN 26 HB2 GLN 26 13.523 10.165 -19.117 195 HB3 GLN 26 HB3 GLN 26 15.017 10.988 -18.622 196 HG2 GLN 26 HG2 GLN 26 16.094 8.641 -18.679 197 HG3 GLN 26 HG3 GLN 26 14.657 8.128 -19.574 198 HE21 GLN 26 HE21 GLN 26 16.955 7.782 -20.829 199 HE22 GLN 26 HE22 GLN 26 17.282 9.038 -22.046 200 H TYR 27 H TYR 27 14.975 12.126 -16.638 201 HA TYR 27 HA TYR 27 12.389 13.128 -15.906 202 HB2 TYR 27 HB2 TYR 27 13.091 14.002 -13.717 203 HB3 TYR 27 HB3 TYR 27 12.877 12.284 -13.782 204 HD1 TYR 27 HD1 TYR 27 14.904 10.739 -13.781 205 HD2 TYR 27 HD2 TYR 27 15.163 14.960 -12.906 206 HE1 TYR 27 HE1 TYR 27 16.917 10.327 -12.388 207 HE2 TYR 27 HE2 TYR 27 17.156 14.554 -11.510 208 HH TYR 27 HH TYR 27 18.790 12.933 -10.887 209 H GLU 28 H GLU 28 12.416 15.479 -15.620 210 HA GLU 28 HA GLU 28 14.729 16.890 -16.799 211 HB2 GLU 28 HB2 GLU 28 13.139 16.415 -18.581 212 HB3 GLU 28 HB3 GLU 28 11.798 16.978 -17.564 213 HG2 GLU 28 HG2 GLU 28 12.170 18.729 -19.039 214 HG3 GLU 28 HG3 GLU 28 12.977 19.259 -17.560 215 H THR 29 H THR 29 15.273 18.489 -15.426 216 HA THR 29 HA THR 29 13.301 20.170 -14.205 217 HB THR 29 HB THR 29 13.314 18.248 -12.676 218 HG1 THR 29 HG1 THR 29 12.845 20.099 -11.763 219 HG21 THR 29 HG21 THR 29 15.189 17.528 -11.429 220 HG22 THR 29 HG22 THR 29 16.206 18.861 -12.038 221 HG23 THR 29 HG23 THR 29 15.693 17.536 -13.106 222 H SER 30 H SER 30 14.504 21.822 -12.803 223 HA SER 30 HA SER 30 17.277 22.401 -13.627 224 HB2 SER 30 HB2 SER 30 14.961 24.324 -14.023 225 HB3 SER 30 HB3 SER 30 16.662 24.624 -14.419 226 HG SER 30 HG SER 30 15.660 24.074 -16.312 227 H ARG 31 H ARG 31 17.104 21.655 -11.145 228 HA ARG 31 HA ARG 31 17.188 24.105 -9.565 229 HB2 ARG 31 HB2 ARG 31 15.906 23.157 -7.677 230 HB3 ARG 31 HB3 ARG 31 14.891 23.530 -9.049 231 HG2 ARG 31 HG2 ARG 31 14.494 21.284 -9.565 232 HG3 ARG 31 HG3 ARG 31 15.906 20.716 -8.673 233 HD2 ARG 31 HD2 ARG 31 13.982 20.132 -7.382 234 HD3 ARG 31 HD3 ARG 31 14.832 21.408 -6.522 235 HE ARG 31 HE ARG 31 12.412 21.810 -8.242 236 HH11 ARG 31 HH11 ARG 31 13.895 22.491 -5.049 237 HH12 ARG 31 HH12 ARG 31 12.492 23.321 -4.494 238 HH21 ARG 31 HH21 ARG 31 10.783 23.077 -7.578 239 HH22 ARG 31 HH22 ARG 31 10.690 23.758 -5.991 240 H ASP 32 H ASP 32 18.311 23.873 -7.600 241 HA ASP 32 HA ASP 32 20.351 21.720 -7.579 242 HB2 ASP 32 HB2 ASP 32 20.053 24.447 -6.234 243 HB3 ASP 32 HB3 ASP 32 21.313 23.308 -5.794 244 H SER 33 H SER 33 20.928 21.011 -5.282 245 HA SER 33 HA SER 33 20.391 19.916 -3.365 246 HB2 SER 33 HB2 SER 33 20.130 22.489 -2.949 247 HB3 SER 33 HB3 SER 33 18.405 22.144 -2.830 248 HG SER 33 HG SER 33 18.889 21.794 -0.865 249 H ILE 34 H ILE 34 18.999 18.802 -5.569 250 HA ILE 34 HA ILE 34 16.248 18.628 -5.188 251 HB ILE 34 HB ILE 34 18.252 17.119 -6.727 252 HG12 ILE 34 HG12 ILE 34 15.352 17.849 -7.339 253 HG13 ILE 34 HG13 ILE 34 16.689 18.994 -7.426 254 HG21 ILE 34 HG21 ILE 34 15.675 15.612 -6.072 255 HG22 ILE 34 HG22 ILE 34 16.853 15.201 -7.336 256 HG23 ILE 34 HG23 ILE 34 17.324 15.136 -5.639 257 HD11 ILE 34 HD11 ILE 34 17.758 17.492 -9.169 258 HD12 ILE 34 HD12 ILE 34 16.221 16.577 -9.191 259 HD13 ILE 34 HD13 ILE 34 16.242 18.289 -9.629 260 HA PRO 35 HA PRO 35 15.629 16.409 -1.459 261 HB2 PRO 35 HB2 PRO 35 13.196 15.153 -2.121 262 HB3 PRO 35 HB3 PRO 35 13.394 16.838 -1.506 263 HG2 PRO 35 HG2 PRO 35 13.005 15.815 -4.294 264 HG3 PRO 35 HG3 PRO 35 12.389 17.353 -3.582 265 HD2 PRO 35 HD2 PRO 35 14.482 17.242 -5.259 266 HD3 PRO 35 HD3 PRO 35 14.386 18.433 -3.941 267 H THR 36 H THR 36 16.985 14.776 -1.096 268 HA THR 36 HA THR 36 17.595 12.661 -2.848 269 HB THR 36 HB THR 36 19.083 13.546 -1.145 270 HG1 THR 36 HG1 THR 36 19.885 11.758 -1.624 271 HG21 THR 36 HG21 THR 36 17.664 13.910 0.752 272 HG22 THR 36 HG22 THR 36 18.935 12.784 1.209 273 HG23 THR 36 HG23 THR 36 17.303 12.166 0.894 274 H GLU 37 H GLU 37 14.953 13.029 -0.507 275 HA GLU 37 HA GLU 37 14.216 10.306 -0.240 276 HB2 GLU 37 HB2 GLU 37 11.967 11.206 0.307 277 HB3 GLU 37 HB3 GLU 37 13.269 11.871 1.271 278 HG2 GLU 37 HG2 GLU 37 13.182 13.972 -0.125 279 HG3 GLU 37 HG3 GLU 37 11.810 13.301 -0.997 280 H LEU 38 H LEU 38 12.751 12.795 -2.422 281 HA LEU 38 HA LEU 38 11.269 10.956 -3.966 282 HB2 LEU 38 HB2 LEU 38 11.913 13.861 -4.173 283 HB3 LEU 38 HB3 LEU 38 11.894 13.059 -5.720 284 HG LEU 38 HG LEU 38 9.565 12.076 -4.992 285 HD11 LEU 38 HD11 LEU 38 8.449 13.695 -3.400 286 HD12 LEU 38 HD12 LEU 38 10.072 14.134 -2.841 287 HD13 LEU 38 HD13 LEU 38 9.515 12.447 -2.720 288 HD21 LEU 38 HD21 LEU 38 9.251 13.476 -6.656 289 HD22 LEU 38 HD22 LEU 38 10.390 14.689 -6.072 290 HD23 LEU 38 HD23 LEU 38 8.743 14.644 -5.437 291 H LEU 39 H LEU 39 14.527 12.335 -4.468 292 HA LEU 39 HA LEU 39 15.161 11.285 -6.943 293 HB2 LEU 39 HB2 LEU 39 16.444 12.877 -5.517 294 HB3 LEU 39 HB3 LEU 39 16.948 11.544 -4.499 295 HG LEU 39 HG LEU 39 18.639 12.444 -6.066 296 HD11 LEU 39 HD11 LEU 39 18.121 9.517 -6.633 297 HD12 LEU 39 HD12 LEU 39 18.792 10.157 -5.094 298 HD13 LEU 39 HD13 LEU 39 19.658 10.399 -6.630 299 HD21 LEU 39 HD21 LEU 39 18.596 11.927 -8.406 300 HD22 LEU 39 HD22 LEU 39 17.124 12.819 -7.989 301 HD23 LEU 39 HD23 LEU 39 17.047 11.057 -8.246 302 H ASN 40 H ASN 40 15.606 9.708 -3.780 303 HA ASN 40 HA ASN 40 16.529 7.190 -4.898 304 HB2 ASN 40 HB2 ASN 40 15.641 8.072 -2.160 305 HB3 ASN 40 HB3 ASN 40 15.850 6.362 -2.517 306 HD21 ASN 40 HD21 ASN 40 17.571 9.437 -2.185 307 HD22 ASN 40 HD22 ASN 40 19.170 8.709 -2.140 308 H LYS 41 H LYS 41 13.344 8.405 -3.725 309 HA LYS 41 HA LYS 41 11.953 5.987 -3.806 310 HB2 LYS 41 HB2 LYS 41 11.180 8.164 -2.858 311 HB3 LYS 41 HB3 LYS 41 10.844 8.767 -4.485 312 HG2 LYS 41 HG2 LYS 41 9.050 7.281 -4.797 313 HG3 LYS 41 HG3 LYS 41 9.688 6.122 -3.635 314 HD2 LYS 41 HD2 LYS 41 7.691 7.185 -2.757 315 HD3 LYS 41 HD3 LYS 41 9.120 7.559 -1.752 316 HE2 LYS 41 HE2 LYS 41 9.336 9.735 -3.047 317 HE3 LYS 41 HE3 LYS 41 7.849 9.294 -3.886 318 HZ1 LYS 41 HZ1 LYS 41 7.181 10.682 -2.350 319 HZ2 LYS 41 HZ2 LYS 41 8.159 10.222 -1.133 320 HZ3 LYS 41 HZ3 LYS 41 6.813 9.305 -1.566 321 H TRP 42 H TRP 42 12.708 8.228 -6.461 322 HA TRP 42 HA TRP 42 11.185 6.964 -8.451 323 HB2 TRP 42 HB2 TRP 42 13.829 8.358 -8.855 324 HB3 TRP 42 HB3 TRP 42 12.607 8.059 -10.082 325 HD1 TRP 42 HD1 TRP 42 10.194 9.130 -7.950 326 HE1 TRP 42 HE1 TRP 42 9.898 11.660 -7.760 327 HE3 TRP 42 HE3 TRP 42 14.778 10.503 -9.605 328 HZ2 TRP 42 HZ2 TRP 42 11.574 14.028 -8.128 329 HZ3 TRP 42 HZ3 TRP 42 15.427 12.927 -9.685 330 HH2 TRP 42 HH2 TRP 42 13.879 14.653 -8.861 331 H LYS 43 H LYS 43 14.481 6.210 -7.314 332 HA LYS 43 HA LYS 43 14.742 4.111 -9.393 333 HB2 LYS 43 HB2 LYS 43 16.910 3.557 -8.330 334 HB3 LYS 43 HB3 LYS 43 16.784 5.194 -8.961 335 HG2 LYS 43 HG2 LYS 43 16.519 6.141 -6.796 336 HG3 LYS 43 HG3 LYS 43 16.397 4.545 -6.018 337 HD2 LYS 43 HD2 LYS 43 18.883 5.424 -7.526 338 HD3 LYS 43 HD3 LYS 43 18.610 5.807 -5.813 339 HE2 LYS 43 HE2 LYS 43 18.280 3.413 -5.300 340 HE3 LYS 43 HE3 LYS 43 18.610 2.985 -6.984 341 HZ1 LYS 43 HZ1 LYS 43 20.499 2.828 -5.365 342 HZ2 LYS 43 HZ2 LYS 43 20.525 4.432 -5.257 343 HZ3 LYS 43 HZ3 LYS 43 20.861 3.708 -6.715 344 H GLN 44 H GLN 44 13.785 4.303 -6.019 345 HA GLN 44 HA GLN 44 13.917 1.538 -5.386 346 HB2 GLN 44 HB2 GLN 44 13.494 3.384 -3.734 347 HB3 GLN 44 HB3 GLN 44 11.925 3.671 -4.478 348 HG2 GLN 44 HG2 GLN 44 11.285 2.452 -2.685 349 HG3 GLN 44 HG3 GLN 44 11.382 1.176 -3.879 350 HE21 GLN 44 HE21 GLN 44 12.633 -0.636 -3.251 351 HE22 GLN 44 HE22 GLN 44 13.712 -0.612 -1.870 352 H HIS 45 H HIS 45 11.167 3.514 -6.625 353 HA HIS 45 HA HIS 45 9.761 1.022 -7.422 354 HB2 HIS 45 HB2 HIS 45 8.700 3.842 -7.075 355 HB3 HIS 45 HB3 HIS 45 7.756 2.375 -7.359 356 HD1 HIS 45 HD1 HIS 45 7.839 0.515 -5.290 357 HD2 HIS 45 HD2 HIS 45 9.239 4.403 -4.616 358 HE1 HIS 45 HE1 HIS 45 8.058 0.761 -2.762 359 H LYS 46 H LYS 46 11.984 2.034 -9.034 360 HA LYS 46 HA LYS 46 11.334 3.524 -11.263 361 HB2 LYS 46 HB2 LYS 46 13.589 2.651 -10.890 362 HB3 LYS 46 HB3 LYS 46 13.009 0.989 -11.213 363 HG2 LYS 46 HG2 LYS 46 12.592 1.411 -13.461 364 HG3 LYS 46 HG3 LYS 46 12.639 3.164 -13.277 365 HD2 LYS 46 HD2 LYS 46 14.559 2.300 -14.533 366 HD3 LYS 46 HD3 LYS 46 15.033 3.157 -13.063 367 HE2 LYS 46 HE2 LYS 46 16.347 1.112 -13.398 368 HE3 LYS 46 HE3 LYS 46 15.413 1.112 -11.894 369 HZ1 LYS 46 HZ1 LYS 46 14.361 -0.241 -14.305 370 HZ2 LYS 46 HZ2 LYS 46 13.969 -0.508 -12.745 371 HZ3 LYS 46 HZ3 LYS 46 15.407 -1.007 -13.298 372 H GLN 47 H GLN 47 10.816 -0.052 -11.072 373 HA GLN 47 HA GLN 47 9.669 -0.302 -13.576 374 HB2 GLN 47 HB2 GLN 47 10.128 -1.985 -11.373 375 HB3 GLN 47 HB3 GLN 47 8.386 -2.086 -11.600 376 HG2 GLN 47 HG2 GLN 47 10.361 -2.342 -13.895 377 HG3 GLN 47 HG3 GLN 47 9.903 -3.702 -12.869 378 HE21 GLN 47 HE21 GLN 47 7.913 -1.076 -14.591 379 HE22 GLN 47 HE22 GLN 47 6.879 -2.232 -15.335 380 H GLU 48 H GLU 48 7.989 0.186 -10.562 381 HA GLU 48 HA GLU 48 5.335 0.238 -11.461 382 HB2 GLU 48 HB2 GLU 48 6.188 1.951 -9.119 383 HB3 GLU 48 HB3 GLU 48 4.742 0.963 -9.326 384 HG2 GLU 48 HG2 GLU 48 6.337 -1.092 -9.281 385 HG3 GLU 48 HG3 GLU 48 7.589 0.065 -8.772 386 H LEU 49 H LEU 49 7.611 2.937 -11.062 387 HA LEU 49 HA LEU 49 5.870 5.031 -11.909 388 HB2 LEU 49 HB2 LEU 49 8.868 4.718 -12.092 389 HB3 LEU 49 HB3 LEU 49 8.036 6.226 -12.457 390 HG LEU 49 HG LEU 49 7.597 4.877 -9.763 391 HD11 LEU 49 HD11 LEU 49 9.457 5.931 -8.842 392 HD12 LEU 49 HD12 LEU 49 9.846 6.806 -10.366 393 HD13 LEU 49 HD13 LEU 49 10.040 5.042 -10.253 394 HD21 LEU 49 HD21 LEU 49 6.151 6.709 -9.974 395 HD22 LEU 49 HD22 LEU 49 7.329 7.702 -10.857 396 HD23 LEU 49 HD23 LEU 49 7.544 7.389 -9.135 397 H ILE 50 H ILE 50 8.246 3.053 -13.728 398 HA ILE 50 HA ILE 50 7.865 4.310 -16.256 399 HB ILE 50 HB ILE 50 8.418 1.412 -15.534 400 HG12 ILE 50 HG12 ILE 50 10.439 3.360 -16.759 401 HG13 ILE 50 HG13 ILE 50 10.123 3.414 -15.020 402 HG21 ILE 50 HG21 ILE 50 8.476 2.622 -18.315 403 HG22 ILE 50 HG22 ILE 50 9.341 1.123 -17.917 404 HG23 ILE 50 HG23 ILE 50 7.600 1.194 -17.745 405 HD11 ILE 50 HD11 ILE 50 12.035 1.988 -15.534 406 HD12 ILE 50 HD12 ILE 50 10.713 1.070 -14.764 407 HD13 ILE 50 HD13 ILE 50 11.020 0.916 -16.508 408 H ASP 51 H ASP 51 6.298 1.455 -14.917 409 HA ASP 51 HA ASP 51 4.500 0.834 -16.951 410 HB2 ASP 51 HB2 ASP 51 5.110 0.131 -14.236 411 HB3 ASP 51 HB3 ASP 51 3.456 0.522 -14.257 412 H PHE 52 H PHE 52 4.229 3.324 -14.437 413 HA PHE 52 HA PHE 52 1.510 4.037 -15.087 414 HB2 PHE 52 HB2 PHE 52 2.363 4.401 -12.897 415 HB3 PHE 52 HB3 PHE 52 3.677 5.398 -13.492 416 HD1 PHE 52 HD1 PHE 52 3.284 7.746 -14.253 417 HD2 PHE 52 HD2 PHE 52 0.046 5.289 -12.819 418 HE1 PHE 52 HE1 PHE 52 1.906 9.763 -13.946 419 HE2 PHE 52 HE2 PHE 52 -1.365 7.326 -12.588 420 HZ PHE 52 HZ PHE 52 -0.402 9.574 -13.100 421 H LEU 53 H LEU 53 4.722 5.667 -15.664 422 HA LEU 53 HA LEU 53 3.682 7.813 -17.236 423 HB2 LEU 53 HB2 LEU 53 6.388 6.427 -17.129 424 HB3 LEU 53 HB3 LEU 53 6.072 7.735 -18.243 425 HG LEU 53 HG LEU 53 7.213 8.772 -16.503 426 HD11 LEU 53 HD11 LEU 53 4.321 9.482 -15.941 427 HD12 LEU 53 HD12 LEU 53 5.242 10.025 -17.365 428 HD13 LEU 53 HD13 LEU 53 5.754 10.498 -15.747 429 HD21 LEU 53 HD21 LEU 53 5.397 7.504 -14.469 430 HD22 LEU 53 HD22 LEU 53 6.542 8.803 -14.140 431 HD23 LEU 53 HD23 LEU 53 7.126 7.238 -14.718 432 H ASN 54 H ASN 54 4.381 4.498 -17.993 433 HA ASN 54 HA ASN 54 4.381 4.753 -20.877 434 HB2 ASN 54 HB2 ASN 54 5.262 2.839 -19.272 435 HB3 ASN 54 HB3 ASN 54 3.650 2.184 -19.418 436 HD21 ASN 54 HD21 ASN 54 6.587 1.935 -20.422 437 HD22 ASN 54 HD22 ASN 54 6.417 1.406 -22.106 438 H GLN 55 H GLN 55 1.935 3.321 -18.596 439 HA GLN 55 HA GLN 55 -0.049 3.219 -20.596 440 HB2 GLN 55 HB2 GLN 55 -1.561 2.585 -18.817 441 HB3 GLN 55 HB3 GLN 55 0.025 1.824 -18.608 442 HG2 GLN 55 HG2 GLN 55 -0.533 2.399 -16.454 443 HG3 GLN 55 HG3 GLN 55 0.561 3.653 -16.956 444 HE21 GLN 55 HE21 GLN 55 -0.004 5.694 -16.347 445 HE22 GLN 55 HE22 GLN 55 -1.645 6.160 -15.918 446 H LEU 56 H LEU 56 0.976 5.887 -18.622 447 HA LEU 56 HA LEU 56 -1.332 7.532 -18.702 448 HB2 LEU 56 HB2 LEU 56 0.498 7.931 -17.167 449 HB3 LEU 56 HB3 LEU 56 1.643 8.086 -18.495 450 HG LEU 56 HG LEU 56 0.571 10.213 -19.197 451 HD11 LEU 56 HD11 LEU 56 -1.004 11.317 -17.619 452 HD12 LEU 56 HD12 LEU 56 -1.112 9.809 -16.675 453 HD13 LEU 56 HD13 LEU 56 -1.716 9.873 -18.343 454 HD21 LEU 56 HD21 LEU 56 1.441 11.523 -17.311 455 HD22 LEU 56 HD22 LEU 56 2.507 10.185 -17.704 456 HD23 LEU 56 HD23 LEU 56 1.446 10.060 -16.284 457 H ASP 57 H ASP 57 1.379 7.171 -21.025 458 HA ASP 57 HA ASP 57 -0.009 9.139 -22.831 459 HB2 ASP 57 HB2 ASP 57 2.254 9.641 -21.809 460 HB3 ASP 57 HB3 ASP 57 2.915 8.314 -22.755 461 H SER 58 H SER 58 1.634 5.971 -22.758 462 HA SER 58 HA SER 58 1.142 5.560 -25.639 463 HB2 SER 58 HB2 SER 58 2.693 3.963 -23.579 464 HB3 SER 58 HB3 SER 58 2.651 3.643 -25.318 465 HG SER 58 HG SER 58 3.304 6.187 -24.301 466 H GLU 59 H GLU 59 -0.295 4.781 -22.635 467 HA GLU 59 HA GLU 59 -1.708 3.143 -21.869 468 HB2 GLU 59 HB2 GLU 59 -3.896 3.487 -22.790 469 HB3 GLU 59 HB3 GLU 59 -3.009 4.993 -22.606 470 HG2 GLU 59 HG2 GLU 59 -2.509 5.007 -25.042 471 HG3 GLU 59 HG3 GLU 59 -3.445 3.528 -25.239 472 H GLU 60 H GLU 60 0.252 1.718 -23.342 473 HA GLU 60 HA GLU 60 -1.415 -0.630 -24.174 474 HB2 GLU 60 HB2 GLU 60 0.784 0.790 -25.683 475 HB3 GLU 60 HB3 GLU 60 0.599 -0.936 -25.853 476 HG2 GLU 60 HG2 GLU 60 -1.791 -0.636 -26.522 477 HG3 GLU 60 HG3 GLU 60 -1.555 1.117 -26.477 478 H GLN 61 H GLN 61 1.133 0.375 -22.091 479 HA GLN 61 HA GLN 61 2.116 -2.446 -21.970 480 HB2 GLN 61 HB2 GLN 61 3.674 -0.031 -21.183 481 HB3 GLN 61 HB3 GLN 61 4.186 -1.713 -21.172 482 HG2 GLN 61 HG2 GLN 61 3.793 -1.858 -23.639 483 HG3 GLN 61 HG3 GLN 61 3.395 -0.139 -23.668 484 HE21 GLN 61 HE21 GLN 61 5.017 1.086 -24.387 485 HE22 GLN 61 HE22 GLN 61 6.714 0.703 -24.366 486 H THR 62 H THR 62 -0.255 -1.522 -20.782 487 HA THR 62 HA THR 62 -0.034 -1.127 -17.979 488 HB THR 62 HB THR 62 -2.283 -2.356 -19.637 489 HG1 THR 62 HG1 THR 62 -2.662 0.237 -19.331 490 HG21 THR 62 HG21 THR 62 -2.385 -0.648 -17.118 491 HG22 THR 62 HG22 THR 62 -2.605 -2.414 -17.171 492 HG23 THR 62 HG23 THR 62 -3.762 -1.353 -17.996 493 H LYS 63 H LYS 63 1.034 -2.678 -16.746 494 HA LYS 63 HA LYS 63 0.576 -5.556 -17.364 495 HB2 LYS 63 HB2 LYS 63 3.056 -4.036 -16.442 496 HB3 LYS 63 HB3 LYS 63 2.928 -5.774 -16.312 497 HG2 LYS 63 HG2 LYS 63 2.554 -4.314 -18.969 498 HG3 LYS 63 HG3 LYS 63 4.144 -4.776 -18.381 499 HD2 LYS 63 HD2 LYS 63 1.895 -6.795 -18.675 500 HD3 LYS 63 HD3 LYS 63 2.962 -6.376 -20.022 501 HE2 LYS 63 HE2 LYS 63 4.919 -7.136 -18.888 502 HE3 LYS 63 HE3 LYS 63 4.082 -7.187 -17.333 503 HZ1 LYS 63 HZ1 LYS 63 2.750 -8.992 -18.119 504 HZ2 LYS 63 HZ2 LYS 63 4.335 -9.386 -18.214 505 HZ3 LYS 63 HZ3 LYS 63 3.485 -8.997 -19.584 Start of MODEL 6 1 H1 GLY 1 H GLY 1 2.640 0.855 1.388 2 HA2 GLY 1 HA2 GLY 1 2.899 -0.334 -0.732 3 HA3 GLY 1 HA3 GLY 1 1.251 0.202 -1.144 4 H ILE 2 H ILE 2 2.091 1.248 -3.084 5 HA ILE 2 HA ILE 2 2.870 3.996 -2.621 6 HB ILE 2 HB ILE 2 5.123 2.715 -2.839 7 HG12 ILE 2 HG12 ILE 2 6.241 4.094 -4.246 8 HG13 ILE 2 HG13 ILE 2 4.820 4.473 -5.246 9 HG21 ILE 2 HG21 ILE 2 3.947 1.986 -5.534 10 HG22 ILE 2 HG22 ILE 2 5.657 1.903 -5.203 11 HG23 ILE 2 HG23 ILE 2 4.496 0.905 -4.279 12 HD11 ILE 2 HD11 ILE 2 5.251 5.376 -2.367 13 HD12 ILE 2 HD12 ILE 2 5.442 6.374 -3.831 14 HD13 ILE 2 HD13 ILE 2 3.852 5.798 -3.385 15 H ASP 3 H ASP 3 2.748 5.189 -4.762 16 HA ASP 3 HA ASP 3 0.960 3.924 -6.714 17 HB2 ASP 3 HB2 ASP 3 0.553 6.504 -5.248 18 HB3 ASP 3 HB3 ASP 3 -0.261 6.098 -6.722 19 H ALA 4 H ALA 4 1.929 4.349 -8.508 20 HA ALA 4 HA ALA 4 4.263 5.963 -8.775 21 HB1 ALA 4 HB1 ALA 4 3.832 4.107 -10.321 22 HB2 ALA 4 HB2 ALA 4 2.342 4.904 -10.867 23 HB3 ALA 4 HB3 ALA 4 3.926 5.632 -11.231 24 H ALA 5 H ALA 5 0.814 6.631 -9.383 25 HA ALA 5 HA ALA 5 1.112 9.155 -10.650 26 HB1 ALA 5 HB1 ALA 5 -1.228 9.532 -9.973 27 HB2 ALA 5 HB2 ALA 5 -1.038 7.871 -10.551 28 HB3 ALA 5 HB3 ALA 5 -1.135 8.210 -8.803 29 H GLN 6 H GLN 6 0.973 8.261 -7.199 30 HA GLN 6 HA GLN 6 0.871 10.924 -6.180 31 HB2 GLN 6 HB2 GLN 6 1.802 8.274 -5.019 32 HB3 GLN 6 HB3 GLN 6 1.871 9.718 -4.073 33 HG2 GLN 6 HG2 GLN 6 -0.776 9.111 -5.386 34 HG3 GLN 6 HG3 GLN 6 -0.260 8.055 -4.080 35 HE21 GLN 6 HE21 GLN 6 -1.736 11.125 -4.734 36 HE22 GLN 6 HE22 GLN 6 -1.910 11.490 -3.015 37 H ILE 7 H ILE 7 3.595 8.752 -7.099 38 HA ILE 7 HA ILE 7 5.643 10.479 -6.111 39 HB ILE 7 HB ILE 7 5.738 8.318 -8.210 40 HG12 ILE 7 HG12 ILE 7 6.531 8.107 -5.286 41 HG13 ILE 7 HG13 ILE 7 5.002 7.540 -5.911 42 HG21 ILE 7 HG21 ILE 7 7.975 9.524 -6.512 43 HG22 ILE 7 HG22 ILE 7 8.199 8.281 -7.748 44 HG23 ILE 7 HG23 ILE 7 7.741 9.902 -8.230 45 HD11 ILE 7 HD11 ILE 7 7.671 6.449 -6.924 46 HD12 ILE 7 HD12 ILE 7 6.737 5.742 -5.657 47 HD13 ILE 7 HD13 ILE 7 6.038 5.851 -7.285 48 H VAL 8 H VAL 8 3.970 10.212 -9.264 49 HA VAL 8 HA VAL 8 5.756 12.037 -10.636 50 HB VAL 8 HB VAL 8 2.905 11.088 -11.225 51 HG11 VAL 8 HG11 VAL 8 3.253 11.943 -13.533 52 HG12 VAL 8 HG12 VAL 8 3.176 13.245 -12.350 53 HG13 VAL 8 HG13 VAL 8 4.752 12.750 -13.001 54 HG21 VAL 8 HG21 VAL 8 4.622 9.342 -11.375 55 HG22 VAL 8 HG22 VAL 8 4.090 9.788 -13.000 56 HG23 VAL 8 HG23 VAL 8 5.635 10.393 -12.385 57 H ASP 9 H ASP 9 2.680 12.412 -8.859 58 HA ASP 9 HA ASP 9 2.177 15.117 -9.366 59 HB2 ASP 9 HB2 ASP 9 0.691 13.362 -8.345 60 HB3 ASP 9 HB3 ASP 9 1.634 13.468 -6.867 61 H GLU 10 H GLU 10 3.847 13.686 -6.491 62 HA GLU 10 HA GLU 10 4.624 16.197 -5.401 63 HB2 GLU 10 HB2 GLU 10 6.192 14.892 -4.007 64 HB3 GLU 10 HB3 GLU 10 4.568 14.206 -4.035 65 HG2 GLU 10 HG2 GLU 10 5.424 12.595 -5.792 66 HG3 GLU 10 HG3 GLU 10 7.033 13.203 -5.485 67 H ALA 11 H ALA 11 6.315 14.060 -7.755 68 HA ALA 11 HA ALA 11 8.772 15.501 -7.555 69 HB1 ALA 11 HB1 ALA 11 9.314 14.420 -9.751 70 HB2 ALA 11 HB2 ALA 11 8.597 13.240 -8.639 71 HB3 ALA 11 HB3 ALA 11 7.620 13.943 -9.942 72 H LEU 12 H LEU 12 5.842 15.874 -9.596 73 HA LEU 12 HA LEU 12 6.929 17.965 -11.236 74 HB2 LEU 12 HB2 LEU 12 4.104 17.115 -10.535 75 HB3 LEU 12 HB3 LEU 12 4.413 18.457 -11.628 76 HG LEU 12 HG LEU 12 5.473 15.630 -12.109 77 HD11 LEU 12 HD11 LEU 12 3.121 17.028 -13.444 78 HD12 LEU 12 HD12 LEU 12 2.974 15.761 -12.195 79 HD13 LEU 12 HD13 LEU 12 3.712 15.382 -13.762 80 HD21 LEU 12 HD21 LEU 12 6.802 17.353 -13.248 81 HD22 LEU 12 HD22 LEU 12 5.336 18.089 -13.911 82 HD23 LEU 12 HD23 LEU 12 5.820 16.459 -14.426 83 H GLU 13 H GLU 13 5.310 17.981 -8.061 84 HA GLU 13 HA GLU 13 4.836 20.824 -7.945 85 HB2 GLU 13 HB2 GLU 13 5.308 18.686 -5.824 86 HB3 GLU 13 HB3 GLU 13 4.996 20.385 -5.441 87 HG2 GLU 13 HG2 GLU 13 2.823 20.165 -6.698 88 HG3 GLU 13 HG3 GLU 13 3.101 18.441 -6.778 89 H GLN 14 H GLN 14 7.594 18.741 -7.370 90 HA GLN 14 HA GLN 14 9.214 20.798 -6.036 91 HB2 GLN 14 HB2 GLN 14 9.596 17.953 -7.006 92 HB3 GLN 14 HB3 GLN 14 10.916 18.903 -6.303 93 HG2 GLN 14 HG2 GLN 14 9.760 19.062 -4.222 94 HG3 GLN 14 HG3 GLN 14 8.310 18.297 -4.872 95 HE21 GLN 14 HE21 GLN 14 8.800 16.816 -2.919 96 HE22 GLN 14 HE22 GLN 14 9.878 15.488 -3.162 97 H GLY 15 H GLY 15 8.254 20.324 -9.205 98 HA2 GLY 15 HA2 GLY 15 8.914 21.511 -11.073 99 HA3 GLY 15 HA3 GLY 15 10.424 21.966 -10.279 100 H ILE 16 H ILE 16 9.402 18.514 -10.459 101 HA ILE 16 HA ILE 16 11.519 18.081 -12.491 102 HB ILE 16 HB ILE 16 10.793 16.230 -10.217 103 HG12 ILE 16 HG12 ILE 16 13.566 17.186 -10.121 104 HG13 ILE 16 HG13 ILE 16 12.464 18.543 -9.944 105 HG21 ILE 16 HG21 ILE 16 11.591 15.006 -12.117 106 HG22 ILE 16 HG22 ILE 16 12.920 16.146 -12.389 107 HG23 ILE 16 HG23 ILE 16 12.926 15.071 -10.981 108 HD11 ILE 16 HD11 ILE 16 13.090 17.355 -7.773 109 HD12 ILE 16 HD12 ILE 16 11.324 17.476 -8.091 110 HD13 ILE 16 HD13 ILE 16 12.190 15.977 -8.368 111 H THR 17 H THR 17 10.793 17.319 -14.299 112 HA THR 17 HA THR 17 8.129 16.115 -14.523 113 HB THR 17 HB THR 17 10.266 17.352 -16.251 114 HG1 THR 17 HG1 THR 17 7.462 17.570 -16.490 115 HG21 THR 17 HG21 THR 17 8.276 15.347 -17.351 116 HG22 THR 17 HG22 THR 17 10.043 15.354 -17.444 117 HG23 THR 17 HG23 THR 17 9.142 16.582 -18.329 118 H LEU 18 H LEU 18 7.750 13.957 -14.810 119 HA LEU 18 HA LEU 18 10.103 12.121 -15.025 120 HB2 LEU 18 HB2 LEU 18 7.291 11.660 -13.907 121 HB3 LEU 18 HB3 LEU 18 8.484 10.418 -14.226 122 HG LEU 18 HG LEU 18 8.304 12.341 -11.948 123 HD11 LEU 18 HD11 LEU 18 9.167 10.307 -10.791 124 HD12 LEU 18 HD12 LEU 18 9.413 9.521 -12.380 125 HD13 LEU 18 HD13 LEU 18 7.780 9.918 -11.825 126 HD21 LEU 18 HD21 LEU 18 10.708 12.174 -11.418 127 HD22 LEU 18 HD22 LEU 18 10.461 13.060 -12.934 128 HD23 LEU 18 HD23 LEU 18 10.992 11.363 -12.979 129 H PHE 19 H PHE 19 10.015 10.461 -16.501 130 HA PHE 19 HA PHE 19 7.739 9.918 -18.194 131 HB2 PHE 19 HB2 PHE 19 8.612 10.831 -20.318 132 HB3 PHE 19 HB3 PHE 19 8.136 12.069 -19.211 133 HD1 PHE 19 HD1 PHE 19 10.689 11.032 -21.434 134 HD2 PHE 19 HD2 PHE 19 10.065 13.195 -17.755 135 HE1 PHE 19 HE1 PHE 19 12.869 12.198 -21.707 136 HE2 PHE 19 HE2 PHE 19 12.212 14.331 -18.042 137 HZ PHE 19 HZ PHE 19 13.646 13.810 -19.970 138 H VAL 20 H VAL 20 8.631 8.579 -20.233 139 HA VAL 20 HA VAL 20 11.038 7.028 -19.403 140 HB VAL 20 HB VAL 20 8.499 5.822 -20.592 141 HG11 VAL 20 HG11 VAL 20 9.488 3.697 -20.088 142 HG12 VAL 20 HG12 VAL 20 10.614 4.622 -21.082 143 HG13 VAL 20 HG13 VAL 20 10.900 4.468 -19.332 144 HG21 VAL 20 HG21 VAL 20 9.474 5.630 -17.700 145 HG22 VAL 20 HG22 VAL 20 8.109 6.608 -18.245 146 HG23 VAL 20 HG23 VAL 20 8.017 4.869 -18.415 147 H VAL 21 H VAL 21 12.509 6.726 -20.956 148 HA VAL 21 HA VAL 21 11.827 7.255 -23.809 149 HB VAL 21 HB VAL 21 14.188 8.250 -22.166 150 HG11 VAL 21 HG11 VAL 21 15.109 9.143 -24.306 151 HG12 VAL 21 HG12 VAL 21 15.165 7.382 -24.233 152 HG13 VAL 21 HG13 VAL 21 13.912 8.188 -25.203 153 HG21 VAL 21 HG21 VAL 21 12.154 9.626 -22.194 154 HG22 VAL 21 HG22 VAL 21 13.443 10.421 -23.101 155 HG23 VAL 21 HG23 VAL 21 12.144 9.615 -23.975 156 H ASN 22 H ASN 22 12.132 5.513 -24.929 157 HA ASN 22 HA ASN 22 12.627 3.403 -25.556 158 HB2 ASN 22 HB2 ASN 22 15.407 4.204 -24.587 159 HB3 ASN 22 HB3 ASN 22 15.043 2.757 -25.508 160 HD21 ASN 22 HD21 ASN 22 16.018 5.960 -25.886 161 HD22 ASN 22 HD22 ASN 22 15.589 6.115 -27.572 162 H ASN 23 H ASN 23 11.216 3.368 -23.118 163 HA ASN 23 HA ASN 23 10.733 2.176 -21.398 164 HB2 ASN 23 HB2 ASN 23 10.813 0.472 -23.046 165 HB3 ASN 23 HB3 ASN 23 12.532 0.159 -22.751 166 HD21 ASN 23 HD21 ASN 23 9.353 0.329 -20.895 167 HD22 ASN 23 HD22 ASN 23 9.802 -0.960 -19.888 168 H ARG 24 H ARG 24 13.288 3.978 -21.229 169 HA ARG 24 HA ARG 24 14.291 2.892 -18.640 170 HB2 ARG 24 HB2 ARG 24 15.707 4.895 -20.443 171 HB3 ARG 24 HB3 ARG 24 16.345 4.087 -19.010 172 HG2 ARG 24 HG2 ARG 24 15.680 2.833 -21.689 173 HG3 ARG 24 HG3 ARG 24 17.287 3.136 -21.074 174 HD2 ARG 24 HD2 ARG 24 17.170 1.398 -19.472 175 HD3 ARG 24 HD3 ARG 24 15.401 1.282 -19.613 176 HE ARG 24 HE ARG 24 16.436 0.794 -22.154 177 HH11 ARG 24 HH11 ARG 24 16.527 -0.936 -18.994 178 HH12 ARG 24 HH12 ARG 24 16.259 -2.459 -19.742 179 HH21 ARG 24 HH21 ARG 24 16.170 -1.187 -23.069 180 HH22 ARG 24 HH22 ARG 24 16.139 -2.634 -22.116 181 H LEU 25 H LEU 25 13.758 4.099 -16.910 182 HA LEU 25 HA LEU 25 11.951 6.360 -17.152 183 HB2 LEU 25 HB2 LEU 25 11.646 4.851 -15.305 184 HB3 LEU 25 HB3 LEU 25 13.346 4.948 -14.846 185 HG LEU 25 HG LEU 25 13.047 7.257 -14.045 186 HD11 LEU 25 HD11 LEU 25 11.352 8.156 -15.454 187 HD12 LEU 25 HD12 LEU 25 10.745 8.190 -13.810 188 HD13 LEU 25 HD13 LEU 25 10.158 6.938 -14.932 189 HD21 LEU 25 HD21 LEU 25 10.994 5.313 -12.949 190 HD22 LEU 25 HD22 LEU 25 11.644 6.743 -12.113 191 HD23 LEU 25 HD23 LEU 25 12.716 5.402 -12.502 192 H GLN 26 H GLN 26 12.654 8.452 -17.573 193 HA GLN 26 HA GLN 26 15.124 9.293 -16.211 194 HB2 GLN 26 HB2 GLN 26 14.543 10.509 -18.902 195 HB3 GLN 26 HB3 GLN 26 16.042 10.359 -18.029 196 HG2 GLN 26 HG2 GLN 26 15.630 7.723 -18.532 197 HG3 GLN 26 HG3 GLN 26 14.748 8.413 -19.888 198 HE21 GLN 26 HE21 GLN 26 16.131 10.256 -21.118 199 HE22 GLN 26 HE22 GLN 26 17.796 9.821 -21.359 200 H TYR 27 H TYR 27 15.169 11.848 -16.254 201 HA TYR 27 HA TYR 27 12.493 13.004 -15.984 202 HB2 TYR 27 HB2 TYR 27 12.865 13.746 -13.698 203 HB3 TYR 27 HB3 TYR 27 12.895 11.992 -13.785 204 HD1 TYR 27 HD1 TYR 27 14.958 10.754 -13.543 205 HD2 TYR 27 HD2 TYR 27 14.844 15.017 -13.054 206 HE1 TYR 27 HE1 TYR 27 17.127 10.678 -12.265 207 HE2 TYR 27 HE2 TYR 27 16.994 14.973 -11.827 208 HH TYR 27 HH TYR 27 18.678 13.646 -10.964 209 H GLU 28 H GLU 28 12.692 15.360 -15.510 210 HA GLU 28 HA GLU 28 15.256 16.561 -16.324 211 HB2 GLU 28 HB2 GLU 28 14.089 16.164 -18.380 212 HB3 GLU 28 HB3 GLU 28 12.577 16.840 -17.746 213 HG2 GLU 28 HG2 GLU 28 13.341 19.011 -17.791 214 HG3 GLU 28 HG3 GLU 28 15.057 18.556 -17.703 215 H THR 29 H THR 29 15.547 18.610 -15.325 216 HA THR 29 HA THR 29 13.413 20.155 -14.256 217 HB THR 29 HB THR 29 13.554 18.330 -12.582 218 HG1 THR 29 HG1 THR 29 13.014 20.257 -11.773 219 HG21 THR 29 HG21 THR 29 15.411 17.861 -11.254 220 HG22 THR 29 HG22 THR 29 16.391 19.183 -11.950 221 HG23 THR 29 HG23 THR 29 15.989 17.735 -12.905 222 H SER 30 H SER 30 14.474 22.136 -13.187 223 HA SER 30 HA SER 30 17.331 22.555 -13.866 224 HB2 SER 30 HB2 SER 30 15.076 24.321 -14.896 225 HB3 SER 30 HB3 SER 30 16.813 24.676 -14.979 226 HG SER 30 HG SER 30 16.762 22.360 -15.977 227 H ARG 31 H ARG 31 17.325 22.268 -11.495 228 HA ARG 31 HA ARG 31 17.235 24.811 -10.169 229 HB2 ARG 31 HB2 ARG 31 15.705 24.075 -8.338 230 HB3 ARG 31 HB3 ARG 31 14.877 24.248 -9.878 231 HG2 ARG 31 HG2 ARG 31 14.662 21.962 -10.223 232 HG3 ARG 31 HG3 ARG 31 15.926 21.507 -9.075 233 HD2 ARG 31 HD2 ARG 31 13.261 22.753 -8.307 234 HD3 ARG 31 HD3 ARG 31 13.619 21.021 -8.309 235 HE ARG 31 HE ARG 31 15.646 22.056 -6.760 236 HH11 ARG 31 HH11 ARG 31 12.089 22.146 -6.588 237 HH12 ARG 31 HH12 ARG 31 12.069 22.187 -4.845 238 HH21 ARG 31 HH21 ARG 31 15.576 21.834 -4.530 239 HH22 ARG 31 HH22 ARG 31 14.024 21.836 -3.703 240 H ASP 32 H ASP 32 17.633 24.136 -7.625 241 HA ASP 32 HA ASP 32 19.829 22.113 -7.651 242 HB2 ASP 32 HB2 ASP 32 19.603 24.898 -6.474 243 HB3 ASP 32 HB3 ASP 32 20.683 23.718 -5.736 244 H SER 33 H SER 33 20.376 21.484 -5.431 245 HA SER 33 HA SER 33 19.946 20.173 -3.698 246 HB2 SER 33 HB2 SER 33 19.680 22.624 -2.948 247 HB3 SER 33 HB3 SER 33 17.951 22.302 -2.881 248 HG SER 33 HG SER 33 20.100 21.327 -1.364 249 H ILE 34 H ILE 34 18.859 18.702 -5.444 250 HA ILE 34 HA ILE 34 15.982 18.562 -5.310 251 HB ILE 34 HB ILE 34 18.157 16.880 -6.516 252 HG12 ILE 34 HG12 ILE 34 15.468 17.909 -7.556 253 HG13 ILE 34 HG13 ILE 34 16.957 18.829 -7.610 254 HG21 ILE 34 HG21 ILE 34 15.361 15.751 -6.065 255 HG22 ILE 34 HG22 ILE 34 16.563 15.085 -7.180 256 HG23 ILE 34 HG23 ILE 34 16.860 15.095 -5.443 257 HD11 ILE 34 HD11 ILE 34 16.209 16.384 -9.186 258 HD12 ILE 34 HD12 ILE 34 16.886 17.941 -9.728 259 HD13 ILE 34 HD13 ILE 34 17.935 16.784 -8.915 260 HA PRO 35 HA PRO 35 15.756 16.483 -1.362 261 HB2 PRO 35 HB2 PRO 35 13.292 15.269 -1.716 262 HB3 PRO 35 HB3 PRO 35 13.491 17.009 -1.272 263 HG2 PRO 35 HG2 PRO 35 12.947 15.694 -3.885 264 HG3 PRO 35 HG3 PRO 35 12.256 17.237 -3.337 265 HD2 PRO 35 HD2 PRO 35 14.236 17.202 -5.084 266 HD3 PRO 35 HD3 PRO 35 14.159 18.435 -3.798 267 H THR 36 H THR 36 17.361 14.798 -1.431 268 HA THR 36 HA THR 36 17.334 12.760 -3.359 269 HB THR 36 HB THR 36 18.530 12.192 -0.667 270 HG1 THR 36 HG1 THR 36 20.287 13.486 -1.240 271 HG21 THR 36 HG21 THR 36 20.317 11.260 -2.088 272 HG22 THR 36 HG22 THR 36 19.574 11.953 -3.540 273 HG23 THR 36 HG23 THR 36 18.772 10.648 -2.659 274 H GLU 37 H GLU 37 15.493 13.043 -0.392 275 HA GLU 37 HA GLU 37 14.818 10.350 0.067 276 HB2 GLU 37 HB2 GLU 37 12.864 11.298 1.274 277 HB3 GLU 37 HB3 GLU 37 14.408 12.036 1.683 278 HG2 GLU 37 HG2 GLU 37 13.806 13.929 0.041 279 HG3 GLU 37 HG3 GLU 37 12.173 13.245 0.006 280 H LEU 38 H LEU 38 13.488 12.706 -2.280 281 HA LEU 38 HA LEU 38 11.400 10.822 -3.123 282 HB2 LEU 38 HB2 LEU 38 11.371 13.514 -3.124 283 HB3 LEU 38 HB3 LEU 38 12.121 13.273 -4.682 284 HG LEU 38 HG LEU 38 9.324 12.775 -3.777 285 HD11 LEU 38 HD11 LEU 38 10.665 13.891 -6.240 286 HD12 LEU 38 HD12 LEU 38 9.326 14.526 -5.255 287 HD13 LEU 38 HD13 LEU 38 9.028 13.259 -6.393 288 HD21 LEU 38 HD21 LEU 38 8.729 11.256 -5.544 289 HD22 LEU 38 HD22 LEU 38 9.837 10.486 -4.430 290 HD23 LEU 38 HD23 LEU 38 10.453 11.047 -5.971 291 H LEU 39 H LEU 39 14.494 12.191 -4.271 292 HA LEU 39 HA LEU 39 14.681 11.129 -6.828 293 HB2 LEU 39 HB2 LEU 39 16.274 12.625 -5.327 294 HB3 LEU 39 HB3 LEU 39 17.104 11.099 -5.016 295 HG LEU 39 HG LEU 39 16.627 12.495 -7.670 296 HD11 LEU 39 HD11 LEU 39 18.404 13.428 -6.185 297 HD12 LEU 39 HD12 LEU 39 19.039 12.790 -7.698 298 HD13 LEU 39 HD13 LEU 39 19.217 11.850 -6.196 299 HD21 LEU 39 HD21 LEU 39 18.033 10.780 -8.745 300 HD22 LEU 39 HD22 LEU 39 16.544 10.082 -8.138 301 HD23 LEU 39 HD23 LEU 39 18.058 9.835 -7.236 302 H ASN 40 H ASN 40 15.686 9.652 -3.760 303 HA ASN 40 HA ASN 40 16.474 7.107 -4.781 304 HB2 ASN 40 HB2 ASN 40 15.625 7.997 -1.994 305 HB3 ASN 40 HB3 ASN 40 16.090 6.334 -2.359 306 HD21 ASN 40 HD21 ASN 40 17.502 8.558 -0.669 307 HD22 ASN 40 HD22 ASN 40 19.106 8.550 -1.341 308 H LYS 41 H LYS 41 13.269 8.339 -3.768 309 HA LYS 41 HA LYS 41 11.976 5.773 -3.754 310 HB2 LYS 41 HB2 LYS 41 11.001 7.555 -2.549 311 HB3 LYS 41 HB3 LYS 41 10.930 8.614 -3.948 312 HG2 LYS 41 HG2 LYS 41 9.154 7.381 -4.953 313 HG3 LYS 41 HG3 LYS 41 9.420 6.015 -3.881 314 HD2 LYS 41 HD2 LYS 41 7.440 7.072 -3.156 315 HD3 LYS 41 HD3 LYS 41 8.687 7.378 -1.937 316 HE2 LYS 41 HE2 LYS 41 9.043 9.632 -2.918 317 HE3 LYS 41 HE3 LYS 41 7.746 9.315 -4.099 318 HZ1 LYS 41 HZ1 LYS 41 6.967 10.618 -2.331 319 HZ2 LYS 41 HZ2 LYS 41 7.436 9.571 -1.164 320 HZ3 LYS 41 HZ3 LYS 41 6.211 9.207 -2.221 321 H TRP 42 H TRP 42 12.686 8.159 -6.359 322 HA TRP 42 HA TRP 42 11.058 6.959 -8.326 323 HB2 TRP 42 HB2 TRP 42 13.770 8.236 -8.778 324 HB3 TRP 42 HB3 TRP 42 12.553 7.875 -10.006 325 HD1 TRP 42 HD1 TRP 42 10.124 9.124 -8.126 326 HE1 TRP 42 HE1 TRP 42 9.890 11.666 -8.056 327 HE3 TRP 42 HE3 TRP 42 14.823 10.398 -9.694 328 HZ2 TRP 42 HZ2 TRP 42 11.571 13.943 -8.432 329 HZ3 TRP 42 HZ3 TRP 42 15.508 12.801 -9.718 330 HH2 TRP 42 HH2 TRP 42 13.932 14.549 -8.998 331 H LYS 43 H LYS 43 14.577 6.349 -7.718 332 HA LYS 43 HA LYS 43 14.626 4.149 -9.546 333 HB2 LYS 43 HB2 LYS 43 16.805 3.563 -8.520 334 HB3 LYS 43 HB3 LYS 43 16.684 5.236 -9.055 335 HG2 LYS 43 HG2 LYS 43 16.383 6.042 -6.811 336 HG3 LYS 43 HG3 LYS 43 16.245 4.396 -6.168 337 HD2 LYS 43 HD2 LYS 43 18.762 5.430 -7.522 338 HD3 LYS 43 HD3 LYS 43 18.438 5.598 -5.792 339 HE2 LYS 43 HE2 LYS 43 18.092 3.088 -5.669 340 HE3 LYS 43 HE3 LYS 43 18.662 2.979 -7.344 341 HZ1 LYS 43 HZ1 LYS 43 20.217 4.099 -5.092 342 HZ2 LYS 43 HZ2 LYS 43 20.746 3.960 -6.634 343 HZ3 LYS 43 HZ3 LYS 43 20.446 2.609 -5.746 344 H GLN 44 H GLN 44 13.489 4.355 -6.297 345 HA GLN 44 HA GLN 44 13.821 1.619 -5.544 346 HB2 GLN 44 HB2 GLN 44 13.216 3.617 -4.010 347 HB3 GLN 44 HB3 GLN 44 11.583 3.473 -4.619 348 HG2 GLN 44 HG2 GLN 44 11.271 2.124 -2.879 349 HG3 GLN 44 HG3 GLN 44 12.008 0.885 -3.888 350 HE21 GLN 44 HE21 GLN 44 12.106 1.529 -0.860 351 HE22 GLN 44 HE22 GLN 44 13.798 1.852 -0.453 352 H HIS 45 H HIS 45 11.015 3.451 -6.854 353 HA HIS 45 HA HIS 45 9.681 0.896 -7.599 354 HB2 HIS 45 HB2 HIS 45 8.426 3.653 -7.226 355 HB3 HIS 45 HB3 HIS 45 7.606 2.127 -7.483 356 HD1 HIS 45 HD1 HIS 45 7.557 0.458 -5.330 357 HD2 HIS 45 HD2 HIS 45 9.244 4.256 -4.879 358 HE1 HIS 45 HE1 HIS 45 7.878 0.824 -2.798 359 H LYS 46 H LYS 46 11.863 1.983 -9.153 360 HA LYS 46 HA LYS 46 11.188 3.524 -11.359 361 HB2 LYS 46 HB2 LYS 46 13.438 2.938 -10.975 362 HB3 LYS 46 HB3 LYS 46 13.130 1.202 -11.123 363 HG2 LYS 46 HG2 LYS 46 12.828 1.326 -13.459 364 HG3 LYS 46 HG3 LYS 46 12.582 3.087 -13.443 365 HD2 LYS 46 HD2 LYS 46 14.890 3.493 -12.913 366 HD3 LYS 46 HD3 LYS 46 15.202 1.765 -12.672 367 HE2 LYS 46 HE2 LYS 46 14.179 2.798 -15.332 368 HE3 LYS 46 HE3 LYS 46 15.903 2.926 -14.929 369 HZ1 LYS 46 HZ1 LYS 46 15.257 0.855 -16.151 370 HZ2 LYS 46 HZ2 LYS 46 14.442 0.358 -14.843 371 HZ3 LYS 46 HZ3 LYS 46 16.057 0.611 -14.716 372 H GLN 47 H GLN 47 10.807 -0.069 -11.231 373 HA GLN 47 HA GLN 47 9.665 -0.145 -13.840 374 HB2 GLN 47 HB2 GLN 47 10.158 -2.021 -11.663 375 HB3 GLN 47 HB3 GLN 47 8.576 -2.313 -12.342 376 HG2 GLN 47 HG2 GLN 47 10.889 -1.861 -14.238 377 HG3 GLN 47 HG3 GLN 47 10.762 -3.399 -13.386 378 HE21 GLN 47 HE21 GLN 47 8.085 -1.311 -14.823 379 HE22 GLN 47 HE22 GLN 47 7.548 -2.604 -15.836 380 H GLU 48 H GLU 48 8.152 0.439 -10.751 381 HA GLU 48 HA GLU 48 5.427 0.140 -11.633 382 HB2 GLU 48 HB2 GLU 48 6.302 1.980 -9.382 383 HB3 GLU 48 HB3 GLU 48 4.795 1.118 -9.611 384 HG2 GLU 48 HG2 GLU 48 6.308 -1.052 -9.334 385 HG3 GLU 48 HG3 GLU 48 7.482 0.100 -8.668 386 H LEU 49 H LEU 49 7.601 2.919 -11.203 387 HA LEU 49 HA LEU 49 5.831 4.957 -12.130 388 HB2 LEU 49 HB2 LEU 49 8.859 4.722 -12.284 389 HB3 LEU 49 HB3 LEU 49 7.989 6.204 -12.664 390 HG LEU 49 HG LEU 49 7.519 4.858 -9.985 391 HD11 LEU 49 HD11 LEU 49 9.349 5.992 -9.032 392 HD12 LEU 49 HD12 LEU 49 9.761 6.812 -10.577 393 HD13 LEU 49 HD13 LEU 49 9.955 5.050 -10.404 394 HD21 LEU 49 HD21 LEU 49 6.057 6.765 -10.702 395 HD22 LEU 49 HD22 LEU 49 7.511 7.788 -10.839 396 HD23 LEU 49 HD23 LEU 49 7.042 7.085 -9.279 397 H ILE 50 H ILE 50 8.198 2.889 -13.804 398 HA ILE 50 HA ILE 50 7.776 4.116 -16.347 399 HB ILE 50 HB ILE 50 8.576 1.248 -15.733 400 HG12 ILE 50 HG12 ILE 50 10.403 3.377 -16.897 401 HG13 ILE 50 HG13 ILE 50 10.105 3.337 -15.153 402 HG21 ILE 50 HG21 ILE 50 7.605 1.173 -17.922 403 HG22 ILE 50 HG22 ILE 50 8.486 2.606 -18.428 404 HG23 ILE 50 HG23 ILE 50 9.354 1.084 -18.111 405 HD11 ILE 50 HD11 ILE 50 12.150 2.107 -15.757 406 HD12 ILE 50 HD12 ILE 50 10.947 1.078 -14.953 407 HD13 ILE 50 HD13 ILE 50 11.193 0.964 -16.713 408 H ASP 51 H ASP 51 6.220 1.180 -14.955 409 HA ASP 51 HA ASP 51 4.454 0.669 -17.011 410 HB2 ASP 51 HB2 ASP 51 4.634 -0.818 -15.120 411 HB3 ASP 51 HB3 ASP 51 4.110 0.449 -14.003 412 H PHE 52 H PHE 52 4.173 3.086 -14.459 413 HA PHE 52 HA PHE 52 1.499 3.888 -15.110 414 HB2 PHE 52 HB2 PHE 52 2.346 4.139 -12.926 415 HB3 PHE 52 HB3 PHE 52 3.683 5.161 -13.478 416 HD1 PHE 52 HD1 PHE 52 3.439 7.474 -13.114 417 HD2 PHE 52 HD2 PHE 52 -0.091 5.074 -13.753 418 HE1 PHE 52 HE1 PHE 52 1.991 9.511 -12.958 419 HE2 PHE 52 HE2 PHE 52 -1.488 7.101 -13.556 420 HZ PHE 52 HZ PHE 52 -0.394 9.348 -13.145 421 H LEU 53 H LEU 53 4.664 5.554 -15.674 422 HA LEU 53 HA LEU 53 3.587 7.757 -17.132 423 HB2 LEU 53 HB2 LEU 53 6.314 6.435 -16.971 424 HB3 LEU 53 HB3 LEU 53 6.012 7.716 -18.133 425 HG LEU 53 HG LEU 53 7.149 8.702 -16.369 426 HD11 LEU 53 HD11 LEU 53 5.711 10.476 -15.642 427 HD12 LEU 53 HD12 LEU 53 4.262 9.483 -15.884 428 HD13 LEU 53 HD13 LEU 53 5.230 10.011 -17.281 429 HD21 LEU 53 HD21 LEU 53 5.209 7.483 -14.420 430 HD22 LEU 53 HD22 LEU 53 6.365 8.779 -14.022 431 HD23 LEU 53 HD23 LEU 53 6.950 7.212 -14.575 432 H ASN 54 H ASN 54 4.338 4.441 -18.026 433 HA ASN 54 HA ASN 54 4.322 4.938 -20.874 434 HB2 ASN 54 HB2 ASN 54 5.202 2.819 -19.338 435 HB3 ASN 54 HB3 ASN 54 3.772 2.147 -19.981 436 HD21 ASN 54 HD21 ASN 54 6.902 3.532 -20.530 437 HD22 ASN 54 HD22 ASN 54 6.948 3.345 -22.275 438 H GLN 55 H GLN 55 1.955 3.304 -18.646 439 HA GLN 55 HA GLN 55 -0.068 3.222 -20.634 440 HB2 GLN 55 HB2 GLN 55 -1.564 2.520 -18.906 441 HB3 GLN 55 HB3 GLN 55 0.019 1.772 -18.680 442 HG2 GLN 55 HG2 GLN 55 -0.564 2.295 -16.530 443 HG3 GLN 55 HG3 GLN 55 0.479 3.610 -16.977 444 HE21 GLN 55 HE21 GLN 55 -0.240 5.658 -16.449 445 HE22 GLN 55 HE22 GLN 55 -1.910 6.044 -16.043 446 H LEU 56 H LEU 56 0.995 5.907 -18.680 447 HA LEU 56 HA LEU 56 -1.377 7.389 -18.547 448 HB2 LEU 56 HB2 LEU 56 1.433 7.754 -17.960 449 HB3 LEU 56 HB3 LEU 56 0.980 9.095 -18.954 450 HG LEU 56 HG LEU 56 -0.288 8.292 -16.305 451 HD11 LEU 56 HD11 LEU 56 0.681 10.499 -15.652 452 HD12 LEU 56 HD12 LEU 56 1.329 10.675 -17.306 453 HD13 LEU 56 HD13 LEU 56 1.924 9.377 -16.239 454 HD21 LEU 56 HD21 LEU 56 -1.596 10.434 -16.541 455 HD22 LEU 56 HD22 LEU 56 -2.085 9.245 -17.765 456 HD23 LEU 56 HD23 LEU 56 -0.999 10.549 -18.211 457 H ASP 57 H ASP 57 0.630 6.852 -21.289 458 HA ASP 57 HA ASP 57 -0.901 8.962 -22.745 459 HB2 ASP 57 HB2 ASP 57 1.633 9.350 -22.002 460 HB3 ASP 57 HB3 ASP 57 1.947 8.511 -23.499 461 H SER 58 H SER 58 0.418 5.767 -22.733 462 HA SER 58 HA SER 58 -0.278 5.353 -25.606 463 HB2 SER 58 HB2 SER 58 1.348 3.513 -23.826 464 HB3 SER 58 HB3 SER 58 1.239 3.536 -25.599 465 HG SER 58 HG SER 58 3.080 4.599 -25.249 466 H GLU 59 H GLU 59 -1.003 4.453 -22.303 467 HA GLU 59 HA GLU 59 -2.270 2.845 -21.331 468 HB2 GLU 59 HB2 GLU 59 -4.617 3.150 -21.660 469 HB3 GLU 59 HB3 GLU 59 -3.739 4.670 -21.570 470 HG2 GLU 59 HG2 GLU 59 -3.922 4.955 -24.027 471 HG3 GLU 59 HG3 GLU 59 -4.793 3.409 -24.119 472 H GLU 60 H GLU 60 -0.650 1.493 -23.021 473 HA GLU 60 HA GLU 60 -2.321 -0.847 -23.644 474 HB2 GLU 60 HB2 GLU 60 -1.478 -1.111 -25.868 475 HB3 GLU 60 HB3 GLU 60 -2.300 0.440 -25.706 476 HG2 GLU 60 HG2 GLU 60 -0.208 1.661 -25.782 477 HG3 GLU 60 HG3 GLU 60 0.732 0.197 -25.524 478 H GLN 61 H GLN 61 -0.370 -0.296 -21.562 479 HA GLN 61 HA GLN 61 1.381 -2.623 -22.001 480 HB2 GLN 61 HB2 GLN 61 2.244 0.183 -21.256 481 HB3 GLN 61 HB3 GLN 61 3.106 -1.222 -20.607 482 HG2 GLN 61 HG2 GLN 61 2.695 -1.045 -23.589 483 HG3 GLN 61 HG3 GLN 61 3.944 -0.098 -22.790 484 HE21 GLN 61 HE21 GLN 61 5.683 -1.200 -23.663 485 HE22 GLN 61 HE22 GLN 61 6.196 -2.759 -23.142 486 H THR 62 H THR 62 1.825 -3.717 -20.113 487 HA THR 62 HA THR 62 0.526 -2.911 -17.592 488 HB THR 62 HB THR 62 -0.156 -5.644 -17.885 489 HG1 THR 62 HG1 THR 62 -0.992 -5.961 -19.765 490 HG21 THR 62 HG21 THR 62 -1.906 -3.192 -18.269 491 HG22 THR 62 HG22 THR 62 -1.496 -3.970 -16.724 492 HG23 THR 62 HG23 THR 62 -2.474 -4.844 -17.913 493 H LYS 63 H LYS 63 3.411 -3.400 -18.736 494 HA LYS 63 HA LYS 63 4.251 -5.184 -16.533 495 HB2 LYS 63 HB2 LYS 63 5.592 -5.279 -19.259 496 HB3 LYS 63 HB3 LYS 63 5.818 -6.323 -17.867 497 HG2 LYS 63 HG2 LYS 63 4.607 -7.750 -19.152 498 HG3 LYS 63 HG3 LYS 63 3.301 -7.000 -18.258 499 HD2 LYS 63 HD2 LYS 63 2.578 -7.035 -20.522 500 HD3 LYS 63 HD3 LYS 63 3.081 -5.371 -20.269 501 HE2 LYS 63 HE2 LYS 63 5.339 -5.985 -21.264 502 HE3 LYS 63 HE3 LYS 63 4.660 -7.570 -21.665 503 HZ1 LYS 63 HZ1 LYS 63 2.948 -6.350 -22.966 504 HZ2 LYS 63 HZ2 LYS 63 4.461 -6.044 -23.531 505 HZ3 LYS 63 HZ3 LYS 63 3.697 -4.943 -22.626 Start of MODEL 7 1 H1 GLY 1 H GLY 1 -0.185 -1.094 -0.222 2 HA2 GLY 1 HA2 GLY 1 2.063 -0.530 -0.945 3 HA3 GLY 1 HA3 GLY 1 1.032 -0.900 -2.348 4 H ILE 2 H ILE 2 3.237 0.631 -2.875 5 HA ILE 2 HA ILE 2 2.698 3.492 -2.651 6 HB ILE 2 HB ILE 2 5.021 2.563 -2.707 7 HG12 ILE 2 HG12 ILE 2 6.102 3.883 -4.299 8 HG13 ILE 2 HG13 ILE 2 4.613 4.154 -5.229 9 HG21 ILE 2 HG21 ILE 2 5.340 0.718 -3.945 10 HG22 ILE 2 HG22 ILE 2 4.040 1.112 -5.068 11 HG23 ILE 2 HG23 ILE 2 5.624 1.829 -5.293 12 HD11 ILE 2 HD11 ILE 2 5.227 6.097 -3.810 13 HD12 ILE 2 HD12 ILE 2 3.682 5.425 -3.295 14 HD13 ILE 2 HD13 ILE 2 5.158 5.076 -2.361 15 H ASP 3 H ASP 3 2.377 4.919 -4.478 16 HA ASP 3 HA ASP 3 0.712 3.724 -6.620 17 HB2 ASP 3 HB2 ASP 3 0.420 6.400 -5.274 18 HB3 ASP 3 HB3 ASP 3 -0.554 5.770 -6.564 19 H ALA 4 H ALA 4 1.712 4.148 -8.493 20 HA ALA 4 HA ALA 4 4.165 5.630 -8.661 21 HB1 ALA 4 HB1 ALA 4 3.651 3.784 -10.208 22 HB2 ALA 4 HB2 ALA 4 2.255 4.696 -10.820 23 HB3 ALA 4 HB3 ALA 4 3.904 5.297 -11.097 24 H ALA 5 H ALA 5 0.773 6.402 -9.399 25 HA ALA 5 HA ALA 5 1.169 8.913 -10.653 26 HB1 ALA 5 HB1 ALA 5 -1.001 7.731 -10.648 27 HB2 ALA 5 HB2 ALA 5 -1.133 7.974 -8.888 28 HB3 ALA 5 HB3 ALA 5 -1.168 9.369 -9.978 29 H GLN 6 H GLN 6 0.889 8.047 -7.156 30 HA GLN 6 HA GLN 6 0.918 10.713 -6.226 31 HB2 GLN 6 HB2 GLN 6 1.751 8.056 -4.970 32 HB3 GLN 6 HB3 GLN 6 1.838 9.534 -4.067 33 HG2 GLN 6 HG2 GLN 6 -0.686 8.371 -5.276 34 HG3 GLN 6 HG3 GLN 6 -0.232 8.319 -3.584 35 HE21 GLN 6 HE21 GLN 6 0.708 11.200 -3.513 36 HE22 GLN 6 HE22 GLN 6 -0.658 12.185 -3.982 37 H ILE 7 H ILE 7 3.554 8.518 -7.211 38 HA ILE 7 HA ILE 7 5.636 10.172 -6.071 39 HB ILE 7 HB ILE 7 5.849 8.001 -8.149 40 HG12 ILE 7 HG12 ILE 7 6.427 7.692 -5.208 41 HG13 ILE 7 HG13 ILE 7 4.884 7.249 -5.875 42 HG21 ILE 7 HG21 ILE 7 7.867 9.213 -6.178 43 HG22 ILE 7 HG22 ILE 7 8.255 7.977 -7.377 44 HG23 ILE 7 HG23 ILE 7 7.815 9.605 -7.912 45 HD11 ILE 7 HD11 ILE 7 5.698 5.421 -7.033 46 HD12 ILE 7 HD12 ILE 7 7.325 6.068 -7.214 47 HD13 ILE 7 HD13 ILE 7 6.817 5.451 -5.650 48 H VAL 8 H VAL 8 3.940 9.962 -9.223 49 HA VAL 8 HA VAL 8 5.826 11.725 -10.568 50 HB VAL 8 HB VAL 8 2.953 10.910 -11.229 51 HG11 VAL 8 HG11 VAL 8 4.889 12.599 -12.889 52 HG12 VAL 8 HG12 VAL 8 3.391 11.852 -13.501 53 HG13 VAL 8 HG13 VAL 8 3.306 13.100 -12.264 54 HG21 VAL 8 HG21 VAL 8 4.177 9.700 -13.085 55 HG22 VAL 8 HG22 VAL 8 5.690 10.170 -12.334 56 HG23 VAL 8 HG23 VAL 8 4.568 9.098 -11.465 57 H ASP 9 H ASP 9 2.747 12.195 -8.818 58 HA ASP 9 HA ASP 9 2.463 14.954 -9.323 59 HB2 ASP 9 HB2 ASP 9 0.826 13.294 -8.173 60 HB3 ASP 9 HB3 ASP 9 1.677 13.701 -6.678 61 H GLU 10 H GLU 10 4.083 13.387 -6.540 62 HA GLU 10 HA GLU 10 4.849 15.827 -5.291 63 HB2 GLU 10 HB2 GLU 10 6.346 14.479 -3.933 64 HB3 GLU 10 HB3 GLU 10 4.776 13.693 -4.102 65 HG2 GLU 10 HG2 GLU 10 5.641 12.301 -5.915 66 HG3 GLU 10 HG3 GLU 10 7.248 13.026 -5.777 67 H ALA 11 H ALA 11 6.364 13.992 -7.974 68 HA ALA 11 HA ALA 11 8.910 15.414 -7.744 69 HB1 ALA 11 HB1 ALA 11 9.364 14.403 -9.961 70 HB2 ALA 11 HB2 ALA 11 8.690 13.173 -8.865 71 HB3 ALA 11 HB3 ALA 11 7.670 13.914 -10.114 72 H LEU 12 H LEU 12 5.898 15.726 -9.676 73 HA LEU 12 HA LEU 12 6.731 17.960 -11.226 74 HB2 LEU 12 HB2 LEU 12 3.965 17.069 -10.323 75 HB3 LEU 12 HB3 LEU 12 4.226 18.400 -11.441 76 HG LEU 12 HG LEU 12 5.191 15.552 -11.971 77 HD11 LEU 12 HD11 LEU 12 3.282 15.368 -13.484 78 HD12 LEU 12 HD12 LEU 12 2.721 16.993 -13.028 79 HD13 LEU 12 HD13 LEU 12 2.724 15.675 -11.837 80 HD21 LEU 12 HD21 LEU 12 5.417 16.307 -14.302 81 HD22 LEU 12 HD22 LEU 12 6.475 17.227 -13.238 82 HD23 LEU 12 HD23 LEU 12 4.965 17.958 -13.809 83 H GLU 13 H GLU 13 5.337 17.717 -8.007 84 HA GLU 13 HA GLU 13 4.714 20.338 -7.343 85 HB2 GLU 13 HB2 GLU 13 5.202 17.784 -6.063 86 HB3 GLU 13 HB3 GLU 13 5.946 19.018 -5.076 87 HG2 GLU 13 HG2 GLU 13 3.059 19.021 -6.002 88 HG3 GLU 13 HG3 GLU 13 3.643 18.348 -4.485 89 H GLN 14 H GLN 14 7.870 18.990 -7.816 90 HA GLN 14 HA GLN 14 9.197 21.352 -6.519 91 HB2 GLN 14 HB2 GLN 14 10.805 19.083 -7.489 92 HB3 GLN 14 HB3 GLN 14 11.065 20.112 -6.110 93 HG2 GLN 14 HG2 GLN 14 9.232 17.707 -6.344 94 HG3 GLN 14 HG3 GLN 14 10.771 17.759 -5.531 95 HE21 GLN 14 HE21 GLN 14 7.846 17.295 -4.696 96 HE22 GLN 14 HE22 GLN 14 7.839 18.023 -3.096 97 H GLY 15 H GLY 15 8.160 20.253 -9.495 98 HA2 GLY 15 HA2 GLY 15 8.511 21.313 -11.561 99 HA3 GLY 15 HA3 GLY 15 9.989 22.063 -10.945 100 H ILE 16 H ILE 16 9.314 18.541 -10.645 101 HA ILE 16 HA ILE 16 11.514 18.051 -12.592 102 HB ILE 16 HB ILE 16 10.698 16.313 -10.256 103 HG12 ILE 16 HG12 ILE 16 13.467 17.421 -10.236 104 HG13 ILE 16 HG13 ILE 16 12.244 18.647 -9.998 105 HG21 ILE 16 HG21 ILE 16 12.929 16.107 -12.323 106 HG22 ILE 16 HG22 ILE 16 12.798 15.079 -10.892 107 HG23 ILE 16 HG23 ILE 16 11.538 15.019 -12.112 108 HD11 ILE 16 HD11 ILE 16 11.184 17.156 -8.236 109 HD12 ILE 16 HD12 ILE 16 12.644 16.158 -8.330 110 HD13 ILE 16 HD13 ILE 16 12.775 17.849 -7.835 111 H THR 17 H THR 17 10.767 17.374 -14.396 112 HA THR 17 HA THR 17 8.081 16.166 -14.606 113 HB THR 17 HB THR 17 10.137 17.414 -16.402 114 HG1 THR 17 HG1 THR 17 8.235 18.396 -17.177 115 HG21 THR 17 HG21 THR 17 8.130 15.360 -17.386 116 HG22 THR 17 HG22 THR 17 9.897 15.363 -17.551 117 HG23 THR 17 HG23 THR 17 8.957 16.565 -18.427 118 H LEU 18 H LEU 18 7.678 14.033 -14.945 119 HA LEU 18 HA LEU 18 9.998 12.166 -15.070 120 HB2 LEU 18 HB2 LEU 18 7.167 11.793 -13.971 121 HB3 LEU 18 HB3 LEU 18 8.262 10.501 -14.306 122 HG LEU 18 HG LEU 18 8.149 12.305 -11.977 123 HD11 LEU 18 HD11 LEU 18 7.756 9.856 -11.909 124 HD12 LEU 18 HD12 LEU 18 9.149 10.278 -10.905 125 HD13 LEU 18 HD13 LEU 18 9.380 9.551 -12.527 126 HD21 LEU 18 HD21 LEU 18 10.281 13.138 -12.962 127 HD22 LEU 18 HD22 LEU 18 10.856 11.451 -13.018 128 HD23 LEU 18 HD23 LEU 18 10.541 12.239 -11.453 129 H PHE 19 H PHE 19 9.993 10.590 -16.588 130 HA PHE 19 HA PHE 19 7.810 10.040 -18.383 131 HB2 PHE 19 HB2 PHE 19 8.924 10.843 -20.424 132 HB3 PHE 19 HB3 PHE 19 8.501 12.152 -19.364 133 HD1 PHE 19 HD1 PHE 19 11.286 10.421 -21.057 134 HD2 PHE 19 HD2 PHE 19 10.284 13.282 -17.997 135 HE1 PHE 19 HE1 PHE 19 13.566 11.392 -21.193 136 HE2 PHE 19 HE2 PHE 19 12.540 14.255 -18.163 137 HZ PHE 19 HZ PHE 19 14.215 13.287 -19.726 138 H VAL 20 H VAL 20 8.985 8.732 -20.294 139 HA VAL 20 HA VAL 20 11.210 7.086 -19.251 140 HB VAL 20 HB VAL 20 8.613 6.086 -20.410 141 HG11 VAL 20 HG11 VAL 20 10.918 4.384 -19.407 142 HG12 VAL 20 HG12 VAL 20 9.407 3.829 -20.160 143 HG13 VAL 20 HG13 VAL 20 10.564 4.732 -21.129 144 HG21 VAL 20 HG21 VAL 20 8.432 6.694 -17.973 145 HG22 VAL 20 HG22 VAL 20 8.157 4.990 -18.277 146 HG23 VAL 20 HG23 VAL 20 9.722 5.538 -17.612 147 H VAL 21 H VAL 21 12.747 7.209 -20.822 148 HA VAL 21 HA VAL 21 11.922 7.823 -23.611 149 HB VAL 21 HB VAL 21 13.115 9.665 -22.965 150 HG11 VAL 21 HG11 VAL 21 15.100 7.904 -21.499 151 HG12 VAL 21 HG12 VAL 21 15.233 9.666 -21.720 152 HG13 VAL 21 HG13 VAL 21 13.904 9.011 -20.766 153 HG21 VAL 21 HG21 VAL 21 15.322 7.836 -24.007 154 HG22 VAL 21 HG22 VAL 21 14.108 8.667 -25.014 155 HG23 VAL 21 HG23 VAL 21 15.277 9.599 -24.067 156 H ASN 22 H ASN 22 12.280 6.297 -25.030 157 HA ASN 22 HA ASN 22 12.678 4.192 -25.840 158 HB2 ASN 22 HB2 ASN 22 15.490 4.723 -24.879 159 HB3 ASN 22 HB3 ASN 22 14.965 3.717 -26.236 160 HD21 ASN 22 HD21 ASN 22 16.559 6.464 -25.797 161 HD22 ASN 22 HD22 ASN 22 15.888 7.469 -27.067 162 H ASN 23 H ASN 23 11.381 3.904 -23.619 163 HA ASN 23 HA ASN 23 10.751 2.583 -21.931 164 HB2 ASN 23 HB2 ASN 23 11.076 0.897 -23.758 165 HB3 ASN 23 HB3 ASN 23 12.619 0.473 -23.006 166 HD21 ASN 23 HD21 ASN 23 9.087 0.856 -22.236 167 HD22 ASN 23 HD22 ASN 23 9.047 -0.352 -20.981 168 H ARG 24 H ARG 24 13.139 4.366 -21.333 169 HA ARG 24 HA ARG 24 14.063 2.923 -18.890 170 HB2 ARG 24 HB2 ARG 24 15.680 4.785 -20.679 171 HB3 ARG 24 HB3 ARG 24 16.225 4.106 -19.139 172 HG2 ARG 24 HG2 ARG 24 15.985 1.826 -20.022 173 HG3 ARG 24 HG3 ARG 24 15.381 2.445 -21.556 174 HD2 ARG 24 HD2 ARG 24 17.573 3.737 -21.766 175 HD3 ARG 24 HD3 ARG 24 18.186 2.674 -20.487 176 HE ARG 24 HE ARG 24 17.899 2.122 -23.251 177 HH11 ARG 24 HH11 ARG 24 17.276 0.475 -20.196 178 HH12 ARG 24 HH12 ARG 24 17.442 -1.127 -20.815 179 HH21 ARG 24 HH21 ARG 24 18.075 -0.011 -24.144 180 HH22 ARG 24 HH22 ARG 24 17.947 -1.404 -23.141 181 H LEU 25 H LEU 25 13.648 3.989 -17.037 182 HA LEU 25 HA LEU 25 12.017 6.339 -17.024 183 HB2 LEU 25 HB2 LEU 25 12.191 4.427 -15.297 184 HB3 LEU 25 HB3 LEU 25 13.605 5.214 -14.656 185 HG LEU 25 HG LEU 25 10.772 6.309 -14.860 186 HD11 LEU 25 HD11 LEU 25 10.738 6.188 -12.450 187 HD12 LEU 25 HD12 LEU 25 12.400 5.574 -12.403 188 HD13 LEU 25 HD13 LEU 25 11.083 4.616 -13.151 189 HD21 LEU 25 HD21 LEU 25 12.000 8.341 -14.913 190 HD22 LEU 25 HD22 LEU 25 13.247 7.740 -13.773 191 HD23 LEU 25 HD23 LEU 25 11.592 8.153 -13.250 192 H GLN 26 H GLN 26 12.643 8.478 -17.118 193 HA GLN 26 HA GLN 26 15.187 9.310 -15.991 194 HB2 GLN 26 HB2 GLN 26 14.463 10.180 -18.809 195 HB3 GLN 26 HB3 GLN 26 15.877 10.574 -17.823 196 HG2 GLN 26 HG2 GLN 26 16.437 8.083 -17.849 197 HG3 GLN 26 HG3 GLN 26 15.220 7.936 -19.131 198 HE21 GLN 26 HE21 GLN 26 16.753 11.003 -19.593 199 HE22 GLN 26 HE22 GLN 26 17.883 10.445 -20.781 200 H TYR 27 H TYR 27 15.160 11.886 -16.089 201 HA TYR 27 HA TYR 27 12.464 13.010 -15.937 202 HB2 TYR 27 HB2 TYR 27 12.957 13.945 -13.667 203 HB3 TYR 27 HB3 TYR 27 12.648 12.224 -13.724 204 HD1 TYR 27 HD1 TYR 27 14.272 10.580 -13.222 205 HD2 TYR 27 HD2 TYR 27 15.263 14.782 -13.077 206 HE1 TYR 27 HE1 TYR 27 16.346 10.029 -12.031 207 HE2 TYR 27 HE2 TYR 27 17.303 14.270 -11.808 208 HH TYR 27 HH TYR 27 18.358 10.819 -11.422 209 H GLU 28 H GLU 28 12.612 15.366 -15.581 210 HA GLU 28 HA GLU 28 15.187 16.581 -16.338 211 HB2 GLU 28 HB2 GLU 28 14.146 16.005 -18.411 212 HB3 GLU 28 HB3 GLU 28 12.588 16.675 -17.907 213 HG2 GLU 28 HG2 GLU 28 13.301 18.855 -18.096 214 HG3 GLU 28 HG3 GLU 28 15.025 18.460 -17.923 215 H THR 29 H THR 29 15.464 18.509 -15.301 216 HA THR 29 HA THR 29 13.185 20.085 -14.409 217 HB THR 29 HB THR 29 13.539 18.384 -12.613 218 HG1 THR 29 HG1 THR 29 12.751 20.360 -12.029 219 HG21 THR 29 HG21 THR 29 15.492 18.604 -11.156 220 HG22 THR 29 HG22 THR 29 16.320 19.550 -12.397 221 HG23 THR 29 HG23 THR 29 15.822 17.858 -12.736 222 H SER 30 H SER 30 14.442 22.012 -13.031 223 HA SER 30 HA SER 30 16.974 22.758 -14.368 224 HB2 SER 30 HB2 SER 30 15.114 23.526 -15.871 225 HB3 SER 30 HB3 SER 30 14.488 24.499 -14.524 226 HG SER 30 HG SER 30 16.499 25.574 -14.482 227 H ARG 31 H ARG 31 17.316 22.072 -11.996 228 HA ARG 31 HA ARG 31 17.717 24.398 -10.413 229 HB2 ARG 31 HB2 ARG 31 16.325 23.665 -8.430 230 HB3 ARG 31 HB3 ARG 31 15.402 24.315 -9.762 231 HG2 ARG 31 HG2 ARG 31 14.538 22.219 -10.391 232 HG3 ARG 31 HG3 ARG 31 15.820 21.315 -9.567 233 HD2 ARG 31 HD2 ARG 31 13.758 21.089 -8.350 234 HD3 ARG 31 HD3 ARG 31 14.945 21.983 -7.386 235 HE ARG 31 HE ARG 31 13.045 23.580 -8.961 236 HH11 ARG 31 HH11 ARG 31 13.609 21.976 -5.874 237 HH12 ARG 31 HH12 ARG 31 12.412 22.839 -4.984 238 HH21 ARG 31 HH21 ARG 31 11.345 24.618 -7.936 239 HH22 ARG 31 HH22 ARG 31 10.846 24.245 -6.325 240 H ASP 32 H ASP 32 18.436 23.676 -8.134 241 HA ASP 32 HA ASP 32 20.022 21.183 -8.245 242 HB2 ASP 32 HB2 ASP 32 21.873 22.288 -7.371 243 HB3 ASP 32 HB3 ASP 32 21.280 23.432 -8.551 244 H SER 33 H SER 33 20.776 20.895 -5.760 245 HA SER 33 HA SER 33 20.164 20.081 -3.791 246 HB2 SER 33 HB2 SER 33 20.125 22.614 -3.491 247 HB3 SER 33 HB3 SER 33 18.361 22.508 -3.548 248 HG SER 33 HG SER 33 20.226 21.617 -1.660 249 H ILE 34 H ILE 34 18.972 18.581 -5.594 250 HA ILE 34 HA ILE 34 16.108 18.585 -5.430 251 HB ILE 34 HB ILE 34 18.195 17.003 -6.752 252 HG12 ILE 34 HG12 ILE 34 15.238 17.163 -7.430 253 HG13 ILE 34 HG13 ILE 34 16.368 18.483 -7.751 254 HG21 ILE 34 HG21 ILE 34 16.926 14.844 -6.945 255 HG22 ILE 34 HG22 ILE 34 17.606 15.133 -5.348 256 HG23 ILE 34 HG23 ILE 34 15.880 15.391 -5.618 257 HD11 ILE 34 HD11 ILE 34 16.030 17.129 -9.751 258 HD12 ILE 34 HD12 ILE 34 17.711 16.986 -9.193 259 HD13 ILE 34 HD13 ILE 34 16.544 15.670 -8.926 260 HA PRO 35 HA PRO 35 15.587 16.555 -1.482 261 HB2 PRO 35 HB2 PRO 35 13.162 15.351 -1.866 262 HB3 PRO 35 HB3 PRO 35 13.370 17.112 -1.561 263 HG2 PRO 35 HG2 PRO 35 12.858 15.696 -4.154 264 HG3 PRO 35 HG3 PRO 35 12.230 17.255 -3.608 265 HD2 PRO 35 HD2 PRO 35 14.327 17.055 -5.330 266 HD3 PRO 35 HD3 PRO 35 14.180 18.378 -4.140 267 H THR 36 H THR 36 17.153 14.956 -1.402 268 HA THR 36 HA THR 36 17.468 12.777 -3.157 269 HB THR 36 HB THR 36 19.286 13.562 -1.903 270 HG1 THR 36 HG1 THR 36 18.736 11.181 -0.510 271 HG21 THR 36 HG21 THR 36 17.545 13.202 0.531 272 HG22 THR 36 HG22 THR 36 18.494 14.609 -0.004 273 HG23 THR 36 HG23 THR 36 19.305 13.199 0.665 274 H GLU 37 H GLU 37 15.457 13.031 -0.218 275 HA GLU 37 HA GLU 37 14.860 10.292 0.139 276 HB2 GLU 37 HB2 GLU 37 12.848 11.182 1.351 277 HB3 GLU 37 HB3 GLU 37 14.391 11.885 1.843 278 HG2 GLU 37 HG2 GLU 37 13.888 13.897 0.388 279 HG3 GLU 37 HG3 GLU 37 12.316 13.202 0.035 280 H LEU 38 H LEU 38 13.312 12.765 -1.861 281 HA LEU 38 HA LEU 38 11.176 11.190 -2.921 282 HB2 LEU 38 HB2 LEU 38 11.740 13.843 -2.796 283 HB3 LEU 38 HB3 LEU 38 12.434 13.513 -4.364 284 HG LEU 38 HG LEU 38 10.111 12.426 -4.938 285 HD11 LEU 38 HD11 LEU 38 8.327 13.641 -3.583 286 HD12 LEU 38 HD12 LEU 38 9.559 14.093 -2.428 287 HD13 LEU 38 HD13 LEU 38 9.194 12.366 -2.702 288 HD21 LEU 38 HD21 LEU 38 9.220 14.621 -5.583 289 HD22 LEU 38 HD22 LEU 38 10.962 14.580 -5.901 290 HD23 LEU 38 HD23 LEU 38 10.333 15.441 -4.478 291 H LEU 39 H LEU 39 14.381 12.193 -4.084 292 HA LEU 39 HA LEU 39 14.404 11.066 -6.654 293 HB2 LEU 39 HB2 LEU 39 16.138 12.561 -5.286 294 HB3 LEU 39 HB3 LEU 39 16.878 11.014 -4.900 295 HG LEU 39 HG LEU 39 16.457 12.300 -7.609 296 HD11 LEU 39 HD11 LEU 39 18.879 12.323 -7.698 297 HD12 LEU 39 HD12 LEU 39 18.993 11.378 -6.196 298 HD13 LEU 39 HD13 LEU 39 18.382 13.042 -6.166 299 HD21 LEU 39 HD21 LEU 39 17.657 10.397 -8.631 300 HD22 LEU 39 HD22 LEU 39 16.094 9.904 -7.999 301 HD23 LEU 39 HD23 LEU 39 17.574 9.510 -7.095 302 H ASN 40 H ASN 40 15.447 9.745 -3.524 303 HA ASN 40 HA ASN 40 16.132 7.132 -4.345 304 HB2 ASN 40 HB2 ASN 40 15.254 8.288 -1.679 305 HB3 ASN 40 HB3 ASN 40 15.521 6.562 -1.859 306 HD21 ASN 40 HD21 ASN 40 17.058 8.492 -0.190 307 HD22 ASN 40 HD22 ASN 40 18.706 8.366 -0.778 308 H LYS 41 H LYS 41 12.916 8.492 -3.458 309 HA LYS 41 HA LYS 41 11.650 5.925 -3.439 310 HB2 LYS 41 HB2 LYS 41 10.671 7.927 -2.381 311 HB3 LYS 41 HB3 LYS 41 10.385 8.672 -3.963 312 HG2 LYS 41 HG2 LYS 41 8.803 7.037 -4.591 313 HG3 LYS 41 HG3 LYS 41 9.383 5.870 -3.398 314 HD2 LYS 41 HD2 LYS 41 7.283 6.617 -2.693 315 HD3 LYS 41 HD3 LYS 41 8.479 7.284 -1.558 316 HE2 LYS 41 HE2 LYS 41 7.964 8.999 -3.882 317 HE3 LYS 41 HE3 LYS 41 6.474 8.601 -3.053 318 HZ1 LYS 41 HZ1 LYS 41 8.764 9.901 -1.673 319 HZ2 LYS 41 HZ2 LYS 41 7.205 9.680 -1.122 320 HZ3 LYS 41 HZ3 LYS 41 7.501 10.623 -2.404 321 H TRP 42 H TRP 42 12.318 8.277 -6.063 322 HA TRP 42 HA TRP 42 10.812 7.010 -8.065 323 HB2 TRP 42 HB2 TRP 42 13.503 8.317 -8.528 324 HB3 TRP 42 HB3 TRP 42 12.225 8.074 -9.707 325 HD1 TRP 42 HD1 TRP 42 10.061 9.382 -7.360 326 HE1 TRP 42 HE1 TRP 42 9.926 11.906 -7.325 327 HE3 TRP 42 HE3 TRP 42 14.485 10.352 -9.671 328 HZ2 TRP 42 HZ2 TRP 42 11.651 14.135 -8.118 329 HZ3 TRP 42 HZ3 TRP 42 15.325 12.687 -9.835 330 HH2 TRP 42 HH2 TRP 42 13.962 14.550 -9.032 331 H LYS 43 H LYS 43 14.301 6.525 -7.280 332 HA LYS 43 HA LYS 43 14.575 4.424 -9.214 333 HB2 LYS 43 HB2 LYS 43 16.668 3.790 -7.811 334 HB3 LYS 43 HB3 LYS 43 16.643 5.307 -8.706 335 HG2 LYS 43 HG2 LYS 43 16.310 6.614 -6.777 336 HG3 LYS 43 HG3 LYS 43 15.856 5.203 -5.802 337 HD2 LYS 43 HD2 LYS 43 18.593 5.215 -6.977 338 HD3 LYS 43 HD3 LYS 43 18.286 6.345 -5.662 339 HE2 LYS 43 HE2 LYS 43 17.465 3.417 -5.418 340 HE3 LYS 43 HE3 LYS 43 19.109 3.951 -5.118 341 HZ1 LYS 43 HZ1 LYS 43 16.751 4.508 -3.496 342 HZ2 LYS 43 HZ2 LYS 43 17.956 5.648 -3.558 343 HZ3 LYS 43 HZ3 LYS 43 18.306 4.185 -3.048 344 H GLN 44 H GLN 44 13.604 4.404 -5.813 345 HA GLN 44 HA GLN 44 13.791 1.649 -5.359 346 HB2 GLN 44 HB2 GLN 44 13.235 3.394 -3.622 347 HB3 GLN 44 HB3 GLN 44 11.644 3.540 -4.320 348 HG2 GLN 44 HG2 GLN 44 11.120 2.117 -2.671 349 HG3 GLN 44 HG3 GLN 44 11.495 0.914 -3.863 350 HE21 GLN 44 HE21 GLN 44 11.513 0.132 -1.307 351 HE22 GLN 44 HE22 GLN 44 13.134 -0.124 -0.687 352 H HIS 45 H HIS 45 10.957 3.532 -6.604 353 HA HIS 45 HA HIS 45 9.668 0.981 -7.413 354 HB2 HIS 45 HB2 HIS 45 8.422 3.715 -6.960 355 HB3 HIS 45 HB3 HIS 45 7.585 2.212 -7.313 356 HD1 HIS 45 HD1 HIS 45 7.649 0.331 -5.321 357 HD2 HIS 45 HD2 HIS 45 9.128 4.168 -4.507 358 HE1 HIS 45 HE1 HIS 45 7.920 0.473 -2.767 359 H LYS 46 H LYS 46 11.792 1.990 -9.000 360 HA LYS 46 HA LYS 46 11.176 3.523 -11.210 361 HB2 LYS 46 HB2 LYS 46 13.397 2.477 -10.605 362 HB3 LYS 46 HB3 LYS 46 12.821 0.976 -11.318 363 HG2 LYS 46 HG2 LYS 46 12.399 2.639 -13.420 364 HG3 LYS 46 HG3 LYS 46 13.583 3.621 -12.572 365 HD2 LYS 46 HD2 LYS 46 14.716 2.302 -14.245 366 HD3 LYS 46 HD3 LYS 46 15.189 1.717 -12.647 367 HE2 LYS 46 HE2 LYS 46 13.358 -0.053 -12.885 368 HE3 LYS 46 HE3 LYS 46 13.162 0.460 -14.558 369 HZ1 LYS 46 HZ1 LYS 46 15.720 -0.484 -13.441 370 HZ2 LYS 46 HZ2 LYS 46 15.351 -0.208 -15.030 371 HZ3 LYS 46 HZ3 LYS 46 14.632 -1.452 -14.209 372 H GLN 47 H GLN 47 10.640 -0.073 -11.079 373 HA GLN 47 HA GLN 47 9.658 -0.227 -13.734 374 HB2 GLN 47 HB2 GLN 47 10.278 -2.020 -11.742 375 HB3 GLN 47 HB3 GLN 47 8.515 -2.160 -11.788 376 HG2 GLN 47 HG2 GLN 47 10.445 -2.441 -14.118 377 HG3 GLN 47 HG3 GLN 47 9.692 -3.781 -13.238 378 HE21 GLN 47 HE21 GLN 47 9.327 -1.789 -15.977 379 HE22 GLN 47 HE22 GLN 47 7.645 -2.196 -16.232 380 H GLU 48 H GLU 48 8.030 0.321 -10.696 381 HA GLU 48 HA GLU 48 5.340 0.223 -11.626 382 HB2 GLU 48 HB2 GLU 48 6.149 2.020 -9.319 383 HB3 GLU 48 HB3 GLU 48 4.704 1.040 -9.546 384 HG2 GLU 48 HG2 GLU 48 6.324 -1.009 -9.378 385 HG3 GLU 48 HG3 GLU 48 7.499 0.164 -8.769 386 H LEU 49 H LEU 49 7.580 2.955 -11.171 387 HA LEU 49 HA LEU 49 5.836 5.015 -12.136 388 HB2 LEU 49 HB2 LEU 49 8.845 4.690 -12.154 389 HB3 LEU 49 HB3 LEU 49 8.080 6.160 -12.717 390 HG LEU 49 HG LEU 49 7.388 5.068 -9.960 391 HD11 LEU 49 HD11 LEU 49 9.703 6.922 -10.541 392 HD12 LEU 49 HD12 LEU 49 9.862 5.162 -10.320 393 HD13 LEU 49 HD13 LEU 49 9.203 6.147 -8.999 394 HD21 LEU 49 HD21 LEU 49 5.953 6.849 -10.483 395 HD22 LEU 49 HD22 LEU 49 7.180 7.719 -11.424 396 HD23 LEU 49 HD23 LEU 49 7.299 7.685 -9.675 397 H ILE 50 H ILE 50 8.241 2.948 -13.767 398 HA ILE 50 HA ILE 50 7.913 4.187 -16.312 399 HB ILE 50 HB ILE 50 8.618 1.280 -15.713 400 HG12 ILE 50 HG12 ILE 50 10.565 3.357 -16.757 401 HG13 ILE 50 HG13 ILE 50 10.191 3.364 -15.034 402 HG21 ILE 50 HG21 ILE 50 8.740 2.724 -18.367 403 HG22 ILE 50 HG22 ILE 50 9.517 1.154 -18.047 404 HG23 ILE 50 HG23 ILE 50 7.763 1.317 -17.957 405 HD11 ILE 50 HD11 ILE 50 11.211 0.885 -16.494 406 HD12 ILE 50 HD12 ILE 50 12.228 2.039 -15.614 407 HD13 ILE 50 HD13 ILE 50 10.999 1.115 -14.739 408 H ASP 51 H ASP 51 6.261 1.265 -15.058 409 HA ASP 51 HA ASP 51 4.535 0.887 -17.226 410 HB2 ASP 51 HB2 ASP 51 4.972 -0.474 -15.035 411 HB3 ASP 51 HB3 ASP 51 3.694 0.522 -14.331 412 H PHE 52 H PHE 52 4.285 3.126 -14.492 413 HA PHE 52 HA PHE 52 1.618 3.966 -15.120 414 HB2 PHE 52 HB2 PHE 52 2.456 4.196 -12.934 415 HB3 PHE 52 HB3 PHE 52 3.785 5.239 -13.450 416 HD1 PHE 52 HD1 PHE 52 3.526 7.547 -13.247 417 HD2 PHE 52 HD2 PHE 52 0.015 5.081 -13.637 418 HE1 PHE 52 HE1 PHE 52 2.048 9.588 -13.187 419 HE2 PHE 52 HE2 PHE 52 -1.408 7.096 -13.546 420 HZ PHE 52 HZ PHE 52 -0.332 9.366 -13.324 421 H LEU 53 H LEU 53 4.791 5.565 -15.755 422 HA LEU 53 HA LEU 53 3.713 7.728 -17.282 423 HB2 LEU 53 HB2 LEU 53 6.429 6.402 -17.029 424 HB3 LEU 53 HB3 LEU 53 6.183 7.606 -18.273 425 HG LEU 53 HG LEU 53 7.226 8.731 -16.539 426 HD11 LEU 53 HD11 LEU 53 5.723 10.492 -15.914 427 HD12 LEU 53 HD12 LEU 53 4.310 9.466 -16.165 428 HD13 LEU 53 HD13 LEU 53 5.317 9.963 -17.551 429 HD21 LEU 53 HD21 LEU 53 6.396 8.866 -14.211 430 HD22 LEU 53 HD22 LEU 53 6.944 7.252 -14.676 431 HD23 LEU 53 HD23 LEU 53 5.217 7.597 -14.596 432 H ASN 54 H ASN 54 4.445 4.395 -18.073 433 HA ASN 54 HA ASN 54 4.447 4.663 -20.956 434 HB2 ASN 54 HB2 ASN 54 5.302 2.701 -19.373 435 HB3 ASN 54 HB3 ASN 54 3.746 2.082 -19.520 436 HD21 ASN 54 HD21 ASN 54 6.763 2.512 -20.819 437 HD22 ASN 54 HD22 ASN 54 6.583 1.799 -22.416 438 H GLN 55 H GLN 55 1.973 3.242 -18.717 439 HA GLN 55 HA GLN 55 -0.070 3.329 -20.634 440 HB2 GLN 55 HB2 GLN 55 -1.561 2.678 -18.890 441 HB3 GLN 55 HB3 GLN 55 0.000 1.869 -18.685 442 HG2 GLN 55 HG2 GLN 55 -0.500 2.403 -16.522 443 HG3 GLN 55 HG3 GLN 55 0.520 3.729 -16.985 444 HE21 GLN 55 HE21 GLN 55 -0.183 5.723 -16.339 445 HE22 GLN 55 HE22 GLN 55 -1.848 6.156 -16.007 446 H LEU 56 H LEU 56 0.957 5.921 -18.441 447 HA LEU 56 HA LEU 56 -1.305 7.537 -18.369 448 HB2 LEU 56 HB2 LEU 56 0.620 7.911 -16.977 449 HB3 LEU 56 HB3 LEU 56 1.663 8.131 -18.393 450 HG LEU 56 HG LEU 56 0.532 10.284 -18.885 451 HD11 LEU 56 HD11 LEU 56 -0.903 11.339 -17.193 452 HD12 LEU 56 HD12 LEU 56 -0.850 9.877 -16.188 453 HD13 LEU 56 HD13 LEU 56 -1.674 9.883 -17.788 454 HD21 LEU 56 HD21 LEU 56 2.583 10.232 -17.622 455 HD22 LEU 56 HD22 LEU 56 1.680 9.991 -16.095 456 HD23 LEU 56 HD23 LEU 56 1.537 11.510 -17.016 457 H ASP 57 H ASP 57 0.776 6.988 -21.061 458 HA ASP 57 HA ASP 57 -0.706 9.127 -22.597 459 HB2 ASP 57 HB2 ASP 57 1.672 9.618 -21.758 460 HB3 ASP 57 HB3 ASP 57 2.194 8.453 -22.929 461 H SER 58 H SER 58 0.849 5.953 -22.650 462 HA SER 58 HA SER 58 0.130 5.633 -25.523 463 HB2 SER 58 HB2 SER 58 1.863 3.862 -23.763 464 HB3 SER 58 HB3 SER 58 1.571 3.691 -25.497 465 HG SER 58 HG SER 58 3.013 5.712 -24.119 466 H GLU 59 H GLU 59 -0.908 4.715 -22.336 467 HA GLU 59 HA GLU 59 -2.250 3.316 -21.423 468 HB2 GLU 59 HB2 GLU 59 -3.522 4.964 -23.234 469 HB3 GLU 59 HB3 GLU 59 -4.224 3.395 -23.616 470 HG2 GLU 59 HG2 GLU 59 -4.798 3.069 -21.293 471 HG3 GLU 59 HG3 GLU 59 -4.047 4.588 -20.824 472 H GLU 60 H GLU 60 -0.890 1.957 -24.103 473 HA GLU 60 HA GLU 60 -2.213 -0.429 -24.465 474 HB2 GLU 60 HB2 GLU 60 -0.872 0.369 -26.141 475 HB3 GLU 60 HB3 GLU 60 0.437 0.824 -25.069 476 HG2 GLU 60 HG2 GLU 60 1.057 -0.929 -26.596 477 HG3 GLU 60 HG3 GLU 60 1.267 -1.353 -24.911 478 H GLN 61 H GLN 61 1.009 -0.230 -22.867 479 HA GLN 61 HA GLN 61 0.947 -2.855 -21.977 480 HB2 GLN 61 HB2 GLN 61 2.570 -0.509 -21.022 481 HB3 GLN 61 HB3 GLN 61 2.847 -2.195 -20.543 482 HG2 GLN 61 HG2 GLN 61 2.747 -2.284 -23.349 483 HG3 GLN 61 HG3 GLN 61 3.550 -0.749 -23.018 484 HE21 GLN 61 HE21 GLN 61 5.739 -0.881 -22.763 485 HE22 GLN 61 HE22 GLN 61 6.597 -2.389 -22.380 486 H THR 62 H THR 62 0.191 -4.025 -20.397 487 HA THR 62 HA THR 62 -0.989 -2.713 -18.030 488 HB THR 62 HB THR 62 -2.545 -4.819 -18.123 489 HG1 THR 62 HG1 THR 62 -2.267 -5.976 -19.850 490 HG21 THR 62 HG21 THR 62 -4.175 -3.555 -19.436 491 HG22 THR 62 HG22 THR 62 -2.881 -2.541 -20.123 492 HG23 THR 62 HG23 THR 62 -3.269 -2.455 -18.400 493 H LYS 63 H LYS 63 -1.100 -4.050 -16.124 494 HA LYS 63 HA LYS 63 1.380 -5.651 -15.739 495 HB2 LYS 63 HB2 LYS 63 -0.409 -4.117 -13.806 496 HB3 LYS 63 HB3 LYS 63 1.030 -5.042 -13.333 497 HG2 LYS 63 HG2 LYS 63 2.478 -3.617 -14.538 498 HG3 LYS 63 HG3 LYS 63 1.139 -2.700 -15.246 499 HD2 LYS 63 HD2 LYS 63 1.580 -2.871 -12.241 500 HD3 LYS 63 HD3 LYS 63 2.382 -1.651 -13.246 501 HE2 LYS 63 HE2 LYS 63 0.269 -0.777 -14.040 502 HE3 LYS 63 HE3 LYS 63 -0.632 -2.066 -13.224 503 HZ1 LYS 63 HZ1 LYS 63 -0.653 0.020 -11.968 504 HZ2 LYS 63 HZ2 LYS 63 0.985 -0.024 -11.845 505 HZ3 LYS 63 HZ3 LYS 63 0.069 -1.181 -11.114 Start of MODEL 8 1 H1 GLY 1 H GLY 1 0.486 -0.856 -0.268 2 HA2 GLY 1 HA2 GLY 1 2.931 -0.658 -0.404 3 HA3 GLY 1 HA3 GLY 1 2.197 -0.777 -2.025 4 H ILE 2 H ILE 2 2.444 0.921 -3.465 5 HA ILE 2 HA ILE 2 3.087 3.586 -2.529 6 HB ILE 2 HB ILE 2 5.312 2.454 -2.876 7 HG12 ILE 2 HG12 ILE 2 6.373 3.973 -4.267 8 HG13 ILE 2 HG13 ILE 2 4.910 4.341 -5.187 9 HG21 ILE 2 HG21 ILE 2 4.880 0.709 -4.454 10 HG22 ILE 2 HG22 ILE 2 4.174 1.824 -5.641 11 HG23 ILE 2 HG23 ILE 2 5.883 1.854 -5.327 12 HD11 ILE 2 HD11 ILE 2 3.971 5.525 -3.197 13 HD12 ILE 2 HD12 ILE 2 5.458 5.123 -2.298 14 HD13 ILE 2 HD13 ILE 2 5.504 6.193 -3.721 15 H ASP 3 H ASP 3 2.789 5.109 -4.605 16 HA ASP 3 HA ASP 3 0.997 3.837 -6.535 17 HB2 ASP 3 HB2 ASP 3 0.464 6.479 -5.248 18 HB3 ASP 3 HB3 ASP 3 -0.578 5.505 -6.250 19 H ALA 4 H ALA 4 2.026 4.233 -8.352 20 HA ALA 4 HA ALA 4 4.334 5.843 -8.637 21 HB1 ALA 4 HB1 ALA 4 3.940 5.521 -11.086 22 HB2 ALA 4 HB2 ALA 4 3.838 4.002 -10.165 23 HB3 ALA 4 HB3 ALA 4 2.357 4.819 -10.691 24 H ALA 5 H ALA 5 0.910 6.632 -9.349 25 HA ALA 5 HA ALA 5 1.360 9.157 -10.551 26 HB1 ALA 5 HB1 ALA 5 -1.007 8.345 -8.819 27 HB2 ALA 5 HB2 ALA 5 -0.972 9.619 -10.041 28 HB3 ALA 5 HB3 ALA 5 -0.829 7.926 -10.549 29 H GLN 6 H GLN 6 1.072 8.233 -7.120 30 HA GLN 6 HA GLN 6 0.975 10.890 -6.068 31 HB2 GLN 6 HB2 GLN 6 1.847 8.207 -4.893 32 HB3 GLN 6 HB3 GLN 6 1.862 9.635 -3.931 33 HG2 GLN 6 HG2 GLN 6 -0.644 8.601 -5.314 34 HG3 GLN 6 HG3 GLN 6 -0.161 8.149 -3.684 35 HE21 GLN 6 HE21 GLN 6 -1.122 11.005 -5.684 36 HE22 GLN 6 HE22 GLN 6 -1.535 11.998 -4.334 37 H ILE 7 H ILE 7 3.658 8.714 -6.993 38 HA ILE 7 HA ILE 7 5.683 10.431 -5.861 39 HB ILE 7 HB ILE 7 5.907 8.296 -7.998 40 HG12 ILE 7 HG12 ILE 7 6.567 7.950 -5.077 41 HG13 ILE 7 HG13 ILE 7 5.037 7.453 -5.770 42 HG21 ILE 7 HG21 ILE 7 8.374 8.314 -7.156 43 HG22 ILE 7 HG22 ILE 7 7.864 9.735 -8.054 44 HG23 ILE 7 HG23 ILE 7 7.948 9.801 -6.282 45 HD11 ILE 7 HD11 ILE 7 7.631 6.377 -6.961 46 HD12 ILE 7 HD12 ILE 7 6.896 5.669 -5.552 47 HD13 ILE 7 HD13 ILE 7 5.983 5.741 -7.068 48 H VAL 8 H VAL 8 4.115 10.126 -9.076 49 HA VAL 8 HA VAL 8 5.957 11.894 -10.419 50 HB VAL 8 HB VAL 8 3.130 10.962 -11.081 51 HG11 VAL 8 HG11 VAL 8 5.039 12.658 -12.760 52 HG12 VAL 8 HG12 VAL 8 3.638 11.779 -13.412 53 HG13 VAL 8 HG13 VAL 8 3.389 13.072 -12.248 54 HG21 VAL 8 HG21 VAL 8 4.895 9.213 -11.202 55 HG22 VAL 8 HG22 VAL 8 4.304 9.646 -12.811 56 HG23 VAL 8 HG23 VAL 8 5.847 10.281 -12.266 57 H ASP 9 H ASP 9 2.779 12.431 -8.783 58 HA ASP 9 HA ASP 9 2.603 15.150 -9.571 59 HB2 ASP 9 HB2 ASP 9 0.749 13.750 -8.499 60 HB3 ASP 9 HB3 ASP 9 1.539 14.053 -6.948 61 H GLU 10 H GLU 10 3.950 13.733 -6.527 62 HA GLU 10 HA GLU 10 4.729 16.266 -5.524 63 HB2 GLU 10 HB2 GLU 10 6.116 15.091 -3.964 64 HB3 GLU 10 HB3 GLU 10 4.533 14.307 -4.095 65 HG2 GLU 10 HG2 GLU 10 5.542 12.597 -5.543 66 HG3 GLU 10 HG3 GLU 10 7.108 13.355 -5.425 67 H ALA 11 H ALA 11 6.398 14.071 -7.815 68 HA ALA 11 HA ALA 11 8.963 15.416 -7.609 69 HB1 ALA 11 HB1 ALA 11 9.434 14.302 -9.777 70 HB2 ALA 11 HB2 ALA 11 8.639 13.152 -8.676 71 HB3 ALA 11 HB3 ALA 11 7.720 13.922 -9.987 72 H LEU 12 H LEU 12 6.062 15.821 -9.643 73 HA LEU 12 HA LEU 12 7.071 17.968 -11.207 74 HB2 LEU 12 HB2 LEU 12 4.258 17.093 -10.475 75 HB3 LEU 12 HB3 LEU 12 4.551 18.442 -11.561 76 HG LEU 12 HG LEU 12 5.752 15.682 -12.091 77 HD11 LEU 12 HD11 LEU 12 3.880 15.238 -13.585 78 HD12 LEU 12 HD12 LEU 12 3.120 16.789 -13.131 79 HD13 LEU 12 HD13 LEU 12 3.294 15.488 -11.935 80 HD21 LEU 12 HD21 LEU 12 5.165 18.059 -13.908 81 HD22 LEU 12 HD22 LEU 12 5.809 16.499 -14.428 82 HD23 LEU 12 HD23 LEU 12 6.780 17.519 -13.368 83 H GLU 13 H GLU 13 5.559 17.865 -8.000 84 HA GLU 13 HA GLU 13 5.123 20.659 -7.727 85 HB2 GLU 13 HB2 GLU 13 5.522 18.430 -5.722 86 HB3 GLU 13 HB3 GLU 13 5.344 20.105 -5.232 87 HG2 GLU 13 HG2 GLU 13 3.159 20.084 -6.675 88 HG3 GLU 13 HG3 GLU 13 3.289 18.315 -6.536 89 H GLN 14 H GLN 14 8.103 18.942 -7.766 90 HA GLN 14 HA GLN 14 9.530 21.238 -6.462 91 HB2 GLN 14 HB2 GLN 14 11.142 18.939 -7.244 92 HB3 GLN 14 HB3 GLN 14 11.219 19.892 -5.791 93 HG2 GLN 14 HG2 GLN 14 9.289 17.613 -6.345 94 HG3 GLN 14 HG3 GLN 14 10.811 17.460 -5.525 95 HE21 GLN 14 HE21 GLN 14 7.810 17.268 -4.743 96 HE22 GLN 14 HE22 GLN 14 8.098 17.547 -3.042 97 H GLY 15 H GLY 15 8.415 20.296 -9.360 98 HA2 GLY 15 HA2 GLY 15 8.779 21.297 -11.432 99 HA3 GLY 15 HA3 GLY 15 10.354 21.880 -10.889 100 H ILE 16 H ILE 16 9.746 18.444 -10.309 101 HA ILE 16 HA ILE 16 11.623 17.873 -12.507 102 HB ILE 16 HB ILE 16 10.857 16.087 -10.188 103 HG12 ILE 16 HG12 ILE 16 13.660 16.983 -10.198 104 HG13 ILE 16 HG13 ILE 16 12.594 18.360 -10.055 105 HG21 ILE 16 HG21 ILE 16 11.585 14.825 -12.115 106 HG22 ILE 16 HG22 ILE 16 12.981 15.902 -12.367 107 HG23 ILE 16 HG23 ILE 16 12.909 14.833 -10.965 108 HD11 ILE 16 HD11 ILE 16 11.385 17.138 -8.202 109 HD12 ILE 16 HD12 ILE 16 12.713 15.966 -8.218 110 HD13 ILE 16 HD13 ILE 16 13.070 17.656 -7.851 111 H THR 17 H THR 17 10.846 17.287 -14.324 112 HA THR 17 HA THR 17 8.161 16.141 -14.599 113 HB THR 17 HB THR 17 10.341 17.308 -16.338 114 HG1 THR 17 HG1 THR 17 8.927 18.781 -16.385 115 HG21 THR 17 HG21 THR 17 9.179 16.596 -18.385 116 HG22 THR 17 HG22 THR 17 8.193 15.453 -17.403 117 HG23 THR 17 HG23 THR 17 9.954 15.284 -17.500 118 H LEU 18 H LEU 18 7.727 14.004 -14.879 119 HA LEU 18 HA LEU 18 9.999 12.084 -15.100 120 HB2 LEU 18 HB2 LEU 18 7.233 11.836 -13.827 121 HB3 LEU 18 HB3 LEU 18 8.199 10.468 -14.265 122 HG LEU 18 HG LEU 18 8.441 12.235 -11.918 123 HD11 LEU 18 HD11 LEU 18 9.386 9.411 -12.607 124 HD12 LEU 18 HD12 LEU 18 7.875 9.830 -11.808 125 HD13 LEU 18 HD13 LEU 18 9.403 10.130 -10.967 126 HD21 LEU 18 HD21 LEU 18 10.871 11.959 -11.624 127 HD22 LEU 18 HD22 LEU 18 10.522 12.938 -13.061 128 HD23 LEU 18 HD23 LEU 18 10.971 11.219 -13.246 129 H PHE 19 H PHE 19 9.963 10.529 -16.628 130 HA PHE 19 HA PHE 19 7.744 9.972 -18.386 131 HB2 PHE 19 HB2 PHE 19 8.826 10.867 -20.435 132 HB3 PHE 19 HB3 PHE 19 8.307 12.104 -19.341 133 HD1 PHE 19 HD1 PHE 19 11.052 10.922 -21.322 134 HD2 PHE 19 HD2 PHE 19 10.128 13.156 -17.754 135 HE1 PHE 19 HE1 PHE 19 13.214 12.126 -21.474 136 HE2 PHE 19 HE2 PHE 19 12.264 14.334 -17.928 137 HZ PHE 19 HZ PHE 19 13.834 13.809 -19.774 138 H VAL 20 H VAL 20 8.818 8.605 -20.315 139 HA VAL 20 HA VAL 20 11.150 7.001 -19.360 140 HB VAL 20 HB VAL 20 8.617 5.819 -20.510 141 HG11 VAL 20 HG11 VAL 20 9.493 3.691 -20.014 142 HG12 VAL 20 HG12 VAL 20 10.764 4.570 -20.863 143 HG13 VAL 20 HG13 VAL 20 10.871 4.374 -19.102 144 HG21 VAL 20 HG21 VAL 20 9.466 5.689 -17.586 145 HG22 VAL 20 HG22 VAL 20 8.166 6.708 -18.224 146 HG23 VAL 20 HG23 VAL 20 8.003 4.985 -18.352 147 H VAL 21 H VAL 21 12.688 7.358 -20.917 148 HA VAL 21 HA VAL 21 11.909 7.529 -23.792 149 HB VAL 21 HB VAL 21 14.495 8.168 -22.301 150 HG11 VAL 21 HG11 VAL 21 13.866 8.530 -25.255 151 HG12 VAL 21 HG12 VAL 21 15.307 9.140 -24.421 152 HG13 VAL 21 HG13 VAL 21 15.061 7.404 -24.595 153 HG21 VAL 21 HG21 VAL 21 13.923 10.494 -23.054 154 HG22 VAL 21 HG22 VAL 21 12.340 9.895 -23.592 155 HG23 VAL 21 HG23 VAL 21 12.818 9.795 -21.879 156 H ASN 22 H ASN 22 12.244 5.770 -25.108 157 HA ASN 22 HA ASN 22 12.699 3.643 -25.718 158 HB2 ASN 22 HB2 ASN 22 15.494 4.430 -24.828 159 HB3 ASN 22 HB3 ASN 22 15.093 3.042 -25.831 160 HD21 ASN 22 HD21 ASN 22 16.443 5.995 -26.207 161 HD22 ASN 22 HD22 ASN 22 15.742 6.400 -27.760 162 H ASN 23 H ASN 23 11.407 3.601 -23.383 163 HA ASN 23 HA ASN 23 10.850 2.405 -21.605 164 HB2 ASN 23 HB2 ASN 23 10.933 0.760 -23.363 165 HB3 ASN 23 HB3 ASN 23 12.568 0.259 -22.855 166 HD21 ASN 23 HD21 ASN 23 9.130 0.566 -21.815 167 HD22 ASN 23 HD22 ASN 23 9.232 -0.757 -20.688 168 H ARG 24 H ARG 24 13.294 4.140 -21.281 169 HA ARG 24 HA ARG 24 14.396 2.924 -18.799 170 HB2 ARG 24 HB2 ARG 24 15.643 4.876 -20.795 171 HB3 ARG 24 HB3 ARG 24 16.288 4.533 -19.191 172 HG2 ARG 24 HG2 ARG 24 16.583 2.174 -19.768 173 HG3 ARG 24 HG3 ARG 24 15.954 2.459 -21.402 174 HD2 ARG 24 HD2 ARG 24 17.764 3.812 -22.029 175 HD3 ARG 24 HD3 ARG 24 18.189 4.209 -20.354 176 HE ARG 24 HE ARG 24 18.537 1.403 -20.922 177 HH11 ARG 24 HH11 ARG 24 20.115 4.572 -21.458 178 HH12 ARG 24 HH12 ARG 24 21.706 3.897 -21.383 179 HH21 ARG 24 HH21 ARG 24 20.631 0.603 -20.739 180 HH22 ARG 24 HH22 ARG 24 22.020 1.650 -20.848 181 H LEU 25 H LEU 25 13.902 4.057 -16.989 182 HA LEU 25 HA LEU 25 12.123 6.353 -17.108 183 HB2 LEU 25 HB2 LEU 25 12.254 4.451 -15.356 184 HB3 LEU 25 HB3 LEU 25 13.623 5.306 -14.669 185 HG LEU 25 HG LEU 25 10.778 6.329 -14.934 186 HD11 LEU 25 HD11 LEU 25 10.705 6.150 -12.516 187 HD12 LEU 25 HD12 LEU 25 12.373 5.562 -12.451 188 HD13 LEU 25 HD13 LEU 25 11.089 4.588 -13.228 189 HD21 LEU 25 HD21 LEU 25 11.546 8.157 -13.325 190 HD22 LEU 25 HD22 LEU 25 12.079 8.338 -14.956 191 HD23 LEU 25 HD23 LEU 25 13.229 7.718 -13.730 192 H GLN 26 H GLN 26 12.796 8.518 -17.347 193 HA GLN 26 HA GLN 26 15.379 9.380 -16.203 194 HB2 GLN 26 HB2 GLN 26 14.368 10.537 -18.790 195 HB3 GLN 26 HB3 GLN 26 15.912 10.737 -18.035 196 HG2 GLN 26 HG2 GLN 26 15.084 7.997 -19.084 197 HG3 GLN 26 HG3 GLN 26 15.689 9.265 -20.117 198 HE21 GLN 26 HE21 GLN 26 16.522 7.279 -17.200 199 HE22 GLN 26 HE22 GLN 26 18.257 7.495 -17.363 200 H TYR 27 H TYR 27 15.283 11.918 -16.083 201 HA TYR 27 HA TYR 27 12.592 13.024 -15.857 202 HB2 TYR 27 HB2 TYR 27 13.107 13.893 -13.591 203 HB3 TYR 27 HB3 TYR 27 12.856 12.160 -13.650 204 HD1 TYR 27 HD1 TYR 27 14.575 10.581 -13.275 205 HD2 TYR 27 HD2 TYR 27 15.369 14.817 -12.999 206 HE1 TYR 27 HE1 TYR 27 16.747 10.095 -12.188 207 HE2 TYR 27 HE2 TYR 27 17.493 14.352 -11.814 208 HH TYR 27 HH TYR 27 18.743 10.977 -11.594 209 H GLU 28 H GLU 28 12.677 15.353 -15.666 210 HA GLU 28 HA GLU 28 15.284 16.600 -16.282 211 HB2 GLU 28 HB2 GLU 28 14.302 16.082 -18.404 212 HB3 GLU 28 HB3 GLU 28 12.738 16.757 -17.936 213 HG2 GLU 28 HG2 GLU 28 13.388 18.901 -18.167 214 HG3 GLU 28 HG3 GLU 28 15.051 18.622 -17.647 215 H THR 29 H THR 29 15.552 18.518 -15.286 216 HA THR 29 HA THR 29 13.312 20.111 -14.374 217 HB THR 29 HB THR 29 13.561 18.229 -12.680 218 HG1 THR 29 HG1 THR 29 12.613 20.163 -12.129 219 HG21 THR 29 HG21 THR 29 15.296 18.308 -11.031 220 HG22 THR 29 HG22 THR 29 16.151 19.588 -11.900 221 HG23 THR 29 HG23 THR 29 15.983 17.967 -12.629 222 H SER 30 H SER 30 14.148 22.145 -13.257 223 HA SER 30 HA SER 30 16.983 22.735 -13.784 224 HB2 SER 30 HB2 SER 30 14.674 24.529 -14.641 225 HB3 SER 30 HB3 SER 30 16.401 24.852 -14.851 226 HG SER 30 HG SER 30 14.784 22.891 -16.101 227 H ARG 31 H ARG 31 17.132 22.280 -11.570 228 HA ARG 31 HA ARG 31 17.021 24.603 -9.973 229 HB2 ARG 31 HB2 ARG 31 15.493 23.623 -8.174 230 HB3 ARG 31 HB3 ARG 31 14.750 24.299 -9.579 231 HG2 ARG 31 HG2 ARG 31 13.509 22.417 -9.431 232 HG3 ARG 31 HG3 ARG 31 14.668 21.860 -10.535 233 HD2 ARG 31 HD2 ARG 31 14.030 20.231 -8.719 234 HD3 ARG 31 HD3 ARG 31 15.748 20.447 -9.013 235 HE ARG 31 HE ARG 31 16.041 21.137 -6.873 236 HH11 ARG 31 HH11 ARG 31 12.613 21.866 -7.576 237 HH12 ARG 31 HH12 ARG 31 12.357 22.608 -6.055 238 HH21 ARG 31 HH21 ARG 31 15.478 21.493 -4.702 239 HH22 ARG 31 HH22 ARG 31 13.939 22.180 -4.324 240 H ASP 32 H ASP 32 18.106 24.293 -8.003 241 HA ASP 32 HA ASP 32 19.827 21.871 -7.934 242 HB2 ASP 32 HB2 ASP 32 19.969 24.692 -6.894 243 HB3 ASP 32 HB3 ASP 32 20.759 23.462 -5.929 244 H SER 33 H SER 33 20.341 21.214 -5.535 245 HA SER 33 HA SER 33 19.646 20.144 -3.694 246 HB2 SER 33 HB2 SER 33 17.768 22.494 -3.373 247 HB3 SER 33 HB3 SER 33 18.282 21.349 -2.129 248 HG SER 33 HG SER 33 19.918 23.173 -3.562 249 H ILE 34 H ILE 34 18.675 18.556 -5.461 250 HA ILE 34 HA ILE 34 15.754 18.505 -5.517 251 HB ILE 34 HB ILE 34 17.975 16.657 -6.467 252 HG12 ILE 34 HG12 ILE 34 15.550 17.886 -7.893 253 HG13 ILE 34 HG13 ILE 34 17.150 18.632 -7.833 254 HG21 ILE 34 HG21 ILE 34 16.303 14.996 -7.229 255 HG22 ILE 34 HG22 ILE 34 16.236 15.126 -5.474 256 HG23 ILE 34 HG23 ILE 34 15.022 15.952 -6.459 257 HD11 ILE 34 HD11 ILE 34 17.032 17.539 -9.919 258 HD12 ILE 34 HD12 ILE 34 18.009 16.447 -8.925 259 HD13 ILE 34 HD13 ILE 34 16.274 16.101 -9.237 260 HA PRO 35 HA PRO 35 15.409 16.596 -1.504 261 HB2 PRO 35 HB2 PRO 35 12.950 15.344 -1.859 262 HB3 PRO 35 HB3 PRO 35 13.183 17.096 -1.462 263 HG2 PRO 35 HG2 PRO 35 12.637 15.805 -4.130 264 HG3 PRO 35 HG3 PRO 35 11.929 17.301 -3.455 265 HD2 PRO 35 HD2 PRO 35 13.945 17.373 -5.232 266 HD3 PRO 35 HD3 PRO 35 13.886 18.527 -3.873 267 H THR 36 H THR 36 16.902 14.992 -1.322 268 HA THR 36 HA THR 36 17.353 12.843 -3.025 269 HB THR 36 HB THR 36 18.807 13.922 -1.280 270 HG1 THR 36 HG1 THR 36 20.105 12.350 -1.384 271 HG21 THR 36 HG21 THR 36 18.942 13.038 0.938 272 HG22 THR 36 HG22 THR 36 17.633 11.878 0.621 273 HG23 THR 36 HG23 THR 36 17.296 13.624 0.674 274 H GLU 37 H GLU 37 15.124 12.994 -0.260 275 HA GLU 37 HA GLU 37 14.593 10.231 0.041 276 HB2 GLU 37 HB2 GLU 37 12.523 11.028 1.164 277 HB3 GLU 37 HB3 GLU 37 13.992 11.837 1.709 278 HG2 GLU 37 HG2 GLU 37 13.390 13.788 0.149 279 HG3 GLU 37 HG3 GLU 37 11.854 12.977 -0.152 280 H LEU 38 H LEU 38 13.061 12.703 -2.010 281 HA LEU 38 HA LEU 38 11.093 10.961 -3.201 282 HB2 LEU 38 HB2 LEU 38 11.176 13.542 -2.761 283 HB3 LEU 38 HB3 LEU 38 12.098 13.624 -4.213 284 HG LEU 38 HG LEU 38 9.228 12.704 -3.853 285 HD11 LEU 38 HD11 LEU 38 10.501 15.074 -5.322 286 HD12 LEU 38 HD12 LEU 38 9.680 15.153 -3.743 287 HD13 LEU 38 HD13 LEU 38 8.764 14.764 -5.189 288 HD21 LEU 38 HD21 LEU 38 10.054 11.358 -5.654 289 HD22 LEU 38 HD22 LEU 38 10.857 12.782 -6.381 290 HD23 LEU 38 HD23 LEU 38 9.079 12.657 -6.338 291 H LEU 39 H LEU 39 14.330 12.200 -4.053 292 HA LEU 39 HA LEU 39 14.526 11.287 -6.718 293 HB2 LEU 39 HB2 LEU 39 16.094 12.779 -5.182 294 HB3 LEU 39 HB3 LEU 39 16.904 11.264 -4.828 295 HG LEU 39 HG LEU 39 16.567 12.633 -7.518 296 HD11 LEU 39 HD11 LEU 39 19.000 12.867 -7.413 297 HD12 LEU 39 HD12 LEU 39 19.049 11.990 -5.866 298 HD13 LEU 39 HD13 LEU 39 18.267 13.577 -5.973 299 HD21 LEU 39 HD21 LEU 39 17.915 9.954 -6.963 300 HD22 LEU 39 HD22 LEU 39 18.052 10.898 -8.471 301 HD23 LEU 39 HD23 LEU 39 16.499 10.246 -8.003 302 H ASN 40 H ASN 40 15.620 9.700 -3.719 303 HA ASN 40 HA ASN 40 16.405 7.239 -4.934 304 HB2 ASN 40 HB2 ASN 40 15.702 7.918 -2.061 305 HB3 ASN 40 HB3 ASN 40 16.128 6.285 -2.571 306 HD21 ASN 40 HD21 ASN 40 17.427 9.439 -1.847 307 HD22 ASN 40 HD22 ASN 40 19.090 8.952 -1.928 308 H LYS 41 H LYS 41 13.224 8.392 -3.787 309 HA LYS 41 HA LYS 41 11.939 5.855 -3.777 310 HB2 LYS 41 HB2 LYS 41 11.028 7.828 -2.728 311 HB3 LYS 41 HB3 LYS 41 10.818 8.647 -4.283 312 HG2 LYS 41 HG2 LYS 41 9.064 7.270 -4.954 313 HG3 LYS 41 HG3 LYS 41 9.531 5.993 -3.817 314 HD2 LYS 41 HD2 LYS 41 7.522 7.043 -3.035 315 HD3 LYS 41 HD3 LYS 41 8.855 7.372 -1.915 316 HE2 LYS 41 HE2 LYS 41 9.110 9.637 -3.097 317 HE3 LYS 41 HE3 LYS 41 7.620 9.263 -3.964 318 HZ1 LYS 41 HZ1 LYS 41 6.832 8.881 -1.457 319 HZ2 LYS 41 HZ2 LYS 41 6.744 10.314 -2.273 320 HZ3 LYS 41 HZ3 LYS 41 7.976 10.072 -1.239 321 H TRP 42 H TRP 42 12.738 8.071 -6.453 322 HA TRP 42 HA TRP 42 11.144 6.850 -8.411 323 HB2 TRP 42 HB2 TRP 42 13.853 8.135 -8.761 324 HB3 TRP 42 HB3 TRP 42 12.703 7.799 -10.074 325 HD1 TRP 42 HD1 TRP 42 10.208 8.987 -8.100 326 HE1 TRP 42 HE1 TRP 42 9.962 11.521 -8.051 327 HE3 TRP 42 HE3 TRP 42 14.869 10.243 -9.729 328 HZ2 TRP 42 HZ2 TRP 42 11.706 13.815 -8.297 329 HZ3 TRP 42 HZ3 TRP 42 15.579 12.636 -9.771 330 HH2 TRP 42 HH2 TRP 42 14.051 14.401 -8.999 331 H LYS 43 H LYS 43 14.557 6.127 -7.509 332 HA LYS 43 HA LYS 43 14.752 3.956 -9.440 333 HB2 LYS 43 HB2 LYS 43 16.841 3.318 -8.165 334 HB3 LYS 43 HB3 LYS 43 16.826 4.956 -8.830 335 HG2 LYS 43 HG2 LYS 43 16.293 5.905 -6.682 336 HG3 LYS 43 HG3 LYS 43 16.136 4.296 -5.950 337 HD2 LYS 43 HD2 LYS 43 18.798 4.670 -7.112 338 HD3 LYS 43 HD3 LYS 43 18.384 5.978 -6.000 339 HE2 LYS 43 HE2 LYS 43 17.563 4.003 -4.419 340 HE3 LYS 43 HE3 LYS 43 18.618 3.013 -5.444 341 HZ1 LYS 43 HZ1 LYS 43 19.869 3.758 -3.594 342 HZ2 LYS 43 HZ2 LYS 43 19.364 5.314 -3.758 343 HZ3 LYS 43 HZ3 LYS 43 20.393 4.676 -4.871 344 H GLN 44 H GLN 44 13.688 4.191 -6.081 345 HA GLN 44 HA GLN 44 13.749 1.489 -5.391 346 HB2 GLN 44 HB2 GLN 44 13.234 3.514 -3.893 347 HB3 GLN 44 HB3 GLN 44 11.619 3.509 -4.566 348 HG2 GLN 44 HG2 GLN 44 11.402 2.324 -2.555 349 HG3 GLN 44 HG3 GLN 44 11.378 1.089 -3.796 350 HE21 GLN 44 HE21 GLN 44 12.033 -0.350 -1.888 351 HE22 GLN 44 HE22 GLN 44 13.734 -0.415 -1.464 352 H HIS 45 H HIS 45 11.040 3.350 -6.875 353 HA HIS 45 HA HIS 45 9.688 0.771 -7.566 354 HB2 HIS 45 HB2 HIS 45 8.513 3.555 -7.267 355 HB3 HIS 45 HB3 HIS 45 7.643 2.027 -7.446 356 HD1 HIS 45 HD1 HIS 45 7.739 0.348 -5.307 357 HD2 HIS 45 HD2 HIS 45 9.280 4.215 -4.853 358 HE1 HIS 45 HE1 HIS 45 8.151 0.678 -2.782 359 H LYS 46 H LYS 46 11.812 1.599 -9.159 360 HA LYS 46 HA LYS 46 11.259 3.268 -11.294 361 HB2 LYS 46 HB2 LYS 46 13.432 1.944 -10.734 362 HB3 LYS 46 HB3 LYS 46 12.750 0.669 -11.747 363 HG2 LYS 46 HG2 LYS 46 12.440 2.589 -13.525 364 HG3 LYS 46 HG3 LYS 46 13.506 3.521 -12.461 365 HD2 LYS 46 HD2 LYS 46 15.128 1.558 -12.616 366 HD3 LYS 46 HD3 LYS 46 14.100 0.894 -13.883 367 HE2 LYS 46 HE2 LYS 46 15.934 2.053 -14.906 368 HE3 LYS 46 HE3 LYS 46 14.466 2.981 -15.225 369 HZ1 LYS 46 HZ1 LYS 46 16.446 3.536 -13.100 370 HZ2 LYS 46 HZ2 LYS 46 15.161 4.497 -13.454 371 HZ3 LYS 46 HZ3 LYS 46 16.418 4.341 -14.510 372 H GLN 47 H GLN 47 10.497 -0.305 -11.292 373 HA GLN 47 HA GLN 47 9.369 -0.139 -13.916 374 HB2 GLN 47 HB2 GLN 47 9.933 -2.207 -12.087 375 HB3 GLN 47 HB3 GLN 47 8.196 -2.316 -12.368 376 HG2 GLN 47 HG2 GLN 47 10.173 -2.044 -14.668 377 HG3 GLN 47 HG3 GLN 47 9.880 -3.597 -13.900 378 HE21 GLN 47 HE21 GLN 47 7.448 -0.995 -14.776 379 HE22 GLN 47 HE22 GLN 47 6.618 -2.030 -15.875 380 H GLU 48 H GLU 48 7.937 0.149 -10.723 381 HA GLU 48 HA GLU 48 5.222 0.222 -11.550 382 HB2 GLU 48 HB2 GLU 48 6.192 1.831 -9.174 383 HB3 GLU 48 HB3 GLU 48 4.647 1.015 -9.410 384 HG2 GLU 48 HG2 GLU 48 6.000 -1.201 -9.444 385 HG3 GLU 48 HG3 GLU 48 7.368 -0.230 -8.879 386 H LEU 49 H LEU 49 7.565 2.864 -11.127 387 HA LEU 49 HA LEU 49 5.862 5.005 -11.979 388 HB2 LEU 49 HB2 LEU 49 8.861 4.635 -12.139 389 HB3 LEU 49 HB3 LEU 49 8.060 6.156 -12.527 390 HG LEU 49 HG LEU 49 7.516 4.846 -9.840 391 HD11 LEU 49 HD11 LEU 49 9.988 4.936 -10.295 392 HD12 LEU 49 HD12 LEU 49 9.403 5.824 -8.878 393 HD13 LEU 49 HD13 LEU 49 9.842 6.703 -10.388 394 HD21 LEU 49 HD21 LEU 49 7.587 7.735 -10.827 395 HD22 LEU 49 HD22 LEU 49 7.310 7.214 -9.162 396 HD23 LEU 49 HD23 LEU 49 6.136 6.792 -10.404 397 H ILE 50 H ILE 50 8.211 2.958 -13.782 398 HA ILE 50 HA ILE 50 7.830 4.271 -16.286 399 HB ILE 50 HB ILE 50 8.491 1.352 -15.723 400 HG12 ILE 50 HG12 ILE 50 10.495 3.327 -16.821 401 HG13 ILE 50 HG13 ILE 50 10.159 3.354 -15.086 402 HG21 ILE 50 HG21 ILE 50 8.429 2.775 -18.369 403 HG22 ILE 50 HG22 ILE 50 9.370 1.288 -18.119 404 HG23 ILE 50 HG23 ILE 50 7.618 1.290 -17.904 405 HD11 ILE 50 HD11 ILE 50 10.802 1.020 -14.837 406 HD12 ILE 50 HD12 ILE 50 10.967 0.807 -16.580 407 HD13 ILE 50 HD13 ILE 50 12.095 1.865 -15.701 408 H ASP 51 H ASP 51 6.174 1.397 -14.961 409 HA ASP 51 HA ASP 51 4.413 0.934 -17.086 410 HB2 ASP 51 HB2 ASP 51 4.995 -0.507 -15.133 411 HB3 ASP 51 HB3 ASP 51 4.013 0.562 -14.104 412 H PHE 52 H PHE 52 4.214 3.278 -14.429 413 HA PHE 52 HA PHE 52 1.474 4.024 -14.985 414 HB2 PHE 52 HB2 PHE 52 2.336 4.331 -12.810 415 HB3 PHE 52 HB3 PHE 52 3.704 5.287 -13.386 416 HD1 PHE 52 HD1 PHE 52 3.566 7.580 -13.088 417 HD2 PHE 52 HD2 PHE 52 -0.080 5.354 -13.662 418 HE1 PHE 52 HE1 PHE 52 2.220 9.719 -13.090 419 HE2 PHE 52 HE2 PHE 52 -1.367 7.460 -13.617 420 HZ PHE 52 HZ PHE 52 -0.149 9.657 -13.320 421 H LEU 53 H LEU 53 4.679 5.605 -15.660 422 HA LEU 53 HA LEU 53 3.574 7.795 -17.136 423 HB2 LEU 53 HB2 LEU 53 6.296 6.464 -17.036 424 HB3 LEU 53 HB3 LEU 53 5.967 7.727 -18.209 425 HG LEU 53 HG LEU 53 7.142 8.743 -16.522 426 HD11 LEU 53 HD11 LEU 53 4.291 9.522 -15.868 427 HD12 LEU 53 HD12 LEU 53 5.142 10.028 -17.350 428 HD13 LEU 53 HD13 LEU 53 5.730 10.528 -15.756 429 HD21 LEU 53 HD21 LEU 53 5.269 7.586 -14.467 430 HD22 LEU 53 HD22 LEU 53 6.477 8.840 -14.133 431 HD23 LEU 53 HD23 LEU 53 6.987 7.237 -14.684 432 H ASN 54 H ASN 54 4.332 4.459 -17.990 433 HA ASN 54 HA ASN 54 4.273 4.903 -20.847 434 HB2 ASN 54 HB2 ASN 54 5.194 2.830 -19.307 435 HB3 ASN 54 HB3 ASN 54 3.738 2.143 -19.904 436 HD21 ASN 54 HD21 ASN 54 6.883 3.439 -20.633 437 HD22 ASN 54 HD22 ASN 54 6.888 3.063 -22.353 438 H GLN 55 H GLN 55 1.882 3.392 -18.577 439 HA GLN 55 HA GLN 55 -0.143 3.310 -20.554 440 HB2 GLN 55 HB2 GLN 55 -1.678 2.743 -18.808 441 HB3 GLN 55 HB3 GLN 55 -0.119 1.981 -18.482 442 HG2 GLN 55 HG2 GLN 55 -0.722 2.764 -16.365 443 HG3 GLN 55 HG3 GLN 55 0.343 3.969 -16.934 444 HE21 GLN 55 HE21 GLN 55 -0.334 6.001 -16.386 445 HE22 GLN 55 HE22 GLN 55 -2.000 6.528 -16.252 446 H LEU 56 H LEU 56 1.006 6.004 -18.649 447 HA LEU 56 HA LEU 56 -1.228 7.651 -18.471 448 HB2 LEU 56 HB2 LEU 56 1.517 7.834 -17.961 449 HB3 LEU 56 HB3 LEU 56 1.317 9.007 -19.221 450 HG LEU 56 HG LEU 56 -0.107 8.928 -16.526 451 HD11 LEU 56 HD11 LEU 56 1.265 10.950 -16.170 452 HD12 LEU 56 HD12 LEU 56 1.941 10.767 -17.817 453 HD13 LEU 56 HD13 LEU 56 2.260 9.543 -16.552 454 HD21 LEU 56 HD21 LEU 56 -1.010 11.157 -17.049 455 HD22 LEU 56 HD22 LEU 56 -1.598 9.969 -18.211 456 HD23 LEU 56 HD23 LEU 56 -0.318 11.070 -18.700 457 H ASP 57 H ASP 57 0.539 6.804 -21.339 458 HA ASP 57 HA ASP 57 -1.118 8.780 -22.776 459 HB2 ASP 57 HB2 ASP 57 1.340 9.517 -22.209 460 HB3 ASP 57 HB3 ASP 57 1.757 8.486 -23.563 461 H SER 58 H SER 58 0.748 5.768 -22.818 462 HA SER 58 HA SER 58 -0.035 5.197 -25.595 463 HB2 SER 58 HB2 SER 58 1.608 3.494 -23.692 464 HB3 SER 58 HB3 SER 58 1.520 3.403 -25.459 465 HG SER 58 HG SER 58 3.293 4.569 -25.211 466 H GLU 59 H GLU 59 -0.932 4.452 -22.340 467 HA GLU 59 HA GLU 59 -2.179 3.023 -21.232 468 HB2 GLU 59 HB2 GLU 59 -4.495 3.344 -21.565 469 HB3 GLU 59 HB3 GLU 59 -3.588 4.831 -21.786 470 HG2 GLU 59 HG2 GLU 59 -3.836 4.686 -24.219 471 HG3 GLU 59 HG3 GLU 59 -4.681 3.140 -24.050 472 H GLU 60 H GLU 60 -1.277 1.614 -24.033 473 HA GLU 60 HA GLU 60 -2.883 -0.859 -23.709 474 HB2 GLU 60 HB2 GLU 60 -1.058 0.250 -25.860 475 HB3 GLU 60 HB3 GLU 60 -1.823 -1.344 -25.961 476 HG2 GLU 60 HG2 GLU 60 -4.001 -0.480 -26.128 477 HG3 GLU 60 HG3 GLU 60 -3.539 1.113 -25.537 478 H GLN 61 H GLN 61 -0.402 0.059 -22.005 479 HA GLN 61 HA GLN 61 1.101 -2.503 -22.255 480 HB2 GLN 61 HB2 GLN 61 2.078 0.347 -21.913 481 HB3 GLN 61 HB3 GLN 61 2.968 -0.961 -21.131 482 HG2 GLN 61 HG2 GLN 61 2.308 -1.148 -24.077 483 HG3 GLN 61 HG3 GLN 61 3.706 -0.236 -23.493 484 HE21 GLN 61 HE21 GLN 61 5.581 -1.346 -23.166 485 HE22 GLN 61 HE22 GLN 61 5.749 -3.074 -23.051 486 H THR 62 H THR 62 1.174 -3.686 -20.451 487 HA THR 62 HA THR 62 0.474 -2.542 -17.814 488 HB THR 62 HB THR 62 -0.553 -5.216 -18.808 489 HG1 THR 62 HG1 THR 62 -1.780 -2.729 -19.377 490 HG21 THR 62 HG21 THR 62 -0.877 -4.617 -16.406 491 HG22 THR 62 HG22 THR 62 -2.379 -4.943 -17.284 492 HG23 THR 62 HG23 THR 62 -1.920 -3.272 -16.919 493 H LYS 63 H LYS 63 2.079 -3.285 -16.287 494 HA LYS 63 HA LYS 63 3.265 -5.890 -16.498 495 HB2 LYS 63 HB2 LYS 63 5.014 -3.395 -16.866 496 HB3 LYS 63 HB3 LYS 63 5.611 -4.962 -16.301 497 HG2 LYS 63 HG2 LYS 63 4.679 -6.007 -18.414 498 HG3 LYS 63 HG3 LYS 63 4.465 -4.343 -19.015 499 HD2 LYS 63 HD2 LYS 63 6.869 -3.928 -18.726 500 HD3 LYS 63 HD3 LYS 63 7.120 -5.578 -18.161 501 HE2 LYS 63 HE2 LYS 63 5.836 -4.883 -20.836 502 HE3 LYS 63 HE3 LYS 63 7.583 -5.144 -20.666 503 HZ1 LYS 63 HZ1 LYS 63 5.636 -7.218 -19.842 504 HZ2 LYS 63 HZ2 LYS 63 7.229 -7.384 -20.143 505 HZ3 LYS 63 HZ3 LYS 63 6.147 -7.114 -21.364 Start of MODEL 9 1 H1 GLY 1 H GLY 1 0.525 1.024 0.456 2 HA2 GLY 1 HA2 GLY 1 2.506 0.007 -0.620 3 HA3 GLY 1 HA3 GLY 1 1.392 -0.606 -1.875 4 H ILE 2 H ILE 2 3.601 1.098 -2.406 5 HA ILE 2 HA ILE 2 2.930 3.853 -2.573 6 HB ILE 2 HB ILE 2 5.235 2.869 -2.673 7 HG12 ILE 2 HG12 ILE 2 6.273 4.193 -4.217 8 HG13 ILE 2 HG13 ILE 2 4.806 4.428 -5.195 9 HG21 ILE 2 HG21 ILE 2 5.729 2.054 -5.257 10 HG22 ILE 2 HG22 ILE 2 5.461 1.001 -3.849 11 HG23 ILE 2 HG23 ILE 2 4.147 1.361 -4.967 12 HD11 ILE 2 HD11 ILE 2 5.360 6.409 -3.816 13 HD12 ILE 2 HD12 ILE 2 3.797 5.753 -3.353 14 HD13 ILE 2 HD13 ILE 2 5.231 5.427 -2.340 15 H ASP 3 H ASP 3 2.475 5.142 -4.482 16 HA ASP 3 HA ASP 3 0.832 3.742 -6.500 17 HB2 ASP 3 HB2 ASP 3 0.339 6.549 -5.579 18 HB3 ASP 3 HB3 ASP 3 -0.695 5.477 -6.474 19 H ALA 4 H ALA 4 1.883 4.018 -8.412 20 HA ALA 4 HA ALA 4 4.217 5.574 -8.698 21 HB1 ALA 4 HB1 ALA 4 3.850 3.693 -10.133 22 HB2 ALA 4 HB2 ALA 4 2.318 4.356 -10.722 23 HB3 ALA 4 HB3 ALA 4 3.850 5.142 -11.157 24 H ALA 5 H ALA 5 0.845 6.346 -9.575 25 HA ALA 5 HA ALA 5 1.294 8.824 -10.862 26 HB1 ALA 5 HB1 ALA 5 -1.066 9.312 -10.311 27 HB2 ALA 5 HB2 ALA 5 -0.898 7.650 -10.886 28 HB3 ALA 5 HB3 ALA 5 -1.089 7.975 -9.147 29 H GLN 6 H GLN 6 0.898 8.087 -7.420 30 HA GLN 6 HA GLN 6 0.783 10.790 -6.516 31 HB2 GLN 6 HB2 GLN 6 1.735 8.217 -5.173 32 HB3 GLN 6 HB3 GLN 6 1.690 9.737 -4.315 33 HG2 GLN 6 HG2 GLN 6 -0.782 8.606 -5.694 34 HG3 GLN 6 HG3 GLN 6 -0.311 8.166 -4.050 35 HE21 GLN 6 HE21 GLN 6 -1.802 10.710 -6.011 36 HE22 GLN 6 HE22 GLN 6 -2.094 11.764 -4.647 37 H ILE 7 H ILE 7 3.580 8.589 -7.085 38 HA ILE 7 HA ILE 7 5.548 10.356 -6.085 39 HB ILE 7 HB ILE 7 5.831 8.251 -8.213 40 HG12 ILE 7 HG12 ILE 7 6.464 7.896 -5.282 41 HG13 ILE 7 HG13 ILE 7 4.943 7.372 -6.013 42 HG21 ILE 7 HG21 ILE 7 8.281 8.291 -7.336 43 HG22 ILE 7 HG22 ILE 7 7.779 9.726 -8.214 44 HG23 ILE 7 HG23 ILE 7 7.831 9.747 -6.439 45 HD11 ILE 7 HD11 ILE 7 6.001 5.759 -7.412 46 HD12 ILE 7 HD12 ILE 7 7.630 6.353 -7.067 47 HD13 ILE 7 HD13 ILE 7 6.726 5.573 -5.811 48 H VAL 8 H VAL 8 4.101 10.022 -9.351 49 HA VAL 8 HA VAL 8 5.968 11.794 -10.635 50 HB VAL 8 HB VAL 8 3.109 11.001 -11.347 51 HG11 VAL 8 HG11 VAL 8 3.626 11.784 -13.636 52 HG12 VAL 8 HG12 VAL 8 3.649 13.134 -12.500 53 HG13 VAL 8 HG13 VAL 8 5.169 12.448 -13.075 54 HG21 VAL 8 HG21 VAL 8 4.599 9.106 -11.370 55 HG22 VAL 8 HG22 VAL 8 4.299 9.595 -13.044 56 HG23 VAL 8 HG23 VAL 8 5.827 10.026 -12.264 57 H ASP 9 H ASP 9 2.761 12.318 -9.097 58 HA ASP 9 HA ASP 9 2.624 15.079 -9.785 59 HB2 ASP 9 HB2 ASP 9 0.723 13.539 -9.094 60 HB3 ASP 9 HB3 ASP 9 1.307 13.708 -7.440 61 H GLU 10 H GLU 10 3.769 13.445 -6.755 62 HA GLU 10 HA GLU 10 4.339 15.982 -5.507 63 HB2 GLU 10 HB2 GLU 10 5.596 14.723 -3.854 64 HB3 GLU 10 HB3 GLU 10 4.037 13.955 -4.196 65 HG2 GLU 10 HG2 GLU 10 5.216 12.379 -5.709 66 HG3 GLU 10 HG3 GLU 10 6.742 13.087 -5.287 67 H ALA 11 H ALA 11 6.135 13.972 -7.822 68 HA ALA 11 HA ALA 11 8.670 15.270 -7.294 69 HB1 ALA 11 HB1 ALA 11 7.647 13.819 -9.780 70 HB2 ALA 11 HB2 ALA 11 9.327 14.308 -9.512 71 HB3 ALA 11 HB3 ALA 11 8.569 13.101 -8.452 72 H LEU 12 H LEU 12 5.840 15.849 -9.423 73 HA LEU 12 HA LEU 12 6.935 18.026 -10.885 74 HB2 LEU 12 HB2 LEU 12 4.063 17.266 -10.224 75 HB3 LEU 12 HB3 LEU 12 4.449 18.637 -11.225 76 HG LEU 12 HG LEU 12 5.276 15.817 -11.891 77 HD11 LEU 12 HD11 LEU 12 2.867 16.042 -11.979 78 HD12 LEU 12 HD12 LEU 12 3.535 15.894 -13.615 79 HD13 LEU 12 HD13 LEU 12 3.023 17.489 -12.999 80 HD21 LEU 12 HD21 LEU 12 5.781 16.691 -14.118 81 HD22 LEU 12 HD22 LEU 12 6.794 17.465 -12.897 82 HD23 LEU 12 HD23 LEU 12 5.410 18.337 -13.567 83 H GLU 13 H GLU 13 5.375 17.860 -7.700 84 HA GLU 13 HA GLU 13 4.949 20.638 -7.298 85 HB2 GLU 13 HB2 GLU 13 5.511 18.300 -5.458 86 HB3 GLU 13 HB3 GLU 13 5.471 19.906 -4.789 87 HG2 GLU 13 HG2 GLU 13 3.149 18.740 -6.365 88 HG3 GLU 13 HG3 GLU 13 3.361 18.496 -4.632 89 H GLN 14 H GLN 14 7.878 18.666 -7.030 90 HA GLN 14 HA GLN 14 9.420 20.968 -5.969 91 HB2 GLN 14 HB2 GLN 14 11.000 18.698 -6.825 92 HB3 GLN 14 HB3 GLN 14 11.005 19.558 -5.312 93 HG2 GLN 14 HG2 GLN 14 9.073 17.344 -6.045 94 HG3 GLN 14 HG3 GLN 14 10.594 17.127 -5.213 95 HE21 GLN 14 HE21 GLN 14 7.582 16.924 -4.437 96 HE22 GLN 14 HE22 GLN 14 7.874 17.204 -2.735 97 H GLY 15 H GLY 15 8.254 20.203 -8.912 98 HA2 GLY 15 HA2 GLY 15 8.619 21.262 -10.919 99 HA3 GLY 15 HA3 GLY 15 10.198 21.814 -10.366 100 H ILE 16 H ILE 16 9.689 18.373 -9.931 101 HA ILE 16 HA ILE 16 11.477 17.939 -12.240 102 HB ILE 16 HB ILE 16 10.793 16.030 -9.998 103 HG12 ILE 16 HG12 ILE 16 13.558 17.019 -9.942 104 HG13 ILE 16 HG13 ILE 16 12.441 18.359 -9.774 105 HG21 ILE 16 HG21 ILE 16 12.827 16.019 -12.271 106 HG22 ILE 16 HG22 ILE 16 12.935 14.912 -10.899 107 HG23 ILE 16 HG23 ILE 16 11.539 14.849 -11.960 108 HD11 ILE 16 HD11 ILE 16 11.244 16.987 -7.963 109 HD12 ILE 16 HD12 ILE 16 12.645 15.917 -8.001 110 HD13 ILE 16 HD13 ILE 16 12.886 17.611 -7.583 111 H THR 17 H THR 17 10.745 17.193 -14.086 112 HA THR 17 HA THR 17 8.054 16.002 -14.251 113 HB THR 17 HB THR 17 10.035 17.347 -16.095 114 HG1 THR 17 HG1 THR 17 8.262 18.454 -15.085 115 HG21 THR 17 HG21 THR 17 9.630 15.345 -17.344 116 HG22 THR 17 HG22 THR 17 8.629 16.621 -18.050 117 HG23 THR 17 HG23 THR 17 7.906 15.370 -16.988 118 H LEU 18 H LEU 18 7.735 13.903 -14.438 119 HA LEU 18 HA LEU 18 10.029 12.067 -14.911 120 HB2 LEU 18 HB2 LEU 18 7.220 11.740 -13.733 121 HB3 LEU 18 HB3 LEU 18 8.230 10.398 -14.154 122 HG LEU 18 HG LEU 18 8.227 11.998 -11.709 123 HD11 LEU 18 HD11 LEU 18 9.566 9.384 -12.526 124 HD12 LEU 18 HD12 LEU 18 7.966 9.584 -11.819 125 HD13 LEU 18 HD13 LEU 18 9.384 9.993 -10.850 126 HD21 LEU 18 HD21 LEU 18 10.681 12.026 -11.326 127 HD22 LEU 18 HD22 LEU 18 10.201 13.109 -12.661 128 HD23 LEU 18 HD23 LEU 18 10.898 11.524 -13.029 129 H PHE 19 H PHE 19 9.930 10.503 -16.499 130 HA PHE 19 HA PHE 19 7.603 10.088 -18.174 131 HB2 PHE 19 HB2 PHE 19 8.499 10.951 -20.283 132 HB3 PHE 19 HB3 PHE 19 8.179 12.232 -19.155 133 HD1 PHE 19 HD1 PHE 19 10.657 10.797 -21.375 134 HD2 PHE 19 HD2 PHE 19 10.193 13.203 -17.810 135 HE1 PHE 19 HE1 PHE 19 12.894 11.759 -21.719 136 HE2 PHE 19 HE2 PHE 19 12.427 14.152 -18.175 137 HZ PHE 19 HZ PHE 19 13.818 13.416 -20.075 138 H VAL 20 H VAL 20 8.583 8.784 -20.272 139 HA VAL 20 HA VAL 20 10.930 7.177 -19.435 140 HB VAL 20 HB VAL 20 8.620 5.727 -20.756 141 HG11 VAL 20 HG11 VAL 20 9.625 3.801 -19.781 142 HG12 VAL 20 HG12 VAL 20 10.873 4.716 -20.611 143 HG13 VAL 20 HG13 VAL 20 10.766 4.780 -18.830 144 HG21 VAL 20 HG21 VAL 20 7.530 6.611 -18.829 145 HG22 VAL 20 HG22 VAL 20 7.832 4.905 -18.561 146 HG23 VAL 20 HG23 VAL 20 8.861 6.117 -17.744 147 H VAL 21 H VAL 21 12.304 6.769 -21.159 148 HA VAL 21 HA VAL 21 11.322 7.375 -23.873 149 HB VAL 21 HB VAL 21 12.399 9.347 -23.286 150 HG11 VAL 21 HG11 VAL 21 14.847 9.411 -22.642 151 HG12 VAL 21 HG12 VAL 21 13.677 8.937 -21.408 152 HG13 VAL 21 HG13 VAL 21 14.692 7.703 -22.194 153 HG21 VAL 21 HG21 VAL 21 12.887 8.349 -25.537 154 HG22 VAL 21 HG22 VAL 21 14.146 9.460 -24.976 155 HG23 VAL 21 HG23 VAL 21 14.419 7.714 -24.886 156 H ASN 22 H ASN 22 11.795 5.758 -25.261 157 HA ASN 22 HA ASN 22 12.382 3.649 -25.913 158 HB2 ASN 22 HB2 ASN 22 15.096 4.804 -25.116 159 HB3 ASN 22 HB3 ASN 22 14.886 3.288 -25.984 160 HD21 ASN 22 HD21 ASN 22 15.455 6.550 -26.550 161 HD22 ASN 22 HD22 ASN 22 14.865 6.586 -28.187 162 H ASN 23 H ASN 23 11.183 3.368 -23.397 163 HA ASN 23 HA ASN 23 10.990 2.158 -21.658 164 HB2 ASN 23 HB2 ASN 23 10.981 0.505 -23.412 165 HB3 ASN 23 HB3 ASN 23 12.742 0.287 -23.250 166 HD21 ASN 23 HD21 ASN 23 9.780 0.291 -21.093 167 HD22 ASN 23 HD22 ASN 23 10.244 -1.185 -20.311 168 H ARG 24 H ARG 24 12.977 4.155 -21.400 169 HA ARG 24 HA ARG 24 14.602 3.082 -19.144 170 HB2 ARG 24 HB2 ARG 24 15.434 5.257 -21.133 171 HB3 ARG 24 HB3 ARG 24 16.360 4.737 -19.742 172 HG2 ARG 24 HG2 ARG 24 15.731 2.722 -21.901 173 HG3 ARG 24 HG3 ARG 24 16.974 3.950 -22.063 174 HD2 ARG 24 HD2 ARG 24 18.265 2.424 -21.142 175 HD3 ARG 24 HD3 ARG 24 17.726 3.136 -19.650 176 HE ARG 24 HE ARG 24 15.867 1.132 -20.201 177 HH11 ARG 24 HH11 ARG 24 19.390 1.280 -19.645 178 HH12 ARG 24 HH12 ARG 24 19.461 -0.202 -18.769 179 HH21 ARG 24 HH21 ARG 24 16.041 -0.984 -19.191 180 HH22 ARG 24 HH22 ARG 24 17.575 -1.439 -18.445 181 H LEU 25 H LEU 25 13.961 4.033 -17.378 182 HA LEU 25 HA LEU 25 12.059 6.288 -17.355 183 HB2 LEU 25 HB2 LEU 25 12.105 4.331 -15.658 184 HB3 LEU 25 HB3 LEU 25 13.445 5.158 -14.891 185 HG LEU 25 HG LEU 25 10.640 6.230 -15.231 186 HD11 LEU 25 HD11 LEU 25 10.856 4.498 -13.476 187 HD12 LEU 25 HD12 LEU 25 10.470 6.073 -12.818 188 HD13 LEU 25 HD13 LEU 25 12.125 5.468 -12.684 189 HD21 LEU 25 HD21 LEU 25 11.935 8.229 -15.134 190 HD22 LEU 25 HD22 LEU 25 13.100 7.535 -13.964 191 HD23 LEU 25 HD23 LEU 25 11.443 7.973 -13.500 192 H GLN 26 H GLN 26 12.685 8.432 -17.401 193 HA GLN 26 HA GLN 26 15.122 9.242 -15.997 194 HB2 GLN 26 HB2 GLN 26 14.662 10.542 -18.661 195 HB3 GLN 26 HB3 GLN 26 16.118 10.346 -17.711 196 HG2 GLN 26 HG2 GLN 26 15.882 7.783 -18.400 197 HG3 GLN 26 HG3 GLN 26 14.841 8.440 -19.684 198 HE21 GLN 26 HE21 GLN 26 15.907 10.178 -21.094 199 HE22 GLN 26 HE22 GLN 26 17.633 10.151 -21.287 200 H TYR 27 H TYR 27 15.089 11.802 -16.020 201 HA TYR 27 HA TYR 27 12.364 12.929 -15.958 202 HB2 TYR 27 HB2 TYR 27 12.678 13.776 -13.721 203 HB3 TYR 27 HB3 TYR 27 12.773 12.022 -13.734 204 HD1 TYR 27 HD1 TYR 27 14.745 10.858 -13.312 205 HD2 TYR 27 HD2 TYR 27 14.685 15.131 -13.217 206 HE1 TYR 27 HE1 TYR 27 16.965 10.864 -12.046 207 HE2 TYR 27 HE2 TYR 27 16.819 15.191 -11.959 208 HH TYR 27 HH TYR 27 18.450 13.938 -10.905 209 H GLU 28 H GLU 28 12.518 15.324 -15.674 210 HA GLU 28 HA GLU 28 15.062 16.509 -16.557 211 HB2 GLU 28 HB2 GLU 28 13.781 16.123 -18.567 212 HB3 GLU 28 HB3 GLU 28 12.305 16.740 -17.816 213 HG2 GLU 28 HG2 GLU 28 13.221 18.377 -19.335 214 HG3 GLU 28 HG3 GLU 28 13.266 18.977 -17.680 215 H THR 29 H THR 29 15.383 18.507 -15.482 216 HA THR 29 HA THR 29 13.340 20.064 -14.278 217 HB THR 29 HB THR 29 13.407 18.165 -12.692 218 HG1 THR 29 HG1 THR 29 13.465 19.332 -10.932 219 HG21 THR 29 HG21 THR 29 15.245 17.524 -11.402 220 HG22 THR 29 HG22 THR 29 16.247 18.885 -11.983 221 HG23 THR 29 HG23 THR 29 15.837 17.533 -13.057 222 H SER 30 H SER 30 14.354 22.129 -13.808 223 HA SER 30 HA SER 30 17.290 22.324 -14.347 224 HB2 SER 30 HB2 SER 30 15.344 24.521 -15.018 225 HB3 SER 30 HB3 SER 30 16.971 24.198 -15.631 226 HG SER 30 HG SER 30 16.038 22.352 -16.754 227 H ARG 31 H ARG 31 17.560 22.051 -12.008 228 HA ARG 31 HA ARG 31 17.602 24.523 -10.611 229 HB2 ARG 31 HB2 ARG 31 16.116 23.867 -8.697 230 HB3 ARG 31 HB3 ARG 31 15.251 24.162 -10.193 231 HG2 ARG 31 HG2 ARG 31 15.120 21.729 -10.623 232 HG3 ARG 31 HG3 ARG 31 16.021 21.395 -9.144 233 HD2 ARG 31 HD2 ARG 31 13.550 21.085 -8.927 234 HD3 ARG 31 HD3 ARG 31 14.267 22.201 -7.762 235 HE ARG 31 HE ARG 31 12.904 23.798 -8.440 236 HH11 ARG 31 HH11 ARG 31 13.167 21.651 -11.308 237 HH12 ARG 31 HH12 ARG 31 12.051 22.608 -12.230 238 HH21 ARG 31 HH21 ARG 31 11.243 24.768 -9.577 239 HH22 ARG 31 HH22 ARG 31 11.039 24.545 -11.287 240 H ASP 32 H ASP 32 18.137 23.939 -8.170 241 HA ASP 32 HA ASP 32 20.094 21.731 -8.067 242 HB2 ASP 32 HB2 ASP 32 21.505 23.264 -6.788 243 HB3 ASP 32 HB3 ASP 32 21.108 23.987 -8.334 244 H SER 33 H SER 33 20.681 21.275 -5.772 245 HA SER 33 HA SER 33 20.158 20.298 -3.864 246 HB2 SER 33 HB2 SER 33 18.711 22.935 -3.508 247 HB3 SER 33 HB3 SER 33 19.151 21.832 -2.184 248 HG SER 33 HG SER 33 20.707 23.587 -2.800 249 H ILE 34 H ILE 34 18.637 19.161 -5.804 250 HA ILE 34 HA ILE 34 15.868 18.984 -5.321 251 HB ILE 34 HB ILE 34 17.979 17.257 -6.604 252 HG12 ILE 34 HG12 ILE 34 15.278 18.268 -7.626 253 HG13 ILE 34 HG13 ILE 34 16.761 19.195 -7.713 254 HG21 ILE 34 HG21 ILE 34 15.160 16.181 -6.311 255 HG22 ILE 34 HG22 ILE 34 16.475 15.453 -7.247 256 HG23 ILE 34 HG23 ILE 34 16.571 15.491 -5.498 257 HD11 ILE 34 HD11 ILE 34 16.097 16.618 -9.177 258 HD12 ILE 34 HD12 ILE 34 16.588 18.203 -9.830 259 HD13 ILE 34 HD13 ILE 34 17.778 17.186 -9.006 260 HA PRO 35 HA PRO 35 15.554 16.736 -1.491 261 HB2 PRO 35 HB2 PRO 35 13.123 15.479 -1.867 262 HB3 PRO 35 HB3 PRO 35 13.329 17.206 -1.406 263 HG2 PRO 35 HG2 PRO 35 12.752 16.020 -4.109 264 HG3 PRO 35 HG3 PRO 35 12.065 17.488 -3.351 265 HD2 PRO 35 HD2 PRO 35 14.068 17.623 -5.183 266 HD3 PRO 35 HD3 PRO 35 13.984 18.748 -3.809 267 H THR 36 H THR 36 16.978 15.102 -1.292 268 HA THR 36 HA THR 36 17.405 13.001 -3.103 269 HB THR 36 HB THR 36 18.962 14.048 -1.425 270 HG1 THR 36 HG1 THR 36 20.152 12.425 -1.776 271 HG21 THR 36 HG21 THR 36 17.458 13.770 0.596 272 HG22 THR 36 HG22 THR 36 19.117 13.206 0.816 273 HG23 THR 36 HG23 THR 36 17.810 12.035 0.549 274 H GLU 37 H GLU 37 15.197 13.189 -0.321 275 HA GLU 37 HA GLU 37 14.674 10.448 0.068 276 HB2 GLU 37 HB2 GLU 37 12.464 11.291 0.981 277 HB3 GLU 37 HB3 GLU 37 13.918 11.980 1.695 278 HG2 GLU 37 HG2 GLU 37 13.646 14.058 0.408 279 HG3 GLU 37 HG3 GLU 37 12.236 13.411 -0.419 280 H LEU 38 H LEU 38 12.958 12.791 -1.961 281 HA LEU 38 HA LEU 38 11.176 10.954 -3.187 282 HB2 LEU 38 HB2 LEU 38 11.236 13.598 -2.760 283 HB3 LEU 38 HB3 LEU 38 11.907 13.627 -4.368 284 HG LEU 38 HG LEU 38 9.200 12.485 -3.540 285 HD11 LEU 38 HD11 LEU 38 9.473 14.979 -3.435 286 HD12 LEU 38 HD12 LEU 38 8.324 14.483 -4.669 287 HD13 LEU 38 HD13 LEU 38 9.964 14.966 -5.149 288 HD21 LEU 38 HD21 LEU 38 8.745 12.428 -6.002 289 HD22 LEU 38 HD22 LEU 38 10.001 11.284 -5.521 290 HD23 LEU 38 HD23 LEU 38 10.454 12.840 -6.283 291 H LEU 39 H LEU 39 14.365 12.312 -4.068 292 HA LEU 39 HA LEU 39 14.577 11.421 -6.736 293 HB2 LEU 39 HB2 LEU 39 16.183 12.830 -5.144 294 HB3 LEU 39 HB3 LEU 39 16.984 11.285 -4.911 295 HG LEU 39 HG LEU 39 16.503 12.768 -7.519 296 HD11 LEU 39 HD11 LEU 39 18.220 13.751 -6.036 297 HD12 LEU 39 HD12 LEU 39 18.920 13.116 -7.524 298 HD13 LEU 39 HD13 LEU 39 19.079 12.203 -6.004 299 HD21 LEU 39 HD21 LEU 39 18.034 10.157 -7.130 300 HD22 LEU 39 HD22 LEU 39 17.973 11.123 -8.625 301 HD23 LEU 39 HD23 LEU 39 16.516 10.352 -8.029 302 H ASN 40 H ASN 40 15.483 9.858 -3.686 303 HA ASN 40 HA ASN 40 16.271 7.315 -4.739 304 HB2 ASN 40 HB2 ASN 40 15.588 8.298 -1.964 305 HB3 ASN 40 HB3 ASN 40 15.784 6.580 -2.269 306 HD21 ASN 40 HD21 ASN 40 17.461 9.652 -2.125 307 HD22 ASN 40 HD22 ASN 40 19.067 8.966 -2.086 308 H LYS 41 H LYS 41 13.095 8.608 -3.747 309 HA LYS 41 HA LYS 41 11.767 6.080 -3.590 310 HB2 LYS 41 HB2 LYS 41 10.855 8.167 -2.673 311 HB3 LYS 41 HB3 LYS 41 10.636 8.832 -4.296 312 HG2 LYS 41 HG2 LYS 41 8.897 7.357 -4.832 313 HG3 LYS 41 HG3 LYS 41 9.403 6.186 -3.609 314 HD2 LYS 41 HD2 LYS 41 7.344 7.239 -2.924 315 HD3 LYS 41 HD3 LYS 41 8.657 7.647 -1.809 316 HE2 LYS 41 HE2 LYS 41 8.887 9.855 -3.049 317 HE3 LYS 41 HE3 LYS 41 7.419 9.414 -3.954 318 HZ1 LYS 41 HZ1 LYS 41 7.547 9.733 -0.999 319 HZ2 LYS 41 HZ2 LYS 41 6.198 9.410 -1.911 320 HZ3 LYS 41 HZ3 LYS 41 6.950 10.822 -2.078 321 H TRP 42 H TRP 42 12.564 8.224 -6.327 322 HA TRP 42 HA TRP 42 11.024 6.914 -8.269 323 HB2 TRP 42 HB2 TRP 42 13.738 8.182 -8.697 324 HB3 TRP 42 HB3 TRP 42 12.515 7.867 -9.941 325 HD1 TRP 42 HD1 TRP 42 10.115 9.106 -7.987 326 HE1 TRP 42 HE1 TRP 42 9.894 11.643 -7.951 327 HE3 TRP 42 HE3 TRP 42 14.791 10.284 -9.604 328 HZ2 TRP 42 HZ2 TRP 42 11.661 13.923 -8.277 329 HZ3 TRP 42 HZ3 TRP 42 15.524 12.671 -9.693 330 HH2 TRP 42 HH2 TRP 42 14.021 14.466 -8.950 331 H LYS 43 H LYS 43 14.505 6.325 -7.436 332 HA LYS 43 HA LYS 43 14.693 4.117 -9.255 333 HB2 LYS 43 HB2 LYS 43 16.778 3.494 -8.018 334 HB3 LYS 43 HB3 LYS 43 16.759 5.136 -8.623 335 HG2 LYS 43 HG2 LYS 43 16.281 6.051 -6.468 336 HG3 LYS 43 HG3 LYS 43 16.068 4.437 -5.748 337 HD2 LYS 43 HD2 LYS 43 18.687 5.389 -6.946 338 HD3 LYS 43 HD3 LYS 43 18.245 5.626 -5.260 339 HE2 LYS 43 HE2 LYS 43 17.963 3.196 -4.948 340 HE3 LYS 43 HE3 LYS 43 18.451 2.906 -6.623 341 HZ1 LYS 43 HZ1 LYS 43 20.187 4.330 -4.703 342 HZ2 LYS 43 HZ2 LYS 43 20.613 3.653 -6.147 343 HZ3 LYS 43 HZ3 LYS 43 20.236 2.704 -4.866 344 H GLN 44 H GLN 44 13.498 4.328 -5.940 345 HA GLN 44 HA GLN 44 13.726 1.592 -5.287 346 HB2 GLN 44 HB2 GLN 44 13.176 3.443 -3.667 347 HB3 GLN 44 HB3 GLN 44 11.602 3.606 -4.417 348 HG2 GLN 44 HG2 GLN 44 11.228 2.354 -2.476 349 HG3 GLN 44 HG3 GLN 44 11.103 1.208 -3.796 350 HE21 GLN 44 HE21 GLN 44 11.458 -0.210 -1.663 351 HE22 GLN 44 HE22 GLN 44 13.160 -0.587 -1.364 352 H HIS 45 H HIS 45 10.995 3.429 -6.698 353 HA HIS 45 HA HIS 45 9.655 0.885 -7.454 354 HB2 HIS 45 HB2 HIS 45 8.487 3.683 -7.114 355 HB3 HIS 45 HB3 HIS 45 7.604 2.184 -7.387 356 HD1 HIS 45 HD1 HIS 45 7.793 0.359 -5.300 357 HD2 HIS 45 HD2 HIS 45 9.070 4.313 -4.664 358 HE1 HIS 45 HE1 HIS 45 8.043 0.639 -2.775 359 H LYS 46 H LYS 46 11.867 1.926 -9.051 360 HA LYS 46 HA LYS 46 11.189 3.431 -11.246 361 HB2 LYS 46 HB2 LYS 46 13.466 2.339 -10.672 362 HB3 LYS 46 HB3 LYS 46 12.884 0.944 -11.580 363 HG2 LYS 46 HG2 LYS 46 12.341 2.832 -13.420 364 HG3 LYS 46 HG3 LYS 46 13.576 3.726 -12.516 365 HD2 LYS 46 HD2 LYS 46 15.104 1.751 -12.868 366 HD3 LYS 46 HD3 LYS 46 13.835 1.011 -13.846 367 HE2 LYS 46 HE2 LYS 46 15.302 1.974 -15.402 368 HE3 LYS 46 HE3 LYS 46 13.906 3.049 -15.360 369 HZ1 LYS 46 HZ1 LYS 46 16.523 3.457 -14.030 370 HZ2 LYS 46 HZ2 LYS 46 15.283 4.479 -13.832 371 HZ3 LYS 46 HZ3 LYS 46 15.979 4.322 -15.299 372 H GLN 47 H GLN 47 10.768 -0.173 -11.153 373 HA GLN 47 HA GLN 47 9.544 -0.245 -13.711 374 HB2 GLN 47 HB2 GLN 47 9.871 -2.116 -11.453 375 HB3 GLN 47 HB3 GLN 47 8.437 -2.444 -12.426 376 HG2 GLN 47 HG2 GLN 47 11.066 -1.869 -13.789 377 HG3 GLN 47 HG3 GLN 47 10.772 -3.482 -13.103 378 HE21 GLN 47 HE21 GLN 47 8.325 -1.382 -14.724 379 HE22 GLN 47 HE22 GLN 47 8.174 -2.452 -16.119 380 H GLU 48 H GLU 48 8.018 0.226 -10.556 381 HA GLU 48 HA GLU 48 5.348 0.008 -11.510 382 HB2 GLU 48 HB2 GLU 48 6.034 1.805 -9.189 383 HB3 GLU 48 HB3 GLU 48 4.670 0.699 -9.430 384 HG2 GLU 48 HG2 GLU 48 6.461 -1.202 -9.228 385 HG3 GLU 48 HG3 GLU 48 7.528 0.077 -8.624 386 H LEU 49 H LEU 49 7.589 2.739 -11.194 387 HA LEU 49 HA LEU 49 5.775 4.837 -11.985 388 HB2 LEU 49 HB2 LEU 49 8.792 4.523 -12.119 389 HB3 LEU 49 HB3 LEU 49 7.987 6.006 -12.595 390 HG LEU 49 HG LEU 49 7.471 4.821 -9.841 391 HD11 LEU 49 HD11 LEU 49 9.923 4.970 -10.270 392 HD12 LEU 49 HD12 LEU 49 9.316 5.993 -8.962 393 HD13 LEU 49 HD13 LEU 49 9.737 6.715 -10.551 394 HD21 LEU 49 HD21 LEU 49 7.308 7.583 -11.123 395 HD22 LEU 49 HD22 LEU 49 7.304 7.323 -9.382 396 HD23 LEU 49 HD23 LEU 49 6.004 6.646 -10.375 397 H ILE 50 H ILE 50 8.168 2.867 -13.737 398 HA ILE 50 HA ILE 50 7.832 4.126 -16.279 399 HB ILE 50 HB ILE 50 8.444 1.195 -15.648 400 HG12 ILE 50 HG12 ILE 50 10.426 3.193 -16.734 401 HG13 ILE 50 HG13 ILE 50 10.074 3.225 -15.022 402 HG21 ILE 50 HG21 ILE 50 7.591 1.189 -17.880 403 HG22 ILE 50 HG22 ILE 50 8.575 2.572 -18.322 404 HG23 ILE 50 HG23 ILE 50 9.334 1.001 -17.969 405 HD11 ILE 50 HD11 ILE 50 11.007 0.673 -16.397 406 HD12 ILE 50 HD12 ILE 50 12.088 1.842 -15.622 407 HD13 ILE 50 HD13 ILE 50 10.887 0.996 -14.659 408 H ASP 51 H ASP 51 6.183 1.198 -14.988 409 HA ASP 51 HA ASP 51 4.499 0.873 -17.151 410 HB2 ASP 51 HB2 ASP 51 4.932 -0.540 -14.966 411 HB3 ASP 51 HB3 ASP 51 3.524 0.347 -14.347 412 H PHE 52 H PHE 52 4.174 3.145 -14.492 413 HA PHE 52 HA PHE 52 1.462 3.911 -15.112 414 HB2 PHE 52 HB2 PHE 52 2.241 4.196 -12.896 415 HB3 PHE 52 HB3 PHE 52 3.618 5.161 -13.418 416 HD1 PHE 52 HD1 PHE 52 3.471 7.443 -13.066 417 HD2 PHE 52 HD2 PHE 52 -0.147 5.257 -13.941 418 HE1 PHE 52 HE1 PHE 52 2.150 9.577 -13.108 419 HE2 PHE 52 HE2 PHE 52 -1.423 7.371 -13.891 420 HZ PHE 52 HZ PHE 52 -0.217 9.551 -13.455 421 H LEU 53 H LEU 53 4.634 5.639 -15.581 422 HA LEU 53 HA LEU 53 3.509 7.822 -17.049 423 HB2 LEU 53 HB2 LEU 53 6.271 6.563 -16.992 424 HB3 LEU 53 HB3 LEU 53 5.877 7.871 -18.108 425 HG LEU 53 HG LEU 53 7.062 8.809 -16.411 426 HD11 LEU 53 HD11 LEU 53 4.173 9.535 -15.795 427 HD12 LEU 53 HD12 LEU 53 5.125 10.141 -17.170 428 HD13 LEU 53 HD13 LEU 53 5.625 10.533 -15.527 429 HD21 LEU 53 HD21 LEU 53 6.884 7.132 -14.680 430 HD22 LEU 53 HD22 LEU 53 5.208 7.594 -14.364 431 HD23 LEU 53 HD23 LEU 53 6.523 8.733 -14.022 432 H ASN 54 H ASN 54 4.351 4.523 -17.970 433 HA ASN 54 HA ASN 54 4.353 5.098 -20.821 434 HB2 ASN 54 HB2 ASN 54 5.325 2.981 -19.384 435 HB3 ASN 54 HB3 ASN 54 3.829 2.306 -19.943 436 HD21 ASN 54 HD21 ASN 54 7.001 3.227 -20.635 437 HD22 ASN 54 HD22 ASN 54 6.888 3.364 -22.394 438 H GLN 55 H GLN 55 1.989 3.401 -18.586 439 HA GLN 55 HA GLN 55 0.072 3.378 -20.632 440 HB2 GLN 55 HB2 GLN 55 -1.551 2.663 -18.974 441 HB3 GLN 55 HB3 GLN 55 0.014 1.893 -18.710 442 HG2 GLN 55 HG2 GLN 55 -0.573 2.359 -16.556 443 HG3 GLN 55 HG3 GLN 55 0.412 3.725 -16.948 444 HE21 GLN 55 HE21 GLN 55 -0.438 5.802 -16.683 445 HE22 GLN 55 HE22 GLN 55 -2.120 6.112 -16.271 446 H LEU 56 H LEU 56 1.102 6.025 -18.726 447 HA LEU 56 HA LEU 56 -1.313 7.631 -18.871 448 HB2 LEU 56 HB2 LEU 56 0.380 7.832 -17.025 449 HB3 LEU 56 HB3 LEU 56 1.602 8.242 -18.222 450 HG LEU 56 HG LEU 56 0.404 10.362 -18.728 451 HD11 LEU 56 HD11 LEU 56 -1.374 11.149 -17.250 452 HD12 LEU 56 HD12 LEU 56 -1.335 9.627 -16.330 453 HD13 LEU 56 HD13 LEU 56 -1.886 9.656 -18.032 454 HD21 LEU 56 HD21 LEU 56 1.125 9.889 -15.821 455 HD22 LEU 56 HD22 LEU 56 0.985 11.470 -16.629 456 HD23 LEU 56 HD23 LEU 56 2.232 10.324 -17.144 457 H ASP 57 H ASP 57 1.604 7.248 -20.902 458 HA ASP 57 HA ASP 57 0.618 9.554 -22.592 459 HB2 ASP 57 HB2 ASP 57 2.796 9.637 -21.132 460 HB3 ASP 57 HB3 ASP 57 3.500 8.675 -22.413 461 H SER 58 H SER 58 1.508 6.291 -22.575 462 HA SER 58 HA SER 58 1.606 6.131 -25.561 463 HB2 SER 58 HB2 SER 58 2.894 4.323 -23.483 464 HB3 SER 58 HB3 SER 58 3.075 4.195 -25.241 465 HG SER 58 HG SER 58 3.896 6.394 -25.164 466 H GLU 59 H GLU 59 0.151 4.995 -22.660 467 HA GLU 59 HA GLU 59 -1.333 3.480 -22.033 468 HB2 GLU 59 HB2 GLU 59 -3.529 3.979 -22.764 469 HB3 GLU 59 HB3 GLU 59 -2.553 5.444 -22.634 470 HG2 GLU 59 HG2 GLU 59 -2.237 5.474 -25.088 471 HG3 GLU 59 HG3 GLU 59 -3.204 3.999 -25.226 472 H GLU 60 H GLU 60 0.084 2.453 -24.815 473 HA GLU 60 HA GLU 60 -1.730 0.226 -25.349 474 HB2 GLU 60 HB2 GLU 60 1.042 0.925 -26.404 475 HB3 GLU 60 HB3 GLU 60 0.071 -0.443 -26.955 476 HG2 GLU 60 HG2 GLU 60 -1.673 1.753 -27.183 477 HG3 GLU 60 HG3 GLU 60 -0.097 2.391 -27.682 478 H GLN 61 H GLN 61 0.861 0.632 -23.031 479 HA GLN 61 HA GLN 61 0.865 -2.301 -22.638 480 HB2 GLN 61 HB2 GLN 61 3.279 -2.221 -22.241 481 HB3 GLN 61 HB3 GLN 61 2.822 -1.793 -23.883 482 HG2 GLN 61 HG2 GLN 61 3.061 0.694 -23.072 483 HG3 GLN 61 HG3 GLN 61 3.955 0.004 -21.723 484 HE21 GLN 61 HE21 GLN 61 6.095 0.098 -22.011 485 HE22 GLN 61 HE22 GLN 61 6.866 0.153 -23.601 486 H THR 62 H THR 62 0.701 -2.979 -20.579 487 HA THR 62 HA THR 62 1.352 -1.386 -18.285 488 HB THR 62 HB THR 62 -1.547 -2.215 -18.352 489 HG1 THR 62 HG1 THR 62 -0.518 0.035 -19.675 490 HG21 THR 62 HG21 THR 62 -1.737 -0.275 -16.787 491 HG22 THR 62 HG22 THR 62 -0.015 0.088 -17.055 492 HG23 THR 62 HG23 THR 62 -0.505 -1.429 -16.282 493 H LYS 63 H LYS 63 1.512 -2.874 -16.429 494 HA LYS 63 HA LYS 63 0.490 -5.589 -16.700 495 HB2 LYS 63 HB2 LYS 63 2.770 -6.618 -16.338 496 HB3 LYS 63 HB3 LYS 63 2.452 -6.047 -17.956 497 HG2 LYS 63 HG2 LYS 63 3.957 -4.320 -17.858 498 HG3 LYS 63 HG3 LYS 63 3.860 -4.134 -16.108 499 HD2 LYS 63 HD2 LYS 63 5.097 -6.629 -17.336 500 HD3 LYS 63 HD3 LYS 63 6.012 -5.126 -17.125 501 HE2 LYS 63 HE2 LYS 63 5.410 -5.082 -14.718 502 HE3 LYS 63 HE3 LYS 63 4.585 -6.631 -14.890 503 HZ1 LYS 63 HZ1 LYS 63 7.470 -6.250 -15.463 504 HZ2 LYS 63 HZ2 LYS 63 6.676 -7.674 -15.382 505 HZ3 LYS 63 HZ3 LYS 63 6.864 -6.800 -14.020 Start of MODEL 10 1 H1 GLY 1 H GLY 1 2.134 1.005 1.025 2 HA2 GLY 1 HA2 GLY 1 2.863 -0.262 -0.939 3 HA3 GLY 1 HA3 GLY 1 1.176 -0.209 -1.504 4 H ILE 2 H ILE 2 3.663 0.891 -2.822 5 HA ILE 2 HA ILE 2 3.326 3.809 -2.537 6 HB ILE 2 HB ILE 2 5.572 2.701 -2.845 7 HG12 ILE 2 HG12 ILE 2 6.574 4.173 -4.309 8 HG13 ILE 2 HG13 ILE 2 5.058 4.458 -5.208 9 HG21 ILE 2 HG21 ILE 2 4.367 1.886 -5.531 10 HG22 ILE 2 HG22 ILE 2 6.079 2.033 -5.298 11 HG23 ILE 2 HG23 ILE 2 5.174 0.873 -4.322 12 HD11 ILE 2 HD11 ILE 2 5.520 5.342 -2.347 13 HD12 ILE 2 HD12 ILE 2 5.739 6.355 -3.771 14 HD13 ILE 2 HD13 ILE 2 4.139 5.756 -3.388 15 H ASP 3 H ASP 3 2.817 5.185 -4.520 16 HA ASP 3 HA ASP 3 1.101 3.762 -6.440 17 HB2 ASP 3 HB2 ASP 3 0.473 6.396 -5.180 18 HB3 ASP 3 HB3 ASP 3 -0.550 5.411 -6.195 19 H ALA 4 H ALA 4 1.985 4.156 -8.309 20 HA ALA 4 HA ALA 4 4.167 5.927 -8.707 21 HB1 ALA 4 HB1 ALA 4 3.757 5.548 -11.142 22 HB2 ALA 4 HB2 ALA 4 3.742 4.034 -10.210 23 HB3 ALA 4 HB3 ALA 4 2.216 4.767 -10.741 24 H ALA 5 H ALA 5 0.661 6.478 -9.301 25 HA ALA 5 HA ALA 5 0.884 8.987 -10.595 26 HB1 ALA 5 HB1 ALA 5 -1.220 7.580 -10.343 27 HB2 ALA 5 HB2 ALA 5 -1.293 8.093 -8.656 28 HB3 ALA 5 HB3 ALA 5 -1.444 9.295 -9.953 29 H GLN 6 H GLN 6 1.016 8.134 -7.167 30 HA GLN 6 HA GLN 6 0.680 10.829 -6.132 31 HB2 GLN 6 HB2 GLN 6 1.789 8.222 -4.961 32 HB3 GLN 6 HB3 GLN 6 1.687 9.684 -4.032 33 HG2 GLN 6 HG2 GLN 6 -0.741 8.401 -5.371 34 HG3 GLN 6 HG3 GLN 6 -0.219 8.050 -3.733 35 HE21 GLN 6 HE21 GLN 6 -1.713 10.552 -5.794 36 HE22 GLN 6 HE22 GLN 6 -2.168 11.555 -4.437 37 H ILE 7 H ILE 7 3.465 8.700 -7.009 38 HA ILE 7 HA ILE 7 5.408 10.522 -6.078 39 HB ILE 7 HB ILE 7 5.701 8.361 -8.149 40 HG12 ILE 7 HG12 ILE 7 6.381 8.030 -5.218 41 HG13 ILE 7 HG13 ILE 7 4.779 7.612 -5.799 42 HG21 ILE 7 HG21 ILE 7 7.699 9.635 -8.143 43 HG22 ILE 7 HG22 ILE 7 7.644 9.930 -6.397 44 HG23 ILE 7 HG23 ILE 7 8.099 8.335 -7.031 45 HD11 ILE 7 HD11 ILE 7 6.874 6.485 -7.540 46 HD12 ILE 7 HD12 ILE 7 6.964 5.905 -5.863 47 HD13 ILE 7 HD13 ILE 7 5.468 5.728 -6.837 48 H VAL 8 H VAL 8 3.822 10.110 -9.267 49 HA VAL 8 HA VAL 8 5.535 11.898 -10.698 50 HB VAL 8 HB VAL 8 2.654 11.027 -11.180 51 HG11 VAL 8 HG11 VAL 8 2.898 11.880 -13.472 52 HG12 VAL 8 HG12 VAL 8 3.036 13.227 -12.328 53 HG13 VAL 8 HG13 VAL 8 4.498 12.557 -13.081 54 HG21 VAL 8 HG21 VAL 8 5.339 10.269 -12.445 55 HG22 VAL 8 HG22 VAL 8 4.420 9.269 -11.303 56 HG23 VAL 8 HG23 VAL 8 3.748 9.620 -12.901 57 H ASP 9 H ASP 9 2.583 12.468 -8.782 58 HA ASP 9 HA ASP 9 2.304 15.224 -9.405 59 HB2 ASP 9 HB2 ASP 9 0.665 13.527 -8.288 60 HB3 ASP 9 HB3 ASP 9 1.433 13.999 -6.778 61 H GLU 10 H GLU 10 3.722 13.690 -6.420 62 HA GLU 10 HA GLU 10 4.587 16.136 -5.320 63 HB2 GLU 10 HB2 GLU 10 5.960 14.857 -3.819 64 HB3 GLU 10 HB3 GLU 10 4.400 14.048 -4.044 65 HG2 GLU 10 HG2 GLU 10 5.384 12.530 -5.659 66 HG3 GLU 10 HG3 GLU 10 6.959 13.288 -5.470 67 H ALA 11 H ALA 11 6.070 14.252 -7.920 68 HA ALA 11 HA ALA 11 8.689 15.554 -7.580 69 HB1 ALA 11 HB1 ALA 11 8.672 13.481 -8.703 70 HB2 ALA 11 HB2 ALA 11 7.400 14.000 -9.866 71 HB3 ALA 11 HB3 ALA 11 9.032 14.663 -9.973 72 H LEU 12 H LEU 12 5.770 16.019 -9.600 73 HA LEU 12 HA LEU 12 6.723 18.291 -11.048 74 HB2 LEU 12 HB2 LEU 12 3.956 17.349 -10.274 75 HB3 LEU 12 HB3 LEU 12 4.182 18.751 -11.309 76 HG LEU 12 HG LEU 12 5.252 16.023 -12.005 77 HD11 LEU 12 HD11 LEU 12 2.783 16.059 -11.901 78 HD12 LEU 12 HD12 LEU 12 3.409 15.785 -13.530 79 HD13 LEU 12 HD13 LEU 12 2.776 17.387 -13.089 80 HD21 LEU 12 HD21 LEU 12 5.470 16.967 -14.316 81 HD22 LEU 12 HD22 LEU 12 6.546 17.740 -13.171 82 HD23 LEU 12 HD23 LEU 12 5.050 18.556 -13.666 83 H GLU 13 H GLU 13 5.318 17.973 -7.765 84 HA GLU 13 HA GLU 13 4.677 20.672 -7.292 85 HB2 GLU 13 HB2 GLU 13 5.714 18.424 -5.590 86 HB3 GLU 13 HB3 GLU 13 5.430 20.015 -4.890 87 HG2 GLU 13 HG2 GLU 13 3.048 19.810 -5.699 88 HG3 GLU 13 HG3 GLU 13 3.394 18.128 -6.076 89 H GLN 14 H GLN 14 7.785 18.990 -7.403 90 HA GLN 14 HA GLN 14 9.241 21.387 -6.460 91 HB2 GLN 14 HB2 GLN 14 10.855 19.088 -7.259 92 HB3 GLN 14 HB3 GLN 14 10.921 20.089 -5.825 93 HG2 GLN 14 HG2 GLN 14 9.147 17.693 -6.274 94 HG3 GLN 14 HG3 GLN 14 10.645 17.713 -5.366 95 HE21 GLN 14 HE21 GLN 14 7.967 17.021 -4.513 96 HE22 GLN 14 HE22 GLN 14 7.506 18.063 -3.195 97 H GLY 15 H GLY 15 8.024 20.237 -9.311 98 HA2 GLY 15 HA2 GLY 15 8.231 21.178 -11.401 99 HA3 GLY 15 HA3 GLY 15 9.791 21.888 -10.964 100 H ILE 16 H ILE 16 9.419 18.474 -10.273 101 HA ILE 16 HA ILE 16 11.278 17.941 -12.498 102 HB ILE 16 HB ILE 16 10.538 16.167 -10.168 103 HG12 ILE 16 HG12 ILE 16 13.288 17.247 -10.159 104 HG13 ILE 16 HG13 ILE 16 12.083 18.504 -9.944 105 HG21 ILE 16 HG21 ILE 16 12.674 16.029 -12.350 106 HG22 ILE 16 HG22 ILE 16 12.683 14.988 -10.922 107 HG23 ILE 16 HG23 ILE 16 11.348 14.888 -12.061 108 HD11 ILE 16 HD11 ILE 16 12.420 16.044 -8.214 109 HD12 ILE 16 HD12 ILE 16 12.703 17.724 -7.781 110 HD13 ILE 16 HD13 ILE 16 11.044 17.147 -8.114 111 H THR 17 H THR 17 10.544 17.239 -14.324 112 HA THR 17 HA THR 17 7.886 16.021 -14.614 113 HB THR 17 HB THR 17 10.156 16.941 -16.416 114 HG1 THR 17 HG1 THR 17 8.846 18.548 -16.960 115 HG21 THR 17 HG21 THR 17 8.684 16.516 -18.354 116 HG22 THR 17 HG22 THR 17 7.510 15.716 -17.256 117 HG23 THR 17 HG23 THR 17 9.126 15.033 -17.499 118 H LEU 18 H LEU 18 7.583 13.825 -14.906 119 HA LEU 18 HA LEU 18 10.010 12.082 -15.191 120 HB2 LEU 18 HB2 LEU 18 7.218 11.537 -14.070 121 HB3 LEU 18 HB3 LEU 18 8.380 10.296 -14.468 122 HG LEU 18 HG LEU 18 8.199 12.033 -12.095 123 HD11 LEU 18 HD11 LEU 18 7.929 9.653 -11.939 124 HD12 LEU 18 HD12 LEU 18 9.461 10.021 -11.145 125 HD13 LEU 18 HD13 LEU 18 9.453 9.332 -12.779 126 HD21 LEU 18 HD21 LEU 18 10.616 12.091 -11.595 127 HD22 LEU 18 HD22 LEU 18 10.194 13.083 -12.998 128 HD23 LEU 18 HD23 LEU 18 10.918 11.484 -13.254 129 H PHE 19 H PHE 19 10.035 10.473 -16.779 130 HA PHE 19 HA PHE 19 7.746 9.942 -18.466 131 HB2 PHE 19 HB2 PHE 19 8.703 10.851 -20.547 132 HB3 PHE 19 HB3 PHE 19 8.291 12.095 -19.417 133 HD1 PHE 19 HD1 PHE 19 10.911 10.771 -21.487 134 HD2 PHE 19 HD2 PHE 19 10.140 13.185 -18.010 135 HE1 PHE 19 HE1 PHE 19 13.155 11.804 -21.686 136 HE2 PHE 19 HE2 PHE 19 12.343 14.211 -18.216 137 HZ PHE 19 HZ PHE 19 13.895 13.527 -20.028 138 H VAL 20 H VAL 20 8.605 8.521 -20.407 139 HA VAL 20 HA VAL 20 10.993 6.944 -19.583 140 HB VAL 20 HB VAL 20 8.364 5.694 -20.500 141 HG11 VAL 20 HG11 VAL 20 10.893 4.357 -19.506 142 HG12 VAL 20 HG12 VAL 20 9.395 3.574 -20.079 143 HG13 VAL 20 HG13 VAL 20 10.392 4.460 -21.216 144 HG21 VAL 20 HG21 VAL 20 8.362 6.577 -18.095 145 HG22 VAL 20 HG22 VAL 20 8.045 4.863 -18.314 146 HG23 VAL 20 HG23 VAL 20 9.651 5.423 -17.756 147 H VAL 21 H VAL 21 12.370 6.574 -21.216 148 HA VAL 21 HA VAL 21 11.453 6.850 -24.025 149 HB VAL 21 HB VAL 21 14.104 7.865 -22.900 150 HG11 VAL 21 HG11 VAL 21 14.107 7.187 -25.310 151 HG12 VAL 21 HG12 VAL 21 12.771 8.317 -25.611 152 HG13 VAL 21 HG13 VAL 21 14.359 8.920 -25.104 153 HG21 VAL 21 HG21 VAL 21 11.611 9.446 -23.560 154 HG22 VAL 21 HG22 VAL 21 12.489 9.343 -22.010 155 HG23 VAL 21 HG23 VAL 21 13.231 10.159 -23.392 156 H ASN 22 H ASN 22 12.060 5.016 -25.143 157 HA ASN 22 HA ASN 22 12.763 2.866 -25.465 158 HB2 ASN 22 HB2 ASN 22 15.374 3.959 -24.350 159 HB3 ASN 22 HB3 ASN 22 15.185 2.517 -25.353 160 HD21 ASN 22 HD21 ASN 22 16.213 5.693 -25.519 161 HD22 ASN 22 HD22 ASN 22 15.908 5.955 -27.200 162 H ASN 23 H ASN 23 11.253 2.909 -23.186 163 HA ASN 23 HA ASN 23 10.714 1.949 -21.322 164 HB2 ASN 23 HB2 ASN 23 11.152 -0.049 -22.656 165 HB3 ASN 23 HB3 ASN 23 12.813 -0.122 -22.024 166 HD21 ASN 23 HD21 ASN 23 9.427 0.232 -20.746 167 HD22 ASN 23 HD22 ASN 23 9.645 -0.928 -19.490 168 H ARG 24 H ARG 24 13.461 3.689 -21.306 169 HA ARG 24 HA ARG 24 14.121 2.995 -18.494 170 HB2 ARG 24 HB2 ARG 24 15.790 4.227 -20.696 171 HB3 ARG 24 HB3 ARG 24 16.224 4.313 -18.971 172 HG2 ARG 24 HG2 ARG 24 15.960 1.822 -18.805 173 HG3 ARG 24 HG3 ARG 24 15.696 1.746 -20.548 174 HD2 ARG 24 HD2 ARG 24 17.940 2.546 -20.977 175 HD3 ARG 24 HD3 ARG 24 18.200 2.876 -19.258 176 HE ARG 24 HE ARG 24 18.054 0.522 -18.765 177 HH11 ARG 24 HH11 ARG 24 18.372 1.140 -22.250 178 HH12 ARG 24 HH12 ARG 24 19.025 -0.395 -22.612 179 HH21 ARG 24 HH21 ARG 24 18.714 -1.579 -19.257 180 HH22 ARG 24 HH22 ARG 24 19.226 -1.990 -20.849 181 H LEU 25 H LEU 25 13.556 4.205 -16.997 182 HA LEU 25 HA LEU 25 11.800 6.436 -17.314 183 HB2 LEU 25 HB2 LEU 25 12.056 4.617 -15.456 184 HB3 LEU 25 HB3 LEU 25 13.327 5.611 -14.803 185 HG LEU 25 HG LEU 25 10.419 6.440 -15.226 186 HD11 LEU 25 HD11 LEU 25 11.999 5.862 -12.682 187 HD12 LEU 25 HD12 LEU 25 10.782 4.787 -13.422 188 HD13 LEU 25 HD13 LEU 25 10.306 6.358 -12.831 189 HD21 LEU 25 HD21 LEU 25 11.154 8.326 -13.607 190 HD22 LEU 25 HD22 LEU 25 11.572 8.492 -15.308 191 HD23 LEU 25 HD23 LEU 25 12.807 7.966 -14.121 192 H GLN 26 H GLN 26 12.385 8.554 -17.654 193 HA GLN 26 HA GLN 26 15.090 9.495 -16.835 194 HB2 GLN 26 HB2 GLN 26 13.519 10.179 -19.336 195 HB3 GLN 26 HB3 GLN 26 15.066 10.889 -18.886 196 HG2 GLN 26 HG2 GLN 26 15.171 7.922 -19.074 197 HG3 GLN 26 HG3 GLN 26 14.597 8.671 -20.546 198 HE21 GLN 26 HE21 GLN 26 17.361 7.587 -19.026 199 HE22 GLN 26 HE22 GLN 26 18.483 8.427 -20.065 200 H TYR 27 H TYR 27 15.017 11.983 -16.533 201 HA TYR 27 HA TYR 27 12.366 13.052 -16.027 202 HB2 TYR 27 HB2 TYR 27 12.718 13.590 -13.719 203 HB3 TYR 27 HB3 TYR 27 12.800 11.860 -13.981 204 HD1 TYR 27 HD1 TYR 27 14.868 10.607 -13.680 205 HD2 TYR 27 HD2 TYR 27 14.674 14.848 -12.946 206 HE1 TYR 27 HE1 TYR 27 16.975 10.473 -12.343 207 HE2 TYR 27 HE2 TYR 27 16.710 14.722 -11.570 208 HH TYR 27 HH TYR 27 18.522 11.629 -11.096 209 H GLU 28 H GLU 28 12.381 15.321 -15.792 210 HA GLU 28 HA GLU 28 14.925 16.672 -16.524 211 HB2 GLU 28 HB2 GLU 28 13.372 16.092 -18.435 212 HB3 GLU 28 HB3 GLU 28 12.108 17.014 -17.628 213 HG2 GLU 28 HG2 GLU 28 12.837 18.603 -18.971 214 HG3 GLU 28 HG3 GLU 28 14.004 18.902 -17.680 215 H THR 29 H THR 29 15.285 18.472 -15.252 216 HA THR 29 HA THR 29 13.138 20.053 -14.127 217 HB THR 29 HB THR 29 13.317 18.208 -12.525 218 HG1 THR 29 HG1 THR 29 13.434 19.468 -10.767 219 HG21 THR 29 HG21 THR 29 15.737 17.640 -12.901 220 HG22 THR 29 HG22 THR 29 15.221 17.692 -11.240 221 HG23 THR 29 HG23 THR 29 16.162 19.049 -11.916 222 H SER 30 H SER 30 14.434 21.784 -12.660 223 HA SER 30 HA SER 30 17.102 22.412 -13.620 224 HB2 SER 30 HB2 SER 30 15.677 23.220 -15.499 225 HB3 SER 30 HB3 SER 30 14.804 24.266 -14.374 226 HG SER 30 HG SER 30 16.402 25.597 -14.338 227 H ARG 31 H ARG 31 17.249 21.992 -11.269 228 HA ARG 31 HA ARG 31 17.142 24.418 -9.798 229 HB2 ARG 31 HB2 ARG 31 15.729 23.680 -7.920 230 HB3 ARG 31 HB3 ARG 31 14.799 23.953 -9.383 231 HG2 ARG 31 HG2 ARG 31 14.197 21.746 -9.598 232 HG3 ARG 31 HG3 ARG 31 15.721 21.141 -8.953 233 HD2 ARG 31 HD2 ARG 31 14.117 20.566 -7.410 234 HD3 ARG 31 HD3 ARG 31 15.038 21.876 -6.653 235 HE ARG 31 HE ARG 31 12.394 22.306 -8.014 236 HH11 ARG 31 HH11 ARG 31 14.157 22.438 -4.891 237 HH12 ARG 31 HH12 ARG 31 12.738 22.711 -3.985 238 HH21 ARG 31 HH21 ARG 31 10.744 23.295 -6.909 239 HH22 ARG 31 HH22 ARG 31 10.711 23.294 -5.182 240 H ASP 32 H ASP 32 18.161 24.189 -7.699 241 HA ASP 32 HA ASP 32 20.195 22.027 -7.689 242 HB2 ASP 32 HB2 ASP 32 20.735 24.517 -7.641 243 HB3 ASP 32 HB3 ASP 32 19.986 24.584 -6.036 244 H SER 33 H SER 33 20.900 21.345 -5.371 245 HA SER 33 HA SER 33 20.451 19.980 -3.659 246 HB2 SER 33 HB2 SER 33 20.506 22.412 -2.913 247 HB3 SER 33 HB3 SER 33 18.741 22.335 -2.794 248 HG SER 33 HG SER 33 18.922 20.856 -1.198 249 H ILE 34 H ILE 34 19.012 18.774 -5.470 250 HA ILE 34 HA ILE 34 16.202 18.745 -5.043 251 HB ILE 34 HB ILE 34 18.201 17.302 -6.656 252 HG12 ILE 34 HG12 ILE 34 15.283 17.943 -7.213 253 HG13 ILE 34 HG13 ILE 34 16.595 19.125 -7.317 254 HG21 ILE 34 HG21 ILE 34 15.697 15.668 -6.024 255 HG22 ILE 34 HG22 ILE 34 16.922 15.328 -7.263 256 HG23 ILE 34 HG23 ILE 34 17.360 15.263 -5.561 257 HD11 ILE 34 HD11 ILE 34 16.179 16.668 -9.039 258 HD12 ILE 34 HD12 ILE 34 16.267 18.392 -9.491 259 HD13 ILE 34 HD13 ILE 34 17.734 17.549 -8.977 260 HA PRO 35 HA PRO 35 15.748 16.376 -1.396 261 HB2 PRO 35 HB2 PRO 35 13.382 15.004 -1.971 262 HB3 PRO 35 HB3 PRO 35 13.517 16.685 -1.378 263 HG2 PRO 35 HG2 PRO 35 12.935 15.693 -4.170 264 HG3 PRO 35 HG3 PRO 35 12.374 17.181 -3.405 265 HD2 PRO 35 HD2 PRO 35 14.453 17.152 -5.163 266 HD3 PRO 35 HD3 PRO 35 14.299 18.312 -3.817 267 H THR 36 H THR 36 17.357 14.856 -1.246 268 HA THR 36 HA THR 36 17.882 12.747 -3.045 269 HB THR 36 HB THR 36 18.652 13.227 -0.134 270 HG1 THR 36 HG1 THR 36 19.734 14.701 -1.228 271 HG21 THR 36 HG21 THR 36 18.984 10.827 -0.609 272 HG22 THR 36 HG22 THR 36 20.527 11.686 -0.513 273 HG23 THR 36 HG23 THR 36 19.866 11.248 -2.104 274 H GLU 37 H GLU 37 15.539 12.967 -0.456 275 HA GLU 37 HA GLU 37 14.972 10.187 -0.132 276 HB2 GLU 37 HB2 GLU 37 12.865 11.054 0.913 277 HB3 GLU 37 HB3 GLU 37 14.330 11.808 1.526 278 HG2 GLU 37 HG2 GLU 37 13.786 13.713 -0.217 279 HG3 GLU 37 HG3 GLU 37 12.165 13.030 -0.202 280 H LEU 38 H LEU 38 13.204 12.706 -1.965 281 HA LEU 38 HA LEU 38 11.462 11.030 -3.374 282 HB2 LEU 38 HB2 LEU 38 11.897 13.750 -3.068 283 HB3 LEU 38 HB3 LEU 38 12.287 13.520 -4.769 284 HG LEU 38 HG LEU 38 9.707 12.592 -3.422 285 HD11 LEU 38 HD11 LEU 38 9.921 15.056 -3.290 286 HD12 LEU 38 HD12 LEU 38 8.658 14.589 -4.424 287 HD13 LEU 38 HD13 LEU 38 10.234 15.137 -5.046 288 HD21 LEU 38 HD21 LEU 38 8.855 12.418 -5.706 289 HD22 LEU 38 HD22 LEU 38 10.314 11.448 -5.572 290 HD23 LEU 38 HD23 LEU 38 10.371 13.052 -6.349 291 H LEU 39 H LEU 39 14.666 12.296 -4.265 292 HA LEU 39 HA LEU 39 14.963 11.339 -6.875 293 HB2 LEU 39 HB2 LEU 39 16.433 12.902 -5.691 294 HB3 LEU 39 HB3 LEU 39 16.962 11.642 -4.604 295 HG LEU 39 HG LEU 39 18.608 12.349 -6.276 296 HD11 LEU 39 HD11 LEU 39 19.537 10.236 -6.773 297 HD12 LEU 39 HD12 LEU 39 17.970 9.419 -6.682 298 HD13 LEU 39 HD13 LEU 39 18.725 10.093 -5.208 299 HD21 LEU 39 HD21 LEU 39 18.469 11.672 -8.580 300 HD22 LEU 39 HD22 LEU 39 17.111 12.721 -8.174 301 HD23 LEU 39 HD23 LEU 39 16.859 10.962 -8.335 302 H ASN 40 H ASN 40 15.725 9.756 -3.791 303 HA ASN 40 HA ASN 40 16.465 7.228 -5.044 304 HB2 ASN 40 HB2 ASN 40 16.208 8.036 -2.151 305 HB3 ASN 40 HB3 ASN 40 16.448 6.359 -2.640 306 HD21 ASN 40 HD21 ASN 40 18.021 9.432 -2.326 307 HD22 ASN 40 HD22 ASN 40 19.605 8.922 -2.916 308 H LYS 41 H LYS 41 13.411 8.563 -3.929 309 HA LYS 41 HA LYS 41 12.035 6.033 -3.589 310 HB2 LYS 41 HB2 LYS 41 11.201 8.113 -2.645 311 HB3 LYS 41 HB3 LYS 41 10.968 8.806 -4.251 312 HG2 LYS 41 HG2 LYS 41 9.153 7.403 -4.773 313 HG3 LYS 41 HG3 LYS 41 9.612 6.196 -3.565 314 HD2 LYS 41 HD2 LYS 41 7.670 7.351 -2.764 315 HD3 LYS 41 HD3 LYS 41 9.068 7.763 -1.751 316 HE2 LYS 41 HE2 LYS 41 9.267 9.875 -3.283 317 HE3 LYS 41 HE3 LYS 41 7.633 9.437 -3.824 318 HZ1 LYS 41 HZ1 LYS 41 6.864 9.692 -1.583 319 HZ2 LYS 41 HZ2 LYS 41 7.569 11.044 -2.081 320 HZ3 LYS 41 HZ3 LYS 41 8.375 10.067 -1.006 321 H TRP 42 H TRP 42 12.402 8.305 -6.324 322 HA TRP 42 HA TRP 42 10.880 7.048 -8.197 323 HB2 TRP 42 HB2 TRP 42 13.578 8.289 -8.715 324 HB3 TRP 42 HB3 TRP 42 12.268 7.975 -9.924 325 HD1 TRP 42 HD1 TRP 42 9.912 9.188 -8.073 326 HE1 TRP 42 HE1 TRP 42 9.631 11.690 -8.211 327 HE3 TRP 42 HE3 TRP 42 14.651 10.397 -9.499 328 HZ2 TRP 42 HZ2 TRP 42 11.415 14.026 -8.417 329 HZ3 TRP 42 HZ3 TRP 42 15.342 12.784 -9.669 330 HH2 TRP 42 HH2 TRP 42 13.809 14.572 -9.014 331 H LYS 43 H LYS 43 14.336 6.407 -7.705 332 HA LYS 43 HA LYS 43 14.420 4.288 -9.631 333 HB2 LYS 43 HB2 LYS 43 16.644 3.821 -8.710 334 HB3 LYS 43 HB3 LYS 43 16.413 5.549 -9.009 335 HG2 LYS 43 HG2 LYS 43 15.914 5.906 -6.620 336 HG3 LYS 43 HG3 LYS 43 16.125 4.175 -6.283 337 HD2 LYS 43 HD2 LYS 43 18.109 5.174 -5.609 338 HD3 LYS 43 HD3 LYS 43 18.476 4.407 -7.164 339 HE2 LYS 43 HE2 LYS 43 18.233 6.545 -8.322 340 HE3 LYS 43 HE3 LYS 43 17.698 7.343 -6.834 341 HZ1 LYS 43 HZ1 LYS 43 19.846 7.112 -5.904 342 HZ2 LYS 43 HZ2 LYS 43 20.081 7.654 -7.430 343 HZ3 LYS 43 HZ3 LYS 43 20.343 6.070 -7.078 344 H GLN 44 H GLN 44 13.569 4.366 -6.214 345 HA GLN 44 HA GLN 44 13.952 1.600 -5.638 346 HB2 GLN 44 HB2 GLN 44 13.422 3.469 -3.982 347 HB3 GLN 44 HB3 GLN 44 11.759 3.403 -4.527 348 HG2 GLN 44 HG2 GLN 44 11.496 2.036 -2.806 349 HG3 GLN 44 HG3 GLN 44 12.008 0.797 -3.945 350 HE21 GLN 44 HE21 GLN 44 12.341 0.819 -1.004 351 HE22 GLN 44 HE22 GLN 44 14.063 0.709 -0.701 352 H HIS 45 H HIS 45 11.052 3.412 -6.698 353 HA HIS 45 HA HIS 45 9.792 0.850 -7.565 354 HB2 HIS 45 HB2 HIS 45 8.299 3.419 -7.052 355 HB3 HIS 45 HB3 HIS 45 7.706 1.792 -7.161 356 HD1 HIS 45 HD1 HIS 45 7.889 0.314 -5.030 357 HD2 HIS 45 HD2 HIS 45 9.342 4.234 -4.724 358 HE1 HIS 45 HE1 HIS 45 8.205 0.775 -2.505 359 H LYS 46 H LYS 46 11.754 1.741 -9.155 360 HA LYS 46 HA LYS 46 11.041 3.639 -11.193 361 HB2 LYS 46 HB2 LYS 46 13.363 2.690 -10.676 362 HB3 LYS 46 HB3 LYS 46 12.849 1.214 -11.495 363 HG2 LYS 46 HG2 LYS 46 12.218 3.052 -13.417 364 HG3 LYS 46 HG3 LYS 46 13.502 3.950 -12.602 365 HD2 LYS 46 HD2 LYS 46 13.688 1.099 -13.624 366 HD3 LYS 46 HD3 LYS 46 14.249 2.508 -14.540 367 HE2 LYS 46 HE2 LYS 46 16.041 2.918 -13.138 368 HE3 LYS 46 HE3 LYS 46 15.299 2.118 -11.747 369 HZ1 LYS 46 HZ1 LYS 46 17.134 0.882 -12.783 370 HZ2 LYS 46 HZ2 LYS 46 16.119 0.569 -14.103 371 HZ3 LYS 46 HZ3 LYS 46 15.744 0.062 -12.578 372 H GLN 47 H GLN 47 10.657 0.012 -11.079 373 HA GLN 47 HA GLN 47 9.600 -0.128 -13.712 374 HB2 GLN 47 HB2 GLN 47 10.244 -1.974 -11.694 375 HB3 GLN 47 HB3 GLN 47 8.499 -2.140 -11.847 376 HG2 GLN 47 HG2 GLN 47 10.552 -2.354 -14.088 377 HG3 GLN 47 HG3 GLN 47 9.704 -3.694 -13.315 378 HE21 GLN 47 HE21 GLN 47 9.484 -1.206 -15.780 379 HE22 GLN 47 HE22 GLN 47 7.858 -1.598 -16.281 380 H GLU 48 H GLU 48 8.125 0.290 -10.577 381 HA GLU 48 HA GLU 48 5.405 0.198 -11.368 382 HB2 GLU 48 HB2 GLU 48 6.392 1.884 -9.049 383 HB3 GLU 48 HB3 GLU 48 4.843 1.076 -9.246 384 HG2 GLU 48 HG2 GLU 48 6.214 -1.143 -9.279 385 HG3 GLU 48 HG3 GLU 48 7.563 -0.175 -8.693 386 H LEU 49 H LEU 49 7.637 2.991 -11.102 387 HA LEU 49 HA LEU 49 5.752 4.980 -11.996 388 HB2 LEU 49 HB2 LEU 49 8.762 4.753 -12.047 389 HB3 LEU 49 HB3 LEU 49 7.947 6.143 -12.743 390 HG LEU 49 HG LEU 49 7.624 5.354 -9.822 391 HD11 LEU 49 HD11 LEU 49 9.424 7.365 -11.225 392 HD12 LEU 49 HD12 LEU 49 9.940 5.804 -10.528 393 HD13 LEU 49 HD13 LEU 49 9.295 7.136 -9.488 394 HD21 LEU 49 HD21 LEU 49 6.794 7.750 -11.507 395 HD22 LEU 49 HD22 LEU 49 7.137 7.929 -9.791 396 HD23 LEU 49 HD23 LEU 49 5.831 6.852 -10.321 397 H ILE 50 H ILE 50 8.252 3.080 -13.675 398 HA ILE 50 HA ILE 50 7.894 4.228 -16.251 399 HB ILE 50 HB ILE 50 8.615 1.340 -15.564 400 HG12 ILE 50 HG12 ILE 50 10.532 3.328 -16.782 401 HG13 ILE 50 HG13 ILE 50 10.206 3.403 -15.048 402 HG21 ILE 50 HG21 ILE 50 9.497 1.158 -17.939 403 HG22 ILE 50 HG22 ILE 50 7.738 1.194 -17.790 404 HG23 ILE 50 HG23 ILE 50 8.588 2.641 -18.288 405 HD11 ILE 50 HD11 ILE 50 11.125 0.848 -16.435 406 HD12 ILE 50 HD12 ILE 50 12.207 2.008 -15.655 407 HD13 ILE 50 HD13 ILE 50 10.989 1.151 -14.691 408 H ASP 51 H ASP 51 6.296 1.334 -14.945 409 HA ASP 51 HA ASP 51 4.571 0.749 -17.058 410 HB2 ASP 51 HB2 ASP 51 5.114 -0.489 -14.907 411 HB3 ASP 51 HB3 ASP 51 4.041 0.628 -14.061 412 H PHE 52 H PHE 52 4.238 3.185 -14.481 413 HA PHE 52 HA PHE 52 1.576 3.991 -15.208 414 HB2 PHE 52 HB2 PHE 52 2.441 4.262 -12.981 415 HB3 PHE 52 HB3 PHE 52 3.689 5.375 -13.531 416 HD1 PHE 52 HD1 PHE 52 3.119 7.679 -14.314 417 HD2 PHE 52 HD2 PHE 52 0.156 5.003 -12.706 418 HE1 PHE 52 HE1 PHE 52 1.569 9.589 -13.999 419 HE2 PHE 52 HE2 PHE 52 -1.420 6.912 -12.453 420 HZ PHE 52 HZ PHE 52 -0.663 9.224 -13.033 421 H LEU 53 H LEU 53 4.792 5.608 -15.719 422 HA LEU 53 HA LEU 53 3.765 7.791 -17.249 423 HB2 LEU 53 HB2 LEU 53 6.477 6.454 -16.976 424 HB3 LEU 53 HB3 LEU 53 6.223 7.708 -18.187 425 HG LEU 53 HG LEU 53 7.253 8.765 -16.493 426 HD11 LEU 53 HD11 LEU 53 4.341 9.454 -15.936 427 HD12 LEU 53 HD12 LEU 53 5.287 10.030 -17.332 428 HD13 LEU 53 HD13 LEU 53 5.749 10.491 -15.695 429 HD21 LEU 53 HD21 LEU 53 6.585 8.794 -14.099 430 HD22 LEU 53 HD22 LEU 53 7.102 7.202 -14.687 431 HD23 LEU 53 HD23 LEU 53 5.375 7.548 -14.450 432 H ASN 54 H ASN 54 4.502 4.465 -18.139 433 HA ASN 54 HA ASN 54 4.607 5.072 -21.004 434 HB2 ASN 54 HB2 ASN 54 5.534 2.976 -19.538 435 HB3 ASN 54 HB3 ASN 54 4.044 2.268 -20.083 436 HD21 ASN 54 HD21 ASN 54 7.235 2.719 -20.777 437 HD22 ASN 54 HD22 ASN 54 7.222 2.661 -22.539 438 H GLN 55 H GLN 55 2.186 3.503 -18.769 439 HA GLN 55 HA GLN 55 0.174 3.502 -20.789 440 HB2 GLN 55 HB2 GLN 55 -1.342 2.704 -19.124 441 HB3 GLN 55 HB3 GLN 55 0.239 1.932 -18.930 442 HG2 GLN 55 HG2 GLN 55 -0.397 2.311 -16.758 443 HG3 GLN 55 HG3 GLN 55 0.694 3.636 -17.105 444 HE21 GLN 55 HE21 GLN 55 -0.023 5.778 -16.910 445 HE22 GLN 55 HE22 GLN 55 -1.692 6.176 -16.493 446 H LEU 56 H LEU 56 1.426 6.143 -19.101 447 HA LEU 56 HA LEU 56 -0.977 7.746 -18.805 448 HB2 LEU 56 HB2 LEU 56 1.027 8.061 -17.393 449 HB3 LEU 56 HB3 LEU 56 1.999 8.379 -18.830 450 HG LEU 56 HG LEU 56 0.700 10.476 -19.228 451 HD11 LEU 56 HD11 LEU 56 -0.684 11.362 -17.392 452 HD12 LEU 56 HD12 LEU 56 -0.484 9.839 -16.479 453 HD13 LEU 56 HD13 LEU 56 -1.379 9.864 -18.016 454 HD21 LEU 56 HD21 LEU 56 2.030 10.209 -16.506 455 HD22 LEU 56 HD22 LEU 56 1.772 11.722 -17.417 456 HD23 LEU 56 HD23 LEU 56 2.845 10.479 -18.070 457 H ASP 57 H ASP 57 1.324 7.056 -21.363 458 HA ASP 57 HA ASP 57 0.061 9.141 -23.104 459 HB2 ASP 57 HB2 ASP 57 2.395 9.601 -22.429 460 HB3 ASP 57 HB3 ASP 57 2.925 8.113 -23.186 461 H SER 58 H SER 58 2.026 6.081 -23.415 462 HA SER 58 HA SER 58 1.008 5.565 -26.011 463 HB2 SER 58 HB2 SER 58 2.099 3.591 -23.950 464 HB3 SER 58 HB3 SER 58 1.918 3.326 -25.690 465 HG SER 58 HG SER 58 3.985 3.825 -25.268 466 H GLU 59 H GLU 59 0.011 4.582 -22.809 467 HA GLU 59 HA GLU 59 -1.609 3.222 -21.958 468 HB2 GLU 59 HB2 GLU 59 -3.792 4.011 -22.185 469 HB3 GLU 59 HB3 GLU 59 -2.648 5.348 -22.159 470 HG2 GLU 59 HG2 GLU 59 -2.964 5.839 -24.472 471 HG3 GLU 59 HG3 GLU 59 -3.888 4.349 -24.705 472 H GLU 60 H GLU 60 -0.402 2.114 -24.482 473 HA GLU 60 HA GLU 60 -2.354 -0.039 -25.108 474 HB2 GLU 60 HB2 GLU 60 -0.060 1.235 -26.640 475 HB3 GLU 60 HB3 GLU 60 -0.746 -0.316 -27.117 476 HG2 GLU 60 HG2 GLU 60 -2.919 0.650 -27.534 477 HG3 GLU 60 HG3 GLU 60 -2.396 2.226 -26.925 478 H GLN 61 H GLN 61 -0.156 0.398 -22.867 479 HA GLN 61 HA GLN 61 1.356 -2.170 -23.224 480 HB2 GLN 61 HB2 GLN 61 1.916 0.427 -21.736 481 HB3 GLN 61 HB3 GLN 61 2.622 -1.085 -21.184 482 HG2 GLN 61 HG2 GLN 61 3.005 -0.193 -24.045 483 HG3 GLN 61 HG3 GLN 61 4.011 0.424 -22.738 484 HE21 GLN 61 HE21 GLN 61 5.210 -1.243 -21.327 485 HE22 GLN 61 HE22 GLN 61 5.828 -2.627 -22.230 486 H THR 62 H THR 62 1.274 -3.656 -21.408 487 HA THR 62 HA THR 62 -0.305 -3.018 -19.089 488 HB THR 62 HB THR 62 -2.055 -3.534 -20.737 489 HG1 THR 62 HG1 THR 62 -2.165 -4.264 -18.502 490 HG21 THR 62 HG21 THR 62 -0.745 -6.273 -21.032 491 HG22 THR 62 HG22 THR 62 -0.813 -5.014 -22.271 492 HG23 THR 62 HG23 THR 62 -2.313 -5.770 -21.715 493 H LYS 63 H LYS 63 -0.403 -5.191 -17.720 494 HA LYS 63 HA LYS 63 2.314 -6.408 -17.782 495 HB2 LYS 63 HB2 LYS 63 0.344 -5.703 -15.569 496 HB3 LYS 63 HB3 LYS 63 1.608 -6.914 -15.322 497 HG2 LYS 63 HG2 LYS 63 3.333 -5.320 -15.941 498 HG3 LYS 63 HG3 LYS 63 2.134 -4.051 -16.230 499 HD2 LYS 63 HD2 LYS 63 1.539 -3.933 -13.946 500 HD3 LYS 63 HD3 LYS 63 2.400 -5.421 -13.518 501 HE2 LYS 63 HE2 LYS 63 3.650 -2.834 -14.484 502 HE3 LYS 63 HE3 LYS 63 3.549 -3.315 -12.789 503 HZ1 LYS 63 HZ1 LYS 63 5.050 -5.093 -13.225 504 HZ2 LYS 63 HZ2 LYS 63 5.700 -3.761 -13.940 505 HZ3 LYS 63 HZ3 LYS 63 4.951 -4.884 -14.859 Start of MODEL 11 1 H1 GLY 1 H GLY 1 2.736 0.106 0.789 2 HA2 GLY 1 HA2 GLY 1 2.985 -0.909 -1.463 3 HA3 GLY 1 HA3 GLY 1 1.303 -0.424 -1.748 4 H ILE 2 H ILE 2 2.252 0.845 -3.619 5 HA ILE 2 HA ILE 2 2.820 3.564 -2.798 6 HB ILE 2 HB ILE 2 5.107 2.509 -2.970 7 HG12 ILE 2 HG12 ILE 2 6.209 3.946 -4.428 8 HG13 ILE 2 HG13 ILE 2 4.732 4.306 -5.361 9 HG21 ILE 2 HG21 ILE 2 4.713 0.672 -4.512 10 HG22 ILE 2 HG22 ILE 2 4.196 1.770 -5.782 11 HG23 ILE 2 HG23 ILE 2 5.869 1.778 -5.284 12 HD11 ILE 2 HD11 ILE 2 3.807 5.492 -3.364 13 HD12 ILE 2 HD12 ILE 2 5.299 5.099 -2.468 14 HD13 ILE 2 HD13 ILE 2 5.335 6.173 -3.879 15 H ASP 3 H ASP 3 2.539 5.032 -4.695 16 HA ASP 3 HA ASP 3 0.841 3.840 -6.803 17 HB2 ASP 3 HB2 ASP 3 0.378 6.495 -5.455 18 HB3 ASP 3 HB3 ASP 3 -0.590 5.701 -6.655 19 H ALA 4 H ALA 4 1.850 4.322 -8.651 20 HA ALA 4 HA ALA 4 4.240 5.929 -8.728 21 HB1 ALA 4 HB1 ALA 4 4.011 4.214 -10.364 22 HB2 ALA 4 HB2 ALA 4 2.431 4.851 -10.893 23 HB3 ALA 4 HB3 ALA 4 3.923 5.753 -11.233 24 H ALA 5 H ALA 5 0.856 6.611 -9.562 25 HA ALA 5 HA ALA 5 1.166 9.156 -10.706 26 HB1 ALA 5 HB1 ALA 5 -1.122 8.160 -8.930 27 HB2 ALA 5 HB2 ALA 5 -1.205 9.475 -10.110 28 HB3 ALA 5 HB3 ALA 5 -0.961 7.840 -10.677 29 H GLN 6 H GLN 6 0.883 8.248 -7.270 30 HA GLN 6 HA GLN 6 0.755 10.901 -6.236 31 HB2 GLN 6 HB2 GLN 6 1.629 8.211 -5.130 32 HB3 GLN 6 HB3 GLN 6 1.835 9.610 -4.151 33 HG2 GLN 6 HG2 GLN 6 -0.851 8.836 -5.368 34 HG3 GLN 6 HG3 GLN 6 -0.299 8.266 -3.800 35 HE21 GLN 6 HE21 GLN 6 0.925 11.309 -3.483 36 HE22 GLN 6 HE22 GLN 6 -0.537 12.088 -2.942 37 H ILE 7 H ILE 7 3.540 8.720 -6.983 38 HA ILE 7 HA ILE 7 5.532 10.442 -5.957 39 HB ILE 7 HB ILE 7 5.706 8.331 -8.122 40 HG12 ILE 7 HG12 ILE 7 6.396 8.027 -5.196 41 HG13 ILE 7 HG13 ILE 7 4.872 7.496 -5.870 42 HG21 ILE 7 HG21 ILE 7 8.166 8.305 -7.304 43 HG22 ILE 7 HG22 ILE 7 7.662 9.693 -8.251 44 HG23 ILE 7 HG23 ILE 7 7.778 9.839 -6.478 45 HD11 ILE 7 HD11 ILE 7 5.844 5.755 -7.126 46 HD12 ILE 7 HD12 ILE 7 7.488 6.394 -6.997 47 HD13 ILE 7 HD13 ILE 7 6.737 5.735 -5.592 48 H VAL 8 H VAL 8 4.029 10.204 -9.202 49 HA VAL 8 HA VAL 8 5.924 11.989 -10.463 50 HB VAL 8 HB VAL 8 3.105 11.114 -11.234 51 HG11 VAL 8 HG11 VAL 8 3.589 11.896 -13.503 52 HG12 VAL 8 HG12 VAL 8 3.680 13.265 -12.396 53 HG13 VAL 8 HG13 VAL 8 5.168 12.521 -12.997 54 HG21 VAL 8 HG21 VAL 8 4.672 9.259 -11.230 55 HG22 VAL 8 HG22 VAL 8 4.358 9.723 -12.900 56 HG23 VAL 8 HG23 VAL 8 5.872 10.216 -12.121 57 H ASP 9 H ASP 9 2.709 12.404 -8.915 58 HA ASP 9 HA ASP 9 2.365 15.125 -9.562 59 HB2 ASP 9 HB2 ASP 9 0.842 13.206 -8.398 60 HB3 ASP 9 HB3 ASP 9 1.257 14.115 -6.968 61 H GLU 10 H GLU 10 3.864 13.639 -6.657 62 HA GLU 10 HA GLU 10 4.347 16.201 -5.418 63 HB2 GLU 10 HB2 GLU 10 5.868 14.971 -3.907 64 HB3 GLU 10 HB3 GLU 10 4.271 14.205 -4.041 65 HG2 GLU 10 HG2 GLU 10 5.294 12.617 -5.661 66 HG3 GLU 10 HG3 GLU 10 6.870 13.335 -5.365 67 H ALA 11 H ALA 11 6.277 14.154 -7.642 68 HA ALA 11 HA ALA 11 8.672 15.697 -7.297 69 HB1 ALA 11 HB1 ALA 11 9.327 14.596 -9.484 70 HB2 ALA 11 HB2 ALA 11 8.599 13.427 -8.372 71 HB3 ALA 11 HB3 ALA 11 7.656 14.088 -9.718 72 H LEU 12 H LEU 12 5.804 16.087 -9.317 73 HA LEU 12 HA LEU 12 6.802 18.198 -10.966 74 HB2 LEU 12 HB2 LEU 12 3.983 17.428 -10.115 75 HB3 LEU 12 HB3 LEU 12 4.282 18.769 -11.203 76 HG LEU 12 HG LEU 12 5.195 15.944 -11.811 77 HD11 LEU 12 HD11 LEU 12 2.780 17.472 -12.838 78 HD12 LEU 12 HD12 LEU 12 2.746 16.066 -11.751 79 HD13 LEU 12 HD13 LEU 12 3.331 15.879 -13.412 80 HD21 LEU 12 HD21 LEU 12 6.549 17.657 -12.937 81 HD22 LEU 12 HD22 LEU 12 5.060 18.421 -13.550 82 HD23 LEU 12 HD23 LEU 12 5.527 16.785 -14.067 83 H GLU 13 H GLU 13 5.368 18.202 -7.709 84 HA GLU 13 HA GLU 13 4.869 20.999 -7.545 85 HB2 GLU 13 HB2 GLU 13 5.651 18.909 -5.496 86 HB3 GLU 13 HB3 GLU 13 5.292 20.584 -5.049 87 HG2 GLU 13 HG2 GLU 13 3.020 20.303 -6.044 88 HG3 GLU 13 HG3 GLU 13 3.418 18.613 -6.385 89 H GLN 14 H GLN 14 7.854 19.081 -7.157 90 HA GLN 14 HA GLN 14 9.393 21.427 -6.204 91 HB2 GLN 14 HB2 GLN 14 10.369 18.755 -7.297 92 HB3 GLN 14 HB3 GLN 14 11.394 20.003 -6.618 93 HG2 GLN 14 HG2 GLN 14 11.250 18.860 -4.760 94 HG3 GLN 14 HG3 GLN 14 9.699 19.691 -4.546 95 HE21 GLN 14 HE21 GLN 14 8.411 18.210 -3.575 96 HE22 GLN 14 HE22 GLN 14 7.993 16.703 -4.399 97 H GLY 15 H GLY 15 8.589 19.841 -9.207 98 HA2 GLY 15 HA2 GLY 15 8.463 21.195 -11.238 99 HA3 GLY 15 HA3 GLY 15 10.008 21.933 -10.814 100 H ILE 16 H ILE 16 9.500 18.439 -10.263 101 HA ILE 16 HA ILE 16 11.406 17.916 -12.458 102 HB ILE 16 HB ILE 16 10.649 16.125 -10.140 103 HG12 ILE 16 HG12 ILE 16 13.410 17.218 -10.081 104 HG13 ILE 16 HG13 ILE 16 12.186 18.447 -9.834 105 HG21 ILE 16 HG21 ILE 16 12.771 14.930 -10.846 106 HG22 ILE 16 HG22 ILE 16 11.472 14.876 -12.028 107 HG23 ILE 16 HG23 ILE 16 12.835 15.986 -12.261 108 HD11 ILE 16 HD11 ILE 16 12.657 15.991 -8.143 109 HD12 ILE 16 HD12 ILE 16 12.718 17.689 -7.678 110 HD13 ILE 16 HD13 ILE 16 11.164 16.907 -8.064 111 H THR 17 H THR 17 10.656 17.060 -14.216 112 HA THR 17 HA THR 17 7.931 15.887 -14.299 113 HB THR 17 HB THR 17 9.811 17.301 -16.174 114 HG1 THR 17 HG1 THR 17 8.207 18.584 -16.024 115 HG21 THR 17 HG21 THR 17 8.485 16.526 -18.146 116 HG22 THR 17 HG22 THR 17 7.814 15.216 -17.124 117 HG23 THR 17 HG23 THR 17 9.553 15.304 -17.451 118 H LEU 18 H LEU 18 7.589 13.789 -14.583 119 HA LEU 18 HA LEU 18 9.925 11.983 -15.029 120 HB2 LEU 18 HB2 LEU 18 7.160 11.520 -13.815 121 HB3 LEU 18 HB3 LEU 18 8.248 10.247 -14.222 122 HG LEU 18 HG LEU 18 8.167 11.922 -11.809 123 HD11 LEU 18 HD11 LEU 18 8.010 9.446 -11.934 124 HD12 LEU 18 HD12 LEU 18 9.313 9.988 -10.866 125 HD13 LEU 18 HD13 LEU 18 9.682 9.367 -12.500 126 HD21 LEU 18 HD21 LEU 18 10.838 11.541 -13.157 127 HD22 LEU 18 HD22 LEU 18 10.613 12.002 -11.428 128 HD23 LEU 18 HD23 LEU 18 10.072 13.086 -12.719 129 H PHE 19 H PHE 19 9.857 10.436 -16.615 130 HA PHE 19 HA PHE 19 7.583 9.966 -18.330 131 HB2 PHE 19 HB2 PHE 19 8.569 10.873 -20.396 132 HB3 PHE 19 HB3 PHE 19 8.116 12.117 -19.274 133 HD1 PHE 19 HD1 PHE 19 10.654 11.070 -21.482 134 HD2 PHE 19 HD2 PHE 19 10.108 13.064 -17.690 135 HE1 PHE 19 HE1 PHE 19 12.748 12.355 -21.825 136 HE2 PHE 19 HE2 PHE 19 12.164 14.323 -18.060 137 HZ PHE 19 HZ PHE 19 13.522 13.969 -20.107 138 H VAL 20 H VAL 20 8.488 8.557 -20.311 139 HA VAL 20 HA VAL 20 10.932 7.043 -19.480 140 HB VAL 20 HB VAL 20 8.358 5.718 -20.427 141 HG11 VAL 20 HG11 VAL 20 10.399 4.557 -21.131 142 HG12 VAL 20 HG12 VAL 20 11.015 4.583 -19.460 143 HG13 VAL 20 HG13 VAL 20 9.564 3.640 -19.879 144 HG21 VAL 20 HG21 VAL 20 9.650 5.585 -17.665 145 HG22 VAL 20 HG22 VAL 20 8.226 6.557 -18.048 146 HG23 VAL 20 HG23 VAL 20 8.137 4.811 -18.212 147 H VAL 21 H VAL 21 12.441 7.443 -21.077 148 HA VAL 21 HA VAL 21 11.551 7.727 -23.885 149 HB VAL 21 HB VAL 21 14.116 8.238 -22.324 150 HG11 VAL 21 HG11 VAL 21 13.720 8.375 -25.347 151 HG12 VAL 21 HG12 VAL 21 15.128 9.026 -24.463 152 HG13 VAL 21 HG13 VAL 21 14.835 7.296 -24.478 153 HG21 VAL 21 HG21 VAL 21 13.809 10.540 -23.038 154 HG22 VAL 21 HG22 VAL 21 12.347 10.089 -23.958 155 HG23 VAL 21 HG23 VAL 21 12.384 9.939 -22.195 156 H ASN 22 H ASN 22 11.592 5.896 -25.128 157 HA ASN 22 HA ASN 22 11.840 3.705 -25.673 158 HB2 ASN 22 HB2 ASN 22 14.762 4.503 -25.382 159 HB3 ASN 22 HB3 ASN 22 14.128 3.116 -26.272 160 HD21 ASN 22 HD21 ASN 22 15.007 6.431 -26.632 161 HD22 ASN 22 HD22 ASN 22 14.174 6.695 -28.135 162 H ASN 23 H ASN 23 10.992 3.491 -23.171 163 HA ASN 23 HA ASN 23 10.795 2.237 -21.420 164 HB2 ASN 23 HB2 ASN 23 11.027 0.492 -23.135 165 HB3 ASN 23 HB3 ASN 23 12.747 0.356 -22.740 166 HD21 ASN 23 HD21 ASN 23 9.457 0.307 -21.083 167 HD22 ASN 23 HD22 ASN 23 9.925 -1.042 -20.116 168 H ARG 24 H ARG 24 13.319 4.169 -21.587 169 HA ARG 24 HA ARG 24 14.691 3.148 -19.154 170 HB2 ARG 24 HB2 ARG 24 15.658 5.087 -21.290 171 HB3 ARG 24 HB3 ARG 24 16.531 4.587 -19.843 172 HG2 ARG 24 HG2 ARG 24 15.974 2.133 -20.874 173 HG3 ARG 24 HG3 ARG 24 16.217 3.121 -22.324 174 HD2 ARG 24 HD2 ARG 24 18.386 2.506 -21.647 175 HD3 ARG 24 HD3 ARG 24 18.271 4.129 -21.078 176 HE ARG 24 HE ARG 24 18.273 3.431 -18.893 177 HH11 ARG 24 HH11 ARG 24 18.295 0.585 -21.035 178 HH12 ARG 24 HH12 ARG 24 18.310 -0.569 -19.751 179 HH21 ARG 24 HH21 ARG 24 18.269 1.834 -17.146 180 HH22 ARG 24 HH22 ARG 24 18.244 0.139 -17.561 181 H LEU 25 H LEU 25 13.978 4.090 -17.348 182 HA LEU 25 HA LEU 25 12.201 6.323 -17.299 183 HB2 LEU 25 HB2 LEU 25 12.538 4.439 -15.584 184 HB3 LEU 25 HB3 LEU 25 13.905 5.350 -14.948 185 HG LEU 25 HG LEU 25 11.068 6.350 -15.217 186 HD11 LEU 25 HD11 LEU 25 11.166 4.551 -13.553 187 HD12 LEU 25 HD12 LEU 25 10.840 6.089 -12.778 188 HD13 LEU 25 HD13 LEU 25 12.478 5.400 -12.687 189 HD21 LEU 25 HD21 LEU 25 13.400 7.628 -13.780 190 HD22 LEU 25 HD22 LEU 25 11.695 8.049 -13.461 191 HD23 LEU 25 HD23 LEU 25 12.360 8.326 -15.050 192 H GLN 26 H GLN 26 12.694 8.541 -17.632 193 HA GLN 26 HA GLN 26 15.302 9.529 -16.633 194 HB2 GLN 26 HB2 GLN 26 14.060 10.778 -19.053 195 HB3 GLN 26 HB3 GLN 26 15.680 10.902 -18.443 196 HG2 GLN 26 HG2 GLN 26 14.535 8.376 -19.685 197 HG3 GLN 26 HG3 GLN 26 15.397 9.563 -20.562 198 HE21 GLN 26 HE21 GLN 26 15.839 6.677 -19.653 199 HE22 GLN 26 HE22 GLN 26 17.472 6.607 -18.968 200 H TYR 27 H TYR 27 15.059 12.060 -16.482 201 HA TYR 27 HA TYR 27 12.391 13.026 -15.993 202 HB2 TYR 27 HB2 TYR 27 12.869 13.805 -13.720 203 HB3 TYR 27 HB3 TYR 27 12.768 12.068 -13.856 204 HD1 TYR 27 HD1 TYR 27 14.662 10.617 -13.543 205 HD2 TYR 27 HD2 TYR 27 14.993 14.883 -12.979 206 HE1 TYR 27 HE1 TYR 27 16.660 10.274 -12.138 207 HE2 TYR 27 HE2 TYR 27 16.961 14.552 -11.530 208 HH TYR 27 HH TYR 27 18.264 11.234 -10.879 209 H GLU 28 H GLU 28 12.558 15.411 -15.458 210 HA GLU 28 HA GLU 28 15.011 16.702 -16.418 211 HB2 GLU 28 HB2 GLU 28 13.838 16.234 -18.433 212 HB3 GLU 28 HB3 GLU 28 12.285 16.773 -17.780 213 HG2 GLU 28 HG2 GLU 28 12.735 18.971 -18.063 214 HG3 GLU 28 HG3 GLU 28 14.465 18.794 -17.718 215 H THR 29 H THR 29 15.321 18.575 -15.236 216 HA THR 29 HA THR 29 13.205 20.063 -14.012 217 HB THR 29 HB THR 29 13.408 18.127 -12.508 218 HG1 THR 29 HG1 THR 29 13.838 19.187 -10.618 219 HG21 THR 29 HG21 THR 29 15.833 17.555 -13.014 220 HG22 THR 29 HG22 THR 29 15.320 17.443 -11.350 221 HG23 THR 29 HG23 THR 29 16.276 18.850 -11.891 222 H SER 30 H SER 30 14.097 22.134 -13.376 223 HA SER 30 HA SER 30 16.939 22.614 -14.165 224 HB2 SER 30 HB2 SER 30 14.556 24.514 -14.283 225 HB3 SER 30 HB3 SER 30 16.199 24.804 -14.881 226 HG SER 30 HG SER 30 15.819 22.873 -16.217 227 H ARG 31 H ARG 31 17.461 21.986 -11.850 228 HA ARG 31 HA ARG 31 17.759 24.306 -10.241 229 HB2 ARG 31 HB2 ARG 31 16.389 23.487 -8.257 230 HB3 ARG 31 HB3 ARG 31 15.488 24.077 -9.624 231 HG2 ARG 31 HG2 ARG 31 15.171 21.653 -10.375 232 HG3 ARG 31 HG3 ARG 31 15.973 21.136 -8.899 233 HD2 ARG 31 HD2 ARG 31 13.448 21.084 -8.795 234 HD3 ARG 31 HD3 ARG 31 14.188 22.109 -7.558 235 HE ARG 31 HE ARG 31 13.266 23.939 -8.415 236 HH11 ARG 31 HH11 ARG 31 13.022 21.456 -11.019 237 HH12 ARG 31 HH12 ARG 31 12.190 22.520 -12.096 238 HH21 ARG 31 HH21 ARG 31 12.280 25.307 -9.927 239 HH22 ARG 31 HH22 ARG 31 11.464 24.670 -11.322 240 H ASP 32 H ASP 32 18.369 23.512 -7.921 241 HA ASP 32 HA ASP 32 20.144 21.163 -7.966 242 HB2 ASP 32 HB2 ASP 32 21.802 22.538 -6.726 243 HB3 ASP 32 HB3 ASP 32 21.537 23.125 -8.364 244 H SER 33 H SER 33 20.935 20.947 -5.536 245 HA SER 33 HA SER 33 20.337 20.046 -3.566 246 HB2 SER 33 HB2 SER 33 18.942 22.741 -3.443 247 HB3 SER 33 HB3 SER 33 19.267 21.706 -2.034 248 HG SER 33 HG SER 33 20.877 23.421 -2.856 249 H ILE 34 H ILE 34 18.876 18.876 -5.526 250 HA ILE 34 HA ILE 34 16.083 18.855 -5.155 251 HB ILE 34 HB ILE 34 18.164 17.235 -6.520 252 HG12 ILE 34 HG12 ILE 34 15.315 17.930 -7.352 253 HG13 ILE 34 HG13 ILE 34 16.693 19.028 -7.512 254 HG21 ILE 34 HG21 ILE 34 15.583 15.810 -5.889 255 HG22 ILE 34 HG22 ILE 34 16.783 15.280 -7.077 256 HG23 ILE 34 HG23 ILE 34 17.197 15.321 -5.370 257 HD11 ILE 34 HD11 ILE 34 17.808 17.174 -8.904 258 HD12 ILE 34 HD12 ILE 34 16.199 16.407 -8.964 259 HD13 ILE 34 HD13 ILE 34 16.445 18.046 -9.612 260 HA PRO 35 HA PRO 35 15.520 16.537 -1.392 261 HB2 PRO 35 HB2 PRO 35 13.096 15.324 -1.916 262 HB3 PRO 35 HB3 PRO 35 13.283 17.047 -1.457 263 HG2 PRO 35 HG2 PRO 35 12.894 15.844 -4.197 264 HG3 PRO 35 HG3 PRO 35 12.148 17.321 -3.543 265 HD2 PRO 35 HD2 PRO 35 14.284 17.416 -5.189 266 HD3 PRO 35 HD3 PRO 35 14.098 18.567 -3.836 267 H THR 36 H THR 36 17.140 14.924 -1.357 268 HA THR 36 HA THR 36 17.475 12.853 -3.235 269 HB THR 36 HB THR 36 18.266 13.011 -0.302 270 HG1 THR 36 HG1 THR 36 19.381 13.968 -2.718 271 HG21 THR 36 HG21 THR 36 20.036 11.433 -0.776 272 HG22 THR 36 HG22 THR 36 19.542 11.314 -2.490 273 HG23 THR 36 HG23 THR 36 18.509 10.690 -1.189 274 H GLU 37 H GLU 37 15.447 12.965 -0.295 275 HA GLU 37 HA GLU 37 14.854 10.230 -0.064 276 HB2 GLU 37 HB2 GLU 37 12.789 11.042 1.097 277 HB3 GLU 37 HB3 GLU 37 14.309 11.706 1.693 278 HG2 GLU 37 HG2 GLU 37 13.885 13.815 0.358 279 HG3 GLU 37 HG3 GLU 37 12.314 13.158 -0.100 280 H LEU 38 H LEU 38 13.194 12.731 -1.932 281 HA LEU 38 HA LEU 38 11.230 11.011 -3.104 282 HB2 LEU 38 HB2 LEU 38 11.417 13.605 -2.628 283 HB3 LEU 38 HB3 LEU 38 12.078 13.676 -4.237 284 HG LEU 38 HG LEU 38 9.447 12.235 -3.715 285 HD11 LEU 38 HD11 LEU 38 9.982 15.206 -3.819 286 HD12 LEU 38 HD12 LEU 38 9.113 14.283 -2.590 287 HD13 LEU 38 HD13 LEU 38 8.384 14.520 -4.185 288 HD21 LEU 38 HD21 LEU 38 8.977 12.911 -6.007 289 HD22 LEU 38 HD22 LEU 38 10.539 12.074 -5.910 290 HD23 LEU 38 HD23 LEU 38 10.480 13.855 -6.076 291 H LEU 39 H LEU 39 14.462 12.161 -4.087 292 HA LEU 39 HA LEU 39 14.467 11.224 -6.766 293 HB2 LEU 39 HB2 LEU 39 16.194 12.669 -5.415 294 HB3 LEU 39 HB3 LEU 39 16.939 11.126 -5.010 295 HG LEU 39 HG LEU 39 16.485 12.310 -7.771 296 HD11 LEU 39 HD11 LEU 39 18.263 13.360 -6.476 297 HD12 LEU 39 HD12 LEU 39 18.905 12.486 -7.867 298 HD13 LEU 39 HD13 LEU 39 19.046 11.782 -6.234 299 HD21 LEU 39 HD21 LEU 39 17.929 10.458 -8.643 300 HD22 LEU 39 HD22 LEU 39 16.350 9.916 -8.117 301 HD23 LEU 39 HD23 LEU 39 17.768 9.636 -7.073 302 H ASN 40 H ASN 40 15.473 9.732 -3.712 303 HA ASN 40 HA ASN 40 16.179 7.152 -4.655 304 HB2 ASN 40 HB2 ASN 40 15.526 8.298 -1.966 305 HB3 ASN 40 HB3 ASN 40 15.393 6.551 -2.143 306 HD21 ASN 40 HD21 ASN 40 17.543 8.666 -0.951 307 HD22 ASN 40 HD22 ASN 40 19.026 7.871 -1.413 308 H LYS 41 H LYS 41 13.005 8.455 -3.552 309 HA LYS 41 HA LYS 41 11.599 6.009 -3.639 310 HB2 LYS 41 HB2 LYS 41 10.699 8.049 -2.643 311 HB3 LYS 41 HB3 LYS 41 10.561 8.824 -4.228 312 HG2 LYS 41 HG2 LYS 41 8.817 7.409 -4.927 313 HG3 LYS 41 HG3 LYS 41 9.194 6.192 -3.715 314 HD2 LYS 41 HD2 LYS 41 7.176 7.207 -3.082 315 HD3 LYS 41 HD3 LYS 41 8.383 7.686 -1.910 316 HE2 LYS 41 HE2 LYS 41 7.973 9.598 -4.191 317 HE3 LYS 41 HE3 LYS 41 6.556 9.324 -3.191 318 HZ1 LYS 41 HZ1 LYS 41 9.124 10.327 -2.148 319 HZ2 LYS 41 HZ2 LYS 41 7.811 9.960 -1.250 320 HZ3 LYS 41 HZ3 LYS 41 7.701 11.149 -2.351 321 H TRP 42 H TRP 42 12.454 8.224 -6.322 322 HA TRP 42 HA TRP 42 10.929 6.903 -8.306 323 HB2 TRP 42 HB2 TRP 42 13.614 8.227 -8.732 324 HB3 TRP 42 HB3 TRP 42 12.391 7.892 -9.958 325 HD1 TRP 42 HD1 TRP 42 9.955 9.122 -8.093 326 HE1 TRP 42 HE1 TRP 42 9.727 11.676 -8.017 327 HE3 TRP 42 HE3 TRP 42 14.638 10.337 -9.652 328 HZ2 TRP 42 HZ2 TRP 42 11.544 13.951 -8.176 329 HZ3 TRP 42 HZ3 TRP 42 15.376 12.710 -9.685 330 HH2 TRP 42 HH2 TRP 42 13.906 14.480 -8.885 331 H LYS 43 H LYS 43 14.429 6.409 -7.475 332 HA LYS 43 HA LYS 43 14.656 4.204 -9.328 333 HB2 LYS 43 HB2 LYS 43 16.776 3.641 -8.095 334 HB3 LYS 43 HB3 LYS 43 16.691 5.257 -8.797 335 HG2 LYS 43 HG2 LYS 43 16.209 6.250 -6.643 336 HG3 LYS 43 HG3 LYS 43 16.154 4.661 -5.855 337 HD2 LYS 43 HD2 LYS 43 18.631 5.709 -7.269 338 HD3 LYS 43 HD3 LYS 43 18.261 6.078 -5.586 339 HE2 LYS 43 HE2 LYS 43 18.050 3.611 -5.122 340 HE3 LYS 43 HE3 LYS 43 18.646 3.285 -6.753 341 HZ1 LYS 43 HZ1 LYS 43 20.173 4.909 -4.805 342 HZ2 LYS 43 HZ2 LYS 43 20.731 4.218 -6.193 343 HZ3 LYS 43 HZ3 LYS 43 20.350 3.281 -4.923 344 H GLN 44 H GLN 44 13.679 4.381 -5.930 345 HA GLN 44 HA GLN 44 13.838 1.697 -5.232 346 HB2 GLN 44 HB2 GLN 44 13.321 3.508 -3.624 347 HB3 GLN 44 HB3 GLN 44 11.785 3.791 -4.422 348 HG2 GLN 44 HG2 GLN 44 11.249 2.555 -2.500 349 HG3 GLN 44 HG3 GLN 44 11.066 1.460 -3.841 350 HE21 GLN 44 HE21 GLN 44 11.189 -0.024 -1.863 351 HE22 GLN 44 HE22 GLN 44 12.753 -0.713 -1.508 352 H HIS 45 H HIS 45 11.051 3.468 -6.673 353 HA HIS 45 HA HIS 45 9.800 0.872 -7.385 354 HB2 HIS 45 HB2 HIS 45 8.556 3.635 -7.180 355 HB3 HIS 45 HB3 HIS 45 7.725 2.095 -7.354 356 HD1 HIS 45 HD1 HIS 45 7.884 0.417 -5.190 357 HD2 HIS 45 HD2 HIS 45 9.100 4.409 -4.776 358 HE1 HIS 45 HE1 HIS 45 8.014 0.909 -2.641 359 H LYS 46 H LYS 46 11.996 2.009 -8.982 360 HA LYS 46 HA LYS 46 11.383 3.414 -11.256 361 HB2 LYS 46 HB2 LYS 46 13.613 2.342 -10.608 362 HB3 LYS 46 HB3 LYS 46 13.015 0.848 -11.313 363 HG2 LYS 46 HG2 LYS 46 12.569 2.776 -13.306 364 HG3 LYS 46 HG3 LYS 46 14.053 3.337 -12.559 365 HD2 LYS 46 HD2 LYS 46 13.548 0.579 -13.761 366 HD3 LYS 46 HD3 LYS 46 14.409 1.911 -14.519 367 HE2 LYS 46 HE2 LYS 46 16.169 0.672 -13.818 368 HE3 LYS 46 HE3 LYS 46 16.020 1.822 -12.487 369 HZ1 LYS 46 HZ1 LYS 46 16.366 -0.507 -11.817 370 HZ2 LYS 46 HZ2 LYS 46 14.885 -0.922 -12.435 371 HZ3 LYS 46 HZ3 LYS 46 15.037 0.091 -11.155 372 H GLN 47 H GLN 47 11.011 -0.172 -11.143 373 HA GLN 47 HA GLN 47 9.822 -0.351 -13.686 374 HB2 GLN 47 HB2 GLN 47 10.658 -2.102 -11.711 375 HB3 GLN 47 HB3 GLN 47 8.918 -2.325 -11.668 376 HG2 GLN 47 HG2 GLN 47 10.725 -2.541 -14.115 377 HG3 GLN 47 HG3 GLN 47 10.082 -3.895 -13.182 378 HE21 GLN 47 HE21 GLN 47 9.467 -1.917 -15.880 379 HE22 GLN 47 HE22 GLN 47 7.802 -2.345 -16.057 380 H GLU 48 H GLU 48 8.305 0.153 -10.536 381 HA GLU 48 HA GLU 48 5.620 -0.123 -11.357 382 HB2 GLU 48 HB2 GLU 48 6.435 1.572 -9.020 383 HB3 GLU 48 HB3 GLU 48 5.058 0.481 -9.198 384 HG2 GLU 48 HG2 GLU 48 6.963 -1.382 -9.338 385 HG3 GLU 48 HG3 GLU 48 7.935 -0.138 -8.560 386 H LEU 49 H LEU 49 7.815 2.652 -11.304 387 HA LEU 49 HA LEU 49 5.792 4.669 -11.943 388 HB2 LEU 49 HB2 LEU 49 8.830 4.714 -12.205 389 HB3 LEU 49 HB3 LEU 49 7.786 6.084 -12.503 390 HG LEU 49 HG LEU 49 7.411 4.701 -9.851 391 HD11 LEU 49 HD11 LEU 49 9.853 4.836 -10.239 392 HD12 LEU 49 HD12 LEU 49 9.253 5.773 -8.861 393 HD13 LEU 49 HD13 LEU 49 9.707 6.601 -10.396 394 HD21 LEU 49 HD21 LEU 49 5.985 6.631 -10.510 395 HD22 LEU 49 HD22 LEU 49 7.431 7.636 -10.707 396 HD23 LEU 49 HD23 LEU 49 7.003 6.979 -9.124 397 H ILE 50 H ILE 50 8.180 2.689 -13.687 398 HA ILE 50 HA ILE 50 7.858 3.906 -16.265 399 HB ILE 50 HB ILE 50 8.642 1.069 -15.550 400 HG12 ILE 50 HG12 ILE 50 10.431 3.226 -16.728 401 HG13 ILE 50 HG13 ILE 50 10.110 3.229 -14.999 402 HG21 ILE 50 HG21 ILE 50 9.467 0.887 -17.938 403 HG22 ILE 50 HG22 ILE 50 7.714 0.939 -17.788 404 HG23 ILE 50 HG23 ILE 50 8.575 2.384 -18.290 405 HD11 ILE 50 HD11 ILE 50 11.336 0.872 -16.477 406 HD12 ILE 50 HD12 ILE 50 12.184 2.080 -15.480 407 HD13 ILE 50 HD13 ILE 50 11.033 0.998 -14.725 408 H ASP 51 H ASP 51 6.297 1.025 -14.832 409 HA ASP 51 HA ASP 51 4.441 0.400 -16.763 410 HB2 ASP 51 HB2 ASP 51 4.858 -0.830 -14.639 411 HB3 ASP 51 HB3 ASP 51 4.046 0.449 -13.733 412 H PHE 52 H PHE 52 4.225 3.085 -14.484 413 HA PHE 52 HA PHE 52 1.481 3.760 -15.170 414 HB2 PHE 52 HB2 PHE 52 2.260 4.122 -12.937 415 HB3 PHE 52 HB3 PHE 52 3.648 5.041 -13.492 416 HD1 PHE 52 HD1 PHE 52 3.532 7.316 -12.965 417 HD2 PHE 52 HD2 PHE 52 -0.078 5.266 -14.164 418 HE1 PHE 52 HE1 PHE 52 2.235 9.449 -12.836 419 HE2 PHE 52 HE2 PHE 52 -1.319 7.388 -13.995 420 HZ PHE 52 HZ PHE 52 -0.140 9.488 -13.317 421 H LEU 53 H LEU 53 4.678 5.452 -15.667 422 HA LEU 53 HA LEU 53 3.562 7.620 -17.126 423 HB2 LEU 53 HB2 LEU 53 6.318 6.348 -16.897 424 HB3 LEU 53 HB3 LEU 53 6.042 7.552 -18.140 425 HG LEU 53 HG LEU 53 7.081 8.648 -16.406 426 HD11 LEU 53 HD11 LEU 53 4.146 9.364 -16.096 427 HD12 LEU 53 HD12 LEU 53 5.154 9.838 -17.493 428 HD13 LEU 53 HD13 LEU 53 5.535 10.435 -15.869 429 HD21 LEU 53 HD21 LEU 53 4.934 7.684 -14.499 430 HD22 LEU 53 HD22 LEU 53 6.215 8.848 -14.105 431 HD23 LEU 53 HD23 LEU 53 6.621 7.179 -14.478 432 H ASN 54 H ASN 54 4.534 4.405 -18.128 433 HA ASN 54 HA ASN 54 4.619 5.035 -20.955 434 HB2 ASN 54 HB2 ASN 54 5.467 2.907 -19.380 435 HB3 ASN 54 HB3 ASN 54 4.088 2.206 -20.152 436 HD21 ASN 54 HD21 ASN 54 7.310 3.434 -20.411 437 HD22 ASN 54 HD22 ASN 54 7.574 3.150 -22.130 438 H GLN 55 H GLN 55 2.199 3.352 -18.844 439 HA GLN 55 HA GLN 55 0.257 3.253 -20.925 440 HB2 GLN 55 HB2 GLN 55 -1.264 2.412 -19.298 441 HB3 GLN 55 HB3 GLN 55 0.341 1.744 -18.993 442 HG2 GLN 55 HG2 GLN 55 -0.409 2.200 -16.868 443 HG3 GLN 55 HG3 GLN 55 0.624 3.540 -17.232 444 HE21 GLN 55 HE21 GLN 55 -0.259 5.579 -16.712 445 HE22 GLN 55 HE22 GLN 55 -1.990 5.841 -16.474 446 H LEU 56 H LEU 56 1.162 5.913 -18.793 447 HA LEU 56 HA LEU 56 -1.334 7.307 -18.904 448 HB2 LEU 56 HB2 LEU 56 1.113 7.706 -17.635 449 HB3 LEU 56 HB3 LEU 56 1.176 8.944 -18.863 450 HG LEU 56 HG LEU 56 -0.956 8.555 -16.723 451 HD11 LEU 56 HD11 LEU 56 1.277 9.425 -15.990 452 HD12 LEU 56 HD12 LEU 56 -0.035 10.586 -15.749 453 HD13 LEU 56 HD13 LEU 56 1.063 10.789 -17.121 454 HD21 LEU 56 HD21 LEU 56 -0.760 10.681 -18.906 455 HD22 LEU 56 HD22 LEU 56 -1.766 10.856 -17.460 456 HD23 LEU 56 HD23 LEU 56 -2.104 9.556 -18.602 457 H ASP 57 H ASP 57 1.390 7.088 -21.129 458 HA ASP 57 HA ASP 57 0.260 9.251 -22.829 459 HB2 ASP 57 HB2 ASP 57 2.798 8.786 -21.949 460 HB3 ASP 57 HB3 ASP 57 2.863 7.964 -23.499 461 H SER 58 H SER 58 1.096 5.788 -22.945 462 HA SER 58 HA SER 58 0.224 5.629 -25.777 463 HB2 SER 58 HB2 SER 58 2.441 4.833 -24.940 464 HB3 SER 58 HB3 SER 58 1.613 3.631 -23.952 465 HG SER 58 HG SER 58 1.207 3.733 -26.774 466 H GLU 59 H GLU 59 -0.799 4.659 -22.557 467 HA GLU 59 HA GLU 59 -2.283 3.266 -21.715 468 HB2 GLU 59 HB2 GLU 59 -4.513 3.917 -22.064 469 HB3 GLU 59 HB3 GLU 59 -3.454 5.315 -22.038 470 HG2 GLU 59 HG2 GLU 59 -3.585 5.528 -24.482 471 HG3 GLU 59 HG3 GLU 59 -4.598 4.080 -24.563 472 H GLU 60 H GLU 60 -0.899 1.944 -23.980 473 HA GLU 60 HA GLU 60 -2.899 -0.236 -24.328 474 HB2 GLU 60 HB2 GLU 60 -2.057 -0.721 -26.474 475 HB3 GLU 60 HB3 GLU 60 -2.574 0.949 -26.426 476 HG2 GLU 60 HG2 GLU 60 -0.481 1.768 -26.848 477 HG3 GLU 60 HG3 GLU 60 0.340 0.494 -25.933 478 H GLN 61 H GLN 61 -0.089 0.478 -22.700 479 HA GLN 61 HA GLN 61 1.142 -2.200 -23.018 480 HB2 GLN 61 HB2 GLN 61 1.886 0.387 -21.632 481 HB3 GLN 61 HB3 GLN 61 2.587 -1.104 -21.027 482 HG2 GLN 61 HG2 GLN 61 2.771 -0.358 -23.968 483 HG3 GLN 61 HG3 GLN 61 3.935 0.186 -22.756 484 HE21 GLN 61 HE21 GLN 61 5.749 -0.942 -23.524 485 HE22 GLN 61 HE22 GLN 61 5.857 -2.668 -23.638 486 H THR 62 H THR 62 1.603 -3.485 -20.934 487 HA THR 62 HA THR 62 -0.071 -3.092 -18.648 488 HB THR 62 HB THR 62 -1.690 -4.013 -20.329 489 HG1 THR 62 HG1 THR 62 -2.502 -5.529 -18.937 490 HG21 THR 62 HG21 THR 62 -1.593 -6.390 -20.933 491 HG22 THR 62 HG22 THR 62 0.005 -6.548 -20.198 492 HG23 THR 62 HG23 THR 62 -0.228 -5.505 -21.621 493 H LYS 63 H LYS 63 0.238 -5.043 -17.179 494 HA LYS 63 HA LYS 63 3.099 -5.648 -16.966 495 HB2 LYS 63 HB2 LYS 63 0.678 -6.377 -15.243 496 HB3 LYS 63 HB3 LYS 63 2.345 -6.835 -14.873 497 HG2 LYS 63 HG2 LYS 63 2.990 -4.458 -14.764 498 HG3 LYS 63 HG3 LYS 63 1.336 -3.960 -15.134 499 HD2 LYS 63 HD2 LYS 63 0.517 -4.922 -13.079 500 HD3 LYS 63 HD3 LYS 63 2.085 -5.674 -12.720 501 HE2 LYS 63 HE2 LYS 63 3.140 -3.570 -12.322 502 HE3 LYS 63 HE3 LYS 63 1.807 -2.676 -13.056 503 HZ1 LYS 63 HZ1 LYS 63 0.407 -3.328 -11.195 504 HZ2 LYS 63 HZ2 LYS 63 1.732 -2.527 -10.674 505 HZ3 LYS 63 HZ3 LYS 63 1.633 -4.161 -10.495 Start of MODEL 12 1 H1 GLY 1 H GLY 1 4.166 -0.904 -0.143 2 HA2 GLY 1 HA2 GLY 1 2.690 -0.894 -2.020 3 HA3 GLY 1 HA3 GLY 1 1.439 -0.158 -0.996 4 H ILE 2 H ILE 2 2.210 0.991 -3.477 5 HA ILE 2 HA ILE 2 2.857 3.680 -2.736 6 HB ILE 2 HB ILE 2 5.192 2.628 -2.973 7 HG12 ILE 2 HG12 ILE 2 6.261 4.095 -4.332 8 HG13 ILE 2 HG13 ILE 2 4.827 4.424 -5.347 9 HG21 ILE 2 HG21 ILE 2 4.719 0.836 -4.556 10 HG22 ILE 2 HG22 ILE 2 4.240 2.003 -5.807 11 HG23 ILE 2 HG23 ILE 2 5.906 1.929 -5.268 12 HD11 ILE 2 HD11 ILE 2 3.789 5.668 -3.514 13 HD12 ILE 2 HD12 ILE 2 5.127 5.214 -2.420 14 HD13 ILE 2 HD13 ILE 2 5.409 6.279 -3.808 15 H ASP 3 H ASP 3 2.710 5.014 -4.785 16 HA ASP 3 HA ASP 3 0.968 3.749 -6.775 17 HB2 ASP 3 HB2 ASP 3 0.445 6.307 -5.284 18 HB3 ASP 3 HB3 ASP 3 -0.320 5.876 -6.761 19 H ALA 4 H ALA 4 1.865 4.199 -8.560 20 HA ALA 4 HA ALA 4 4.240 5.789 -8.832 21 HB1 ALA 4 HB1 ALA 4 3.829 5.521 -11.307 22 HB2 ALA 4 HB2 ALA 4 3.755 3.974 -10.437 23 HB3 ALA 4 HB3 ALA 4 2.264 4.789 -10.940 24 H ALA 5 H ALA 5 0.804 6.457 -9.413 25 HA ALA 5 HA ALA 5 1.062 8.996 -10.623 26 HB1 ALA 5 HB1 ALA 5 -1.053 7.637 -10.532 27 HB2 ALA 5 HB2 ALA 5 -1.179 8.002 -8.791 28 HB3 ALA 5 HB3 ALA 5 -1.291 9.311 -9.981 29 H GLN 6 H GLN 6 1.022 8.073 -7.186 30 HA GLN 6 HA GLN 6 0.744 10.723 -6.127 31 HB2 GLN 6 HB2 GLN 6 1.794 8.088 -5.027 32 HB3 GLN 6 HB3 GLN 6 1.856 9.542 -4.066 33 HG2 GLN 6 HG2 GLN 6 -0.743 8.492 -5.266 34 HG3 GLN 6 HG3 GLN 6 -0.128 8.029 -3.680 35 HE21 GLN 6 HE21 GLN 6 -1.620 10.688 -5.520 36 HE22 GLN 6 HE22 GLN 6 -1.974 11.632 -4.088 37 H ILE 7 H ILE 7 3.566 8.672 -6.980 38 HA ILE 7 HA ILE 7 5.498 10.497 -5.998 39 HB ILE 7 HB ILE 7 5.738 8.380 -8.125 40 HG12 ILE 7 HG12 ILE 7 6.438 8.059 -5.200 41 HG13 ILE 7 HG13 ILE 7 4.923 7.503 -5.884 42 HG21 ILE 7 HG21 ILE 7 7.698 10.241 -6.885 43 HG22 ILE 7 HG22 ILE 7 8.218 8.570 -6.774 44 HG23 ILE 7 HG23 ILE 7 7.822 9.221 -8.354 45 HD11 ILE 7 HD11 ILE 7 7.572 6.532 -7.043 46 HD12 ILE 7 HD12 ILE 7 6.803 5.770 -5.677 47 HD13 ILE 7 HD13 ILE 7 5.948 5.850 -7.229 48 H VAL 8 H VAL 8 3.993 10.131 -9.257 49 HA VAL 8 HA VAL 8 5.703 11.998 -10.564 50 HB VAL 8 HB VAL 8 2.878 11.058 -11.159 51 HG11 VAL 8 HG11 VAL 8 3.206 11.883 -13.465 52 HG12 VAL 8 HG12 VAL 8 3.209 13.229 -12.324 53 HG13 VAL 8 HG13 VAL 8 4.745 12.636 -12.997 54 HG21 VAL 8 HG21 VAL 8 5.621 10.316 -12.270 55 HG22 VAL 8 HG22 VAL 8 4.579 9.306 -11.250 56 HG23 VAL 8 HG23 VAL 8 4.074 9.713 -12.887 57 H ASP 9 H ASP 9 2.690 12.461 -8.731 58 HA ASP 9 HA ASP 9 2.221 15.176 -9.326 59 HB2 ASP 9 HB2 ASP 9 0.810 13.278 -8.170 60 HB3 ASP 9 HB3 ASP 9 1.489 13.905 -6.677 61 H GLU 10 H GLU 10 3.724 13.773 -6.344 62 HA GLU 10 HA GLU 10 4.517 16.248 -5.267 63 HB2 GLU 10 HB2 GLU 10 5.882 14.961 -3.733 64 HB3 GLU 10 HB3 GLU 10 4.311 14.176 -3.970 65 HG2 GLU 10 HG2 GLU 10 5.357 12.618 -5.556 66 HG3 GLU 10 HG3 GLU 10 6.929 13.347 -5.246 67 H ALA 11 H ALA 11 6.079 14.309 -7.768 68 HA ALA 11 HA ALA 11 8.672 15.595 -7.375 69 HB1 ALA 11 HB1 ALA 11 9.077 14.718 -9.786 70 HB2 ALA 11 HB2 ALA 11 8.781 13.550 -8.492 71 HB3 ALA 11 HB3 ALA 11 7.483 13.984 -9.655 72 H LEU 12 H LEU 12 5.795 16.052 -9.461 73 HA LEU 12 HA LEU 12 6.801 18.265 -10.962 74 HB2 LEU 12 HB2 LEU 12 3.998 17.305 -10.289 75 HB3 LEU 12 HB3 LEU 12 4.264 18.757 -11.259 76 HG LEU 12 HG LEU 12 5.493 16.098 -11.977 77 HD11 LEU 12 HD11 LEU 12 2.891 17.182 -13.066 78 HD12 LEU 12 HD12 LEU 12 3.047 15.847 -11.898 79 HD13 LEU 12 HD13 LEU 12 3.691 15.683 -13.527 80 HD21 LEU 12 HD21 LEU 12 5.617 17.071 -14.267 81 HD22 LEU 12 HD22 LEU 12 6.542 18.026 -13.109 82 HD23 LEU 12 HD23 LEU 12 4.949 18.585 -13.646 83 H GLU 13 H GLU 13 5.442 18.032 -7.709 84 HA GLU 13 HA GLU 13 4.905 20.809 -7.333 85 HB2 GLU 13 HB2 GLU 13 5.357 18.425 -5.558 86 HB3 GLU 13 HB3 GLU 13 5.580 19.992 -4.806 87 HG2 GLU 13 HG2 GLU 13 3.153 19.164 -6.407 88 HG3 GLU 13 HG3 GLU 13 3.257 19.051 -4.630 89 H GLN 14 H GLN 14 7.928 19.012 -7.316 90 HA GLN 14 HA GLN 14 9.376 21.358 -6.183 91 HB2 GLN 14 HB2 GLN 14 10.914 19.089 -7.265 92 HB3 GLN 14 HB3 GLN 14 11.164 20.025 -5.810 93 HG2 GLN 14 HG2 GLN 14 9.266 17.691 -6.163 94 HG3 GLN 14 HG3 GLN 14 10.834 17.657 -5.375 95 HE21 GLN 14 HE21 GLN 14 7.952 17.250 -4.474 96 HE22 GLN 14 HE22 GLN 14 7.704 18.319 -3.115 97 H GLY 15 H GLY 15 8.224 20.253 -9.158 98 HA2 GLY 15 HA2 GLY 15 8.435 21.374 -11.186 99 HA3 GLY 15 HA3 GLY 15 10.001 22.036 -10.701 100 H ILE 16 H ILE 16 9.362 18.568 -10.225 101 HA ILE 16 HA ILE 16 11.286 18.012 -12.402 102 HB ILE 16 HB ILE 16 10.645 16.220 -10.062 103 HG12 ILE 16 HG12 ILE 16 13.394 17.270 -10.114 104 HG13 ILE 16 HG13 ILE 16 12.248 18.561 -9.866 105 HG21 ILE 16 HG21 ILE 16 12.750 16.167 -12.275 106 HG22 ILE 16 HG22 ILE 16 12.748 15.071 -10.893 107 HG23 ILE 16 HG23 ILE 16 11.419 15.018 -12.032 108 HD11 ILE 16 HD11 ILE 16 12.876 17.778 -7.696 109 HD12 ILE 16 HD12 ILE 16 11.235 17.127 -7.987 110 HD13 ILE 16 HD13 ILE 16 12.658 16.094 -8.143 111 H THR 17 H THR 17 10.582 17.239 -14.166 112 HA THR 17 HA THR 17 7.911 16.056 -14.480 113 HB THR 17 HB THR 17 10.165 17.144 -16.206 114 HG1 THR 17 HG1 THR 17 8.735 18.644 -15.601 115 HG21 THR 17 HG21 THR 17 7.853 15.516 -17.250 116 HG22 THR 17 HG22 THR 17 9.587 15.160 -17.366 117 HG23 THR 17 HG23 THR 17 8.950 16.556 -18.226 118 H LEU 18 H LEU 18 7.628 13.866 -14.702 119 HA LEU 18 HA LEU 18 10.039 12.109 -14.931 120 HB2 LEU 18 HB2 LEU 18 7.240 11.700 -13.765 121 HB3 LEU 18 HB3 LEU 18 8.275 10.377 -14.209 122 HG LEU 18 HG LEU 18 8.292 11.980 -11.797 123 HD11 LEU 18 HD11 LEU 18 9.557 9.977 -10.963 124 HD12 LEU 18 HD12 LEU 18 9.683 9.390 -12.636 125 HD13 LEU 18 HD13 LEU 18 8.095 9.547 -11.861 126 HD21 LEU 18 HD21 LEU 18 10.691 12.101 -11.391 127 HD22 LEU 18 HD22 LEU 18 10.227 13.120 -12.769 128 HD23 LEU 18 HD23 LEU 18 10.975 11.534 -13.065 129 H PHE 19 H PHE 19 10.081 10.508 -16.478 130 HA PHE 19 HA PHE 19 7.859 9.992 -18.246 131 HB2 PHE 19 HB2 PHE 19 8.885 10.838 -20.303 132 HB3 PHE 19 HB3 PHE 19 8.446 12.108 -19.208 133 HD1 PHE 19 HD1 PHE 19 11.038 10.857 -21.289 134 HD2 PHE 19 HD2 PHE 19 10.346 13.134 -17.710 135 HE1 PHE 19 HE1 PHE 19 13.239 11.992 -21.570 136 HE2 PHE 19 HE2 PHE 19 12.471 14.307 -18.045 137 HZ PHE 19 HZ PHE 19 13.967 13.727 -19.929 138 H VAL 20 H VAL 20 8.846 8.652 -20.205 139 HA VAL 20 HA VAL 20 11.147 7.014 -19.337 140 HB VAL 20 HB VAL 20 8.499 5.833 -20.317 141 HG11 VAL 20 HG11 VAL 20 10.951 4.458 -19.170 142 HG12 VAL 20 HG12 VAL 20 9.489 3.695 -19.814 143 HG13 VAL 20 HG13 VAL 20 10.553 4.565 -20.907 144 HG21 VAL 20 HG21 VAL 20 9.658 5.605 -17.502 145 HG22 VAL 20 HG22 VAL 20 8.338 6.690 -17.946 146 HG23 VAL 20 HG23 VAL 20 8.115 4.960 -18.138 147 H VAL 21 H VAL 21 12.456 6.588 -21.045 148 HA VAL 21 HA VAL 21 11.399 7.045 -23.806 149 HB VAL 21 HB VAL 21 14.144 7.964 -22.889 150 HG11 VAL 21 HG11 VAL 21 14.200 9.069 -25.093 151 HG12 VAL 21 HG12 VAL 21 13.919 7.335 -25.301 152 HG13 VAL 21 HG13 VAL 21 12.569 8.478 -25.454 153 HG21 VAL 21 HG21 VAL 21 11.641 9.596 -23.254 154 HG22 VAL 21 HG22 VAL 21 12.669 9.435 -21.806 155 HG23 VAL 21 HG23 VAL 21 13.282 10.279 -23.236 156 H ASN 22 H ASN 22 11.617 5.190 -24.908 157 HA ASN 22 HA ASN 22 12.149 3.084 -25.441 158 HB2 ASN 22 HB2 ASN 22 14.944 4.102 -24.781 159 HB3 ASN 22 HB3 ASN 22 14.616 2.555 -25.560 160 HD21 ASN 22 HD21 ASN 22 15.366 5.783 -26.329 161 HD22 ASN 22 HD22 ASN 22 14.636 5.775 -27.909 162 H ASN 23 H ASN 23 10.991 3.264 -23.001 163 HA ASN 23 HA ASN 23 10.454 2.162 -21.213 164 HB2 ASN 23 HB2 ASN 23 10.698 0.209 -22.677 165 HB3 ASN 23 HB3 ASN 23 12.350 -0.027 -22.068 166 HD21 ASN 23 HD21 ASN 23 8.911 0.327 -21.012 167 HD22 ASN 23 HD22 ASN 23 9.088 -0.738 -19.642 168 H ARG 24 H ARG 24 13.268 3.736 -21.383 169 HA ARG 24 HA ARG 24 14.287 2.879 -18.736 170 HB2 ARG 24 HB2 ARG 24 15.437 4.713 -20.868 171 HB3 ARG 24 HB3 ARG 24 16.255 4.308 -19.368 172 HG2 ARG 24 HG2 ARG 24 16.656 2.072 -20.018 173 HG3 ARG 24 HG3 ARG 24 15.341 2.059 -21.190 174 HD2 ARG 24 HD2 ARG 24 16.614 3.762 -22.545 175 HD3 ARG 24 HD3 ARG 24 18.008 3.423 -21.494 176 HE ARG 24 HE ARG 24 17.421 0.948 -22.181 177 HH11 ARG 24 HH11 ARG 24 17.516 3.800 -24.372 178 HH12 ARG 24 HH12 ARG 24 17.696 2.819 -25.777 179 HH21 ARG 24 HH21 ARG 24 17.703 -0.258 -24.054 180 HH22 ARG 24 HH22 ARG 24 17.977 0.457 -25.585 181 H LEU 25 H LEU 25 13.716 3.990 -16.997 182 HA LEU 25 HA LEU 25 11.918 6.201 -17.049 183 HB2 LEU 25 HB2 LEU 25 12.387 4.326 -15.208 184 HB3 LEU 25 HB3 LEU 25 13.680 5.358 -14.685 185 HG LEU 25 HG LEU 25 10.765 6.195 -14.883 186 HD11 LEU 25 HD11 LEU 25 12.393 5.386 -12.446 187 HD12 LEU 25 HD12 LEU 25 10.991 4.541 -13.172 188 HD13 LEU 25 HD13 LEU 25 10.770 6.109 -12.417 189 HD21 LEU 25 HD21 LEU 25 13.212 7.619 -13.735 190 HD22 LEU 25 HD22 LEU 25 11.544 8.039 -13.274 191 HD23 LEU 25 HD23 LEU 25 12.029 8.226 -14.925 192 H GLN 26 H GLN 26 12.414 8.357 -17.335 193 HA GLN 26 HA GLN 26 15.096 9.400 -16.635 194 HB2 GLN 26 HB2 GLN 26 13.349 10.008 -19.059 195 HB3 GLN 26 HB3 GLN 26 14.834 10.870 -18.661 196 HG2 GLN 26 HG2 GLN 26 14.740 7.887 -19.284 197 HG3 GLN 26 HG3 GLN 26 14.980 9.138 -20.478 198 HE21 GLN 26 HE21 GLN 26 17.015 8.161 -20.978 199 HE22 GLN 26 HE22 GLN 26 18.432 8.352 -19.947 200 H TYR 27 H TYR 27 14.951 11.897 -16.455 201 HA TYR 27 HA TYR 27 12.343 12.962 -15.791 202 HB2 TYR 27 HB2 TYR 27 12.872 13.620 -13.531 203 HB3 TYR 27 HB3 TYR 27 12.936 11.864 -13.690 204 HD1 TYR 27 HD1 TYR 27 15.043 10.646 -13.528 205 HD2 TYR 27 HD2 TYR 27 14.816 14.900 -12.908 206 HE1 TYR 27 HE1 TYR 27 17.171 10.570 -12.198 207 HE2 TYR 27 HE2 TYR 27 16.904 14.839 -11.597 208 HH TYR 27 HH TYR 27 18.813 11.829 -11.071 209 H GLU 28 H GLU 28 12.469 15.288 -15.427 210 HA GLU 28 HA GLU 28 15.035 16.555 -16.152 211 HB2 GLU 28 HB2 GLU 28 14.172 16.147 -18.304 212 HB3 GLU 28 HB3 GLU 28 12.523 16.643 -17.853 213 HG2 GLU 28 HG2 GLU 28 13.068 18.885 -17.678 214 HG3 GLU 28 HG3 GLU 28 14.824 18.595 -17.610 215 H THR 29 H THR 29 15.295 18.512 -15.267 216 HA THR 29 HA THR 29 13.196 20.276 -14.483 217 HB THR 29 HB THR 29 13.141 18.581 -12.655 218 HG1 THR 29 HG1 THR 29 12.485 20.539 -12.100 219 HG21 THR 29 HG21 THR 29 16.003 19.393 -12.108 220 HG22 THR 29 HG22 THR 29 15.365 17.774 -12.505 221 HG23 THR 29 HG23 THR 29 14.931 18.553 -10.983 222 H SER 30 H SER 30 14.353 22.204 -13.319 223 HA SER 30 HA SER 30 17.201 22.544 -14.068 224 HB2 SER 30 HB2 SER 30 15.638 23.206 -15.955 225 HB3 SER 30 HB3 SER 30 14.977 24.453 -14.892 226 HG SER 30 HG SER 30 16.665 25.083 -16.350 227 H ARG 31 H ARG 31 17.333 22.209 -11.721 228 HA ARG 31 HA ARG 31 16.981 24.663 -10.218 229 HB2 ARG 31 HB2 ARG 31 15.589 23.619 -8.452 230 HB3 ARG 31 HB3 ARG 31 14.756 23.727 -9.992 231 HG2 ARG 31 HG2 ARG 31 15.306 21.328 -10.448 232 HG3 ARG 31 HG3 ARG 31 16.062 21.203 -8.855 233 HD2 ARG 31 HD2 ARG 31 13.181 22.089 -9.300 234 HD3 ARG 31 HD3 ARG 31 13.649 20.416 -9.027 235 HE ARG 31 HE ARG 31 14.272 20.844 -6.839 236 HH11 ARG 31 HH11 ARG 31 12.673 23.682 -8.203 237 HH12 ARG 31 HH12 ARG 31 12.718 24.599 -6.739 238 HH21 ARG 31 HH21 ARG 31 14.175 21.869 -4.916 239 HH22 ARG 31 HH22 ARG 31 13.402 23.379 -4.695 240 H ASP 32 H ASP 32 17.440 23.734 -7.636 241 HA ASP 32 HA ASP 32 19.963 22.180 -7.792 242 HB2 ASP 32 HB2 ASP 32 21.117 23.704 -6.522 243 HB3 ASP 32 HB3 ASP 32 20.171 24.789 -7.528 244 H SER 33 H SER 33 20.618 21.451 -5.571 245 HA SER 33 HA SER 33 20.246 19.850 -4.028 246 HB2 SER 33 HB2 SER 33 20.144 22.263 -3.025 247 HB3 SER 33 HB3 SER 33 18.477 21.860 -2.633 248 HG SER 33 HG SER 33 19.408 19.942 -1.558 249 H ILE 34 H ILE 34 18.990 18.478 -5.566 250 HA ILE 34 HA ILE 34 16.117 18.479 -5.262 251 HB ILE 34 HB ILE 34 18.126 16.775 -6.694 252 HG12 ILE 34 HG12 ILE 34 15.425 17.965 -7.516 253 HG13 ILE 34 HG13 ILE 34 16.933 18.871 -7.555 254 HG21 ILE 34 HG21 ILE 34 16.512 15.075 -7.375 255 HG22 ILE 34 HG22 ILE 34 16.704 15.019 -5.626 256 HG23 ILE 34 HG23 ILE 34 15.260 15.754 -6.319 257 HD11 ILE 34 HD11 ILE 34 17.874 17.075 -9.078 258 HD12 ILE 34 HD12 ILE 34 16.190 16.463 -9.233 259 HD13 ILE 34 HD13 ILE 34 16.615 18.116 -9.741 260 HA PRO 35 HA PRO 35 15.900 16.331 -1.424 261 HB2 PRO 35 HB2 PRO 35 13.431 15.059 -1.810 262 HB3 PRO 35 HB3 PRO 35 13.672 16.751 -1.264 263 HG2 PRO 35 HG2 PRO 35 12.909 15.736 -4.008 264 HG3 PRO 35 HG3 PRO 35 12.395 17.226 -3.239 265 HD2 PRO 35 HD2 PRO 35 14.352 17.196 -5.072 266 HD3 PRO 35 HD3 PRO 35 14.374 18.320 -3.683 267 H THR 36 H THR 36 17.461 14.706 -1.375 268 HA THR 36 HA THR 36 17.722 12.596 -3.212 269 HB THR 36 HB THR 36 19.599 13.087 -1.911 270 HG1 THR 36 HG1 THR 36 19.343 10.857 -2.172 271 HG21 THR 36 HG21 THR 36 17.902 12.704 0.561 272 HG22 THR 36 HG22 THR 36 18.704 14.192 0.022 273 HG23 THR 36 HG23 THR 36 19.678 12.835 0.583 274 H GLU 37 H GLU 37 15.636 12.878 -0.348 275 HA GLU 37 HA GLU 37 14.839 10.177 -0.123 276 HB2 GLU 37 HB2 GLU 37 12.835 11.167 0.992 277 HB3 GLU 37 HB3 GLU 37 14.392 11.721 1.612 278 HG2 GLU 37 HG2 GLU 37 14.126 13.863 0.375 279 HG3 GLU 37 HG3 GLU 37 12.568 13.303 -0.222 280 H LEU 38 H LEU 38 13.600 12.782 -2.227 281 HA LEU 38 HA LEU 38 11.387 11.181 -3.259 282 HB2 LEU 38 HB2 LEU 38 11.809 13.836 -2.952 283 HB3 LEU 38 HB3 LEU 38 12.307 13.672 -4.639 284 HG LEU 38 HG LEU 38 9.625 12.703 -3.512 285 HD11 LEU 38 HD11 LEU 38 9.861 15.148 -3.206 286 HD12 LEU 38 HD12 LEU 38 8.667 14.776 -4.447 287 HD13 LEU 38 HD13 LEU 38 10.288 15.332 -4.928 288 HD21 LEU 38 HD21 LEU 38 10.220 11.654 -5.649 289 HD22 LEU 38 HD22 LEU 38 10.581 13.255 -6.349 290 HD23 LEU 38 HD23 LEU 38 8.924 12.831 -5.902 291 H LEU 39 H LEU 39 14.613 12.276 -4.311 292 HA LEU 39 HA LEU 39 14.676 11.243 -6.914 293 HB2 LEU 39 HB2 LEU 39 16.380 12.677 -5.515 294 HB3 LEU 39 HB3 LEU 39 17.097 11.130 -5.084 295 HG LEU 39 HG LEU 39 16.762 12.312 -7.868 296 HD11 LEU 39 HD11 LEU 39 19.196 12.485 -7.853 297 HD12 LEU 39 HD12 LEU 39 19.263 11.764 -6.226 298 HD13 LEU 39 HD13 LEU 39 18.513 13.355 -6.477 299 HD21 LEU 39 HD21 LEU 39 18.191 10.434 -8.676 300 HD22 LEU 39 HD22 LEU 39 16.602 9.907 -8.158 301 HD23 LEU 39 HD23 LEU 39 18.009 9.641 -7.094 302 H ASN 40 H ASN 40 15.621 9.771 -3.825 303 HA ASN 40 HA ASN 40 16.264 7.184 -4.752 304 HB2 ASN 40 HB2 ASN 40 15.422 8.165 -2.017 305 HB3 ASN 40 HB3 ASN 40 15.831 6.479 -2.353 306 HD21 ASN 40 HD21 ASN 40 17.371 7.850 -0.491 307 HD22 ASN 40 HD22 ASN 40 18.965 8.103 -1.203 308 H LYS 41 H LYS 41 13.094 8.605 -3.929 309 HA LYS 41 HA LYS 41 11.735 6.077 -3.786 310 HB2 LYS 41 HB2 LYS 41 10.880 8.149 -2.816 311 HB3 LYS 41 HB3 LYS 41 10.659 8.861 -4.421 312 HG2 LYS 41 HG2 LYS 41 8.899 7.403 -4.974 313 HG3 LYS 41 HG3 LYS 41 9.388 6.226 -3.759 314 HD2 LYS 41 HD2 LYS 41 7.367 7.285 -3.050 315 HD3 LYS 41 HD3 LYS 41 8.700 7.669 -1.951 316 HE2 LYS 41 HE2 LYS 41 8.942 9.840 -3.450 317 HE3 LYS 41 HE3 LYS 41 7.280 9.448 -3.935 318 HZ1 LYS 41 HZ1 LYS 41 7.097 10.856 -2.146 319 HZ2 LYS 41 HZ2 LYS 41 8.305 10.118 -1.272 320 HZ3 LYS 41 HZ3 LYS 41 6.828 9.392 -1.466 321 H TRP 42 H TRP 42 12.558 8.280 -6.456 322 HA TRP 42 HA TRP 42 11.012 7.007 -8.455 323 HB2 TRP 42 HB2 TRP 42 13.722 8.297 -8.845 324 HB3 TRP 42 HB3 TRP 42 12.482 7.997 -10.072 325 HD1 TRP 42 HD1 TRP 42 10.081 9.212 -8.121 326 HE1 TRP 42 HE1 TRP 42 9.805 11.702 -8.203 327 HE3 TRP 42 HE3 TRP 42 14.789 10.456 -9.666 328 HZ2 TRP 42 HZ2 TRP 42 11.588 14.045 -8.395 329 HZ3 TRP 42 HZ3 TRP 42 15.502 12.836 -9.717 330 HH2 TRP 42 HH2 TRP 42 13.952 14.614 -9.026 331 H LYS 43 H LYS 43 14.479 6.491 -7.607 332 HA LYS 43 HA LYS 43 14.784 4.313 -9.461 333 HB2 LYS 43 HB2 LYS 43 16.881 3.815 -8.177 334 HB3 LYS 43 HB3 LYS 43 16.758 5.452 -8.797 335 HG2 LYS 43 HG2 LYS 43 16.219 6.332 -6.653 336 HG3 LYS 43 HG3 LYS 43 16.072 4.716 -5.929 337 HD2 LYS 43 HD2 LYS 43 18.684 5.837 -7.013 338 HD3 LYS 43 HD3 LYS 43 18.142 5.969 -5.335 339 HE2 LYS 43 HE2 LYS 43 17.814 3.388 -5.441 340 HE3 LYS 43 HE3 LYS 43 18.854 3.458 -6.870 341 HZ1 LYS 43 HZ1 LYS 43 19.510 4.361 -4.131 342 HZ2 LYS 43 HZ2 LYS 43 20.515 4.578 -5.428 343 HZ3 LYS 43 HZ3 LYS 43 20.138 3.060 -4.898 344 H GLN 44 H GLN 44 13.867 4.427 -6.014 345 HA GLN 44 HA GLN 44 13.880 1.750 -5.415 346 HB2 GLN 44 HB2 GLN 44 13.428 3.543 -3.773 347 HB3 GLN 44 HB3 GLN 44 11.881 3.880 -4.538 348 HG2 GLN 44 HG2 GLN 44 11.357 2.635 -2.610 349 HG3 GLN 44 HG3 GLN 44 11.128 1.551 -3.948 350 HE21 GLN 44 HE21 GLN 44 11.335 -0.099 -2.125 351 HE22 GLN 44 HE22 GLN 44 12.979 -0.728 -1.933 352 H HIS 45 H HIS 45 11.136 3.574 -6.864 353 HA HIS 45 HA HIS 45 9.779 0.979 -7.433 354 HB2 HIS 45 HB2 HIS 45 8.587 3.770 -7.224 355 HB3 HIS 45 HB3 HIS 45 7.730 2.242 -7.341 356 HD1 HIS 45 HD1 HIS 45 7.925 0.630 -5.129 357 HD2 HIS 45 HD2 HIS 45 9.244 4.578 -4.883 358 HE1 HIS 45 HE1 HIS 45 8.044 1.170 -2.627 359 H LYS 46 H LYS 46 11.931 1.912 -9.094 360 HA LYS 46 HA LYS 46 11.324 3.390 -11.302 361 HB2 LYS 46 HB2 LYS 46 13.532 2.415 -10.825 362 HB3 LYS 46 HB3 LYS 46 12.924 0.797 -11.297 363 HG2 LYS 46 HG2 LYS 46 12.909 1.271 -13.529 364 HG3 LYS 46 HG3 LYS 46 12.615 2.994 -13.304 365 HD2 LYS 46 HD2 LYS 46 14.835 2.603 -14.257 366 HD3 LYS 46 HD3 LYS 46 14.923 3.371 -12.655 367 HE2 LYS 46 HE2 LYS 46 15.224 1.108 -11.655 368 HE3 LYS 46 HE3 LYS 46 15.319 0.399 -13.267 369 HZ1 LYS 46 HZ1 LYS 46 17.318 1.666 -13.659 370 HZ2 LYS 46 HZ2 LYS 46 17.453 0.865 -12.206 371 HZ3 LYS 46 HZ3 LYS 46 17.138 2.475 -12.217 372 H GLN 47 H GLN 47 10.820 -0.177 -11.174 373 HA GLN 47 HA GLN 47 9.666 -0.346 -13.748 374 HB2 GLN 47 HB2 GLN 47 10.421 -2.140 -11.791 375 HB3 GLN 47 HB3 GLN 47 8.666 -2.308 -11.734 376 HG2 GLN 47 HG2 GLN 47 10.457 -2.504 -14.183 377 HG3 GLN 47 HG3 GLN 47 9.792 -3.888 -13.296 378 HE21 GLN 47 HE21 GLN 47 9.190 -1.684 -15.900 379 HE22 GLN 47 HE22 GLN 47 7.481 -2.030 -16.072 380 H GLU 48 H GLU 48 8.206 0.105 -10.627 381 HA GLU 48 HA GLU 48 5.471 -0.037 -11.325 382 HB2 GLU 48 HB2 GLU 48 6.397 1.803 -9.112 383 HB3 GLU 48 HB3 GLU 48 4.976 0.783 -9.204 384 HG2 GLU 48 HG2 GLU 48 6.685 -1.224 -9.143 385 HG3 GLU 48 HG3 GLU 48 7.854 -0.013 -8.619 386 H LEU 49 H LEU 49 7.630 2.781 -11.112 387 HA LEU 49 HA LEU 49 5.745 4.770 -11.973 388 HB2 LEU 49 HB2 LEU 49 8.773 4.601 -12.124 389 HB3 LEU 49 HB3 LEU 49 7.885 6.057 -12.549 390 HG LEU 49 HG LEU 49 7.410 4.800 -9.829 391 HD11 LEU 49 HD11 LEU 49 9.259 5.922 -8.896 392 HD12 LEU 49 HD12 LEU 49 9.661 6.736 -10.446 393 HD13 LEU 49 HD13 LEU 49 9.876 4.982 -10.269 394 HD21 LEU 49 HD21 LEU 49 7.057 7.150 -9.225 395 HD22 LEU 49 HD22 LEU 49 5.966 6.684 -10.530 396 HD23 LEU 49 HD23 LEU 49 7.400 7.670 -10.871 397 H ILE 50 H ILE 50 8.196 2.838 -13.719 398 HA ILE 50 HA ILE 50 7.888 4.139 -16.209 399 HB ILE 50 HB ILE 50 8.592 1.259 -15.575 400 HG12 ILE 50 HG12 ILE 50 10.451 3.339 -16.792 401 HG13 ILE 50 HG13 ILE 50 10.145 3.365 -15.052 402 HG21 ILE 50 HG21 ILE 50 8.425 2.565 -18.300 403 HG22 ILE 50 HG22 ILE 50 9.484 1.169 -17.998 404 HG23 ILE 50 HG23 ILE 50 7.737 1.039 -17.776 405 HD11 ILE 50 HD11 ILE 50 11.199 0.946 -16.583 406 HD12 ILE 50 HD12 ILE 50 12.163 2.044 -15.598 407 HD13 ILE 50 HD13 ILE 50 10.907 1.039 -14.833 408 H ASP 51 H ASP 51 6.243 1.211 -14.990 409 HA ASP 51 HA ASP 51 4.595 0.695 -17.137 410 HB2 ASP 51 HB2 ASP 51 5.036 -0.479 -14.822 411 HB3 ASP 51 HB3 ASP 51 3.643 0.435 -14.268 412 H PHE 52 H PHE 52 4.165 3.102 -14.612 413 HA PHE 52 HA PHE 52 1.479 3.862 -15.351 414 HB2 PHE 52 HB2 PHE 52 2.278 4.071 -13.084 415 HB3 PHE 52 HB3 PHE 52 3.599 5.104 -13.579 416 HD1 PHE 52 HD1 PHE 52 3.398 7.420 -13.377 417 HD2 PHE 52 HD2 PHE 52 -0.172 5.032 -13.697 418 HE1 PHE 52 HE1 PHE 52 1.981 9.462 -13.112 419 HE2 PHE 52 HE2 PHE 52 -1.553 7.066 -13.348 420 HZ PHE 52 HZ PHE 52 -0.417 9.292 -13.049 421 H LEU 53 H LEU 53 4.735 5.472 -15.820 422 HA LEU 53 HA LEU 53 3.682 7.748 -17.200 423 HB2 LEU 53 HB2 LEU 53 6.391 6.397 -16.968 424 HB3 LEU 53 HB3 LEU 53 6.155 7.674 -18.148 425 HG LEU 53 HG LEU 53 7.197 8.670 -16.414 426 HD11 LEU 53 HD11 LEU 53 5.757 10.431 -15.678 427 HD12 LEU 53 HD12 LEU 53 4.310 9.421 -15.940 428 HD13 LEU 53 HD13 LEU 53 5.301 9.971 -17.321 429 HD21 LEU 53 HD21 LEU 53 6.449 8.705 -14.048 430 HD22 LEU 53 HD22 LEU 53 6.960 7.109 -14.616 431 HD23 LEU 53 HD23 LEU 53 5.242 7.477 -14.459 432 H ASN 54 H ASN 54 4.643 4.517 -18.234 433 HA ASN 54 HA ASN 54 4.764 5.192 -21.042 434 HB2 ASN 54 HB2 ASN 54 5.466 2.959 -19.463 435 HB3 ASN 54 HB3 ASN 54 4.189 2.363 -20.416 436 HD21 ASN 54 HD21 ASN 54 7.307 3.900 -20.299 437 HD22 ASN 54 HD22 ASN 54 7.840 3.612 -21.959 438 H GLN 55 H GLN 55 2.296 3.429 -19.058 439 HA GLN 55 HA GLN 55 0.390 3.490 -21.149 440 HB2 GLN 55 HB2 GLN 55 -1.179 2.621 -19.550 441 HB3 GLN 55 HB3 GLN 55 0.408 1.917 -19.243 442 HG2 GLN 55 HG2 GLN 55 -0.348 2.361 -17.119 443 HG3 GLN 55 HG3 GLN 55 0.690 3.713 -17.453 444 HE21 GLN 55 HE21 GLN 55 -0.181 5.711 -16.821 445 HE22 GLN 55 HE22 GLN 55 -1.939 6.014 -16.797 446 H LEU 56 H LEU 56 1.316 6.026 -18.909 447 HA LEU 56 HA LEU 56 -1.054 7.583 -18.861 448 HB2 LEU 56 HB2 LEU 56 0.791 7.886 -17.289 449 HB3 LEU 56 HB3 LEU 56 1.890 8.276 -18.619 450 HG LEU 56 HG LEU 56 0.537 10.361 -19.022 451 HD11 LEU 56 HD11 LEU 56 -1.533 9.537 -17.825 452 HD12 LEU 56 HD12 LEU 56 -0.967 11.125 -17.281 453 HD13 LEU 56 HD13 LEU 56 -0.655 9.671 -16.293 454 HD21 LEU 56 HD21 LEU 56 2.649 10.361 -17.779 455 HD22 LEU 56 HD22 LEU 56 1.781 9.990 -16.266 456 HD23 LEU 56 HD23 LEU 56 1.520 11.543 -17.103 457 H ASP 57 H ASP 57 1.427 7.135 -21.316 458 HA ASP 57 HA ASP 57 0.177 9.306 -22.960 459 HB2 ASP 57 HB2 ASP 57 2.761 9.093 -22.033 460 HB3 ASP 57 HB3 ASP 57 2.919 8.421 -23.643 461 H SER 58 H SER 58 0.758 5.905 -22.899 462 HA SER 58 HA SER 58 -0.177 5.786 -25.721 463 HB2 SER 58 HB2 SER 58 2.335 4.477 -24.660 464 HB3 SER 58 HB3 SER 58 1.551 4.053 -26.207 465 HG SER 58 HG SER 58 1.710 6.729 -25.877 466 H GLU 59 H GLU 59 -0.886 4.939 -22.689 467 HA GLU 59 HA GLU 59 -1.837 3.182 -21.643 468 HB2 GLU 59 HB2 GLU 59 -3.293 5.042 -22.782 469 HB3 GLU 59 HB3 GLU 59 -3.872 3.734 -23.799 470 HG2 GLU 59 HG2 GLU 59 -4.313 2.518 -21.545 471 HG3 GLU 59 HG3 GLU 59 -4.006 4.068 -20.779 472 H GLU 60 H GLU 60 -0.044 1.598 -22.959 473 HA GLU 60 HA GLU 60 -1.733 -0.614 -24.036 474 HB2 GLU 60 HB2 GLU 60 -0.141 -1.058 -25.648 475 HB3 GLU 60 HB3 GLU 60 -0.357 0.679 -25.713 476 HG2 GLU 60 HG2 GLU 60 1.987 -0.773 -24.385 477 HG3 GLU 60 HG3 GLU 60 1.978 -0.085 -25.993 478 H GLN 61 H GLN 61 0.060 0.140 -21.341 479 HA GLN 61 HA GLN 61 1.180 -2.617 -21.163 480 HB2 GLN 61 HB2 GLN 61 1.999 -0.202 -19.536 481 HB3 GLN 61 HB3 GLN 61 2.691 -1.820 -19.463 482 HG2 GLN 61 HG2 GLN 61 2.921 -1.291 -22.163 483 HG3 GLN 61 HG3 GLN 61 3.110 0.317 -21.480 484 HE21 GLN 61 HE21 GLN 61 4.464 -2.963 -21.621 485 HE22 GLN 61 HE22 GLN 61 6.081 -2.540 -21.082 486 H THR 62 H THR 62 -1.664 -1.238 -20.070 487 HA THR 62 HA THR 62 -1.759 -1.870 -17.358 488 HB THR 62 HB THR 62 -4.220 -2.223 -17.687 489 HG1 THR 62 HG1 THR 62 -3.639 -1.523 -20.387 490 HG21 THR 62 HG21 THR 62 -4.655 0.125 -18.302 491 HG22 THR 62 HG22 THR 62 -2.994 0.289 -18.921 492 HG23 THR 62 HG23 THR 62 -3.286 -0.030 -17.209 493 H LYS 63 H LYS 63 -1.208 -3.622 -16.275 494 HA LYS 63 HA LYS 63 -1.192 -6.257 -17.498 495 HB2 LYS 63 HB2 LYS 63 -0.604 -5.267 -14.680 496 HB3 LYS 63 HB3 LYS 63 -0.418 -6.952 -15.213 497 HG2 LYS 63 HG2 LYS 63 1.230 -6.209 -16.927 498 HG3 LYS 63 HG3 LYS 63 1.063 -4.539 -16.346 499 HD2 LYS 63 HD2 LYS 63 1.844 -5.261 -14.086 500 HD3 LYS 63 HD3 LYS 63 2.005 -6.918 -14.682 501 HE2 LYS 63 HE2 LYS 63 4.186 -5.943 -14.750 502 HE3 LYS 63 HE3 LYS 63 3.619 -6.070 -16.424 503 HZ1 LYS 63 HZ1 LYS 63 4.580 -3.915 -16.065 504 HZ2 LYS 63 HZ2 LYS 63 3.611 -3.630 -14.753 505 HZ3 LYS 63 HZ3 LYS 63 2.991 -3.664 -16.240 Start of MODEL 13 1 H1 GLY 1 H GLY 1 0.475 -0.119 -1.127 2 HA2 GLY 1 HA2 GLY 1 3.295 -1.045 -1.282 3 HA3 GLY 1 HA3 GLY 1 2.180 -1.018 -2.667 4 H ILE 2 H ILE 2 2.680 0.672 -3.999 5 HA ILE 2 HA ILE 2 2.932 3.363 -2.832 6 HB ILE 2 HB ILE 2 5.243 2.469 -3.224 7 HG12 ILE 2 HG12 ILE 2 6.180 4.166 -4.500 8 HG13 ILE 2 HG13 ILE 2 4.675 4.517 -5.369 9 HG21 ILE 2 HG21 ILE 2 5.899 2.189 -5.726 10 HG22 ILE 2 HG22 ILE 2 5.019 0.868 -4.972 11 HG23 ILE 2 HG23 ILE 2 4.205 2.002 -6.063 12 HD11 ILE 2 HD11 ILE 2 5.232 6.259 -3.762 13 HD12 ILE 2 HD12 ILE 2 3.720 5.473 -3.283 14 HD13 ILE 2 HD13 ILE 2 5.240 5.076 -2.433 15 H ASP 3 H ASP 3 2.506 5.020 -4.620 16 HA ASP 3 HA ASP 3 0.696 3.913 -6.669 17 HB2 ASP 3 HB2 ASP 3 0.300 6.564 -5.350 18 HB3 ASP 3 HB3 ASP 3 -0.814 5.602 -6.287 19 H ALA 4 H ALA 4 1.756 4.300 -8.491 20 HA ALA 4 HA ALA 4 4.135 5.850 -8.703 21 HB1 ALA 4 HB1 ALA 4 2.150 4.958 -10.829 22 HB2 ALA 4 HB2 ALA 4 3.772 5.603 -11.156 23 HB3 ALA 4 HB3 ALA 4 3.588 4.061 -10.293 24 H ALA 5 H ALA 5 0.727 6.694 -9.373 25 HA ALA 5 HA ALA 5 1.142 9.244 -10.506 26 HB1 ALA 5 HB1 ALA 5 -1.054 8.116 -10.500 27 HB2 ALA 5 HB2 ALA 5 -1.143 8.303 -8.724 28 HB3 ALA 5 HB3 ALA 5 -1.170 9.728 -9.764 29 H GLN 6 H GLN 6 0.933 8.280 -7.085 30 HA GLN 6 HA GLN 6 0.960 10.935 -6.029 31 HB2 GLN 6 HB2 GLN 6 1.780 8.199 -4.933 32 HB3 GLN 6 HB3 GLN 6 1.993 9.610 -3.967 33 HG2 GLN 6 HG2 GLN 6 -0.653 8.672 -5.126 34 HG3 GLN 6 HG3 GLN 6 -0.102 8.340 -3.493 35 HE21 GLN 6 HE21 GLN 6 0.950 11.182 -3.125 36 HE22 GLN 6 HE22 GLN 6 -0.466 12.178 -3.047 37 H ILE 7 H ILE 7 3.616 8.648 -6.949 38 HA ILE 7 HA ILE 7 5.684 10.354 -5.949 39 HB ILE 7 HB ILE 7 5.862 8.233 -8.075 40 HG12 ILE 7 HG12 ILE 7 6.509 7.785 -5.178 41 HG13 ILE 7 HG13 ILE 7 4.959 7.346 -5.887 42 HG21 ILE 7 HG21 ILE 7 7.866 9.635 -8.061 43 HG22 ILE 7 HG22 ILE 7 7.898 9.661 -6.282 44 HG23 ILE 7 HG23 ILE 7 8.324 8.189 -7.166 45 HD11 ILE 7 HD11 ILE 7 5.793 5.589 -7.097 46 HD12 ILE 7 HD12 ILE 7 7.374 6.316 -7.356 47 HD13 ILE 7 HD13 ILE 7 7.023 5.625 -5.799 48 H VAL 8 H VAL 8 4.106 10.061 -9.149 49 HA VAL 8 HA VAL 8 5.978 11.777 -10.509 50 HB VAL 8 HB VAL 8 3.085 11.000 -11.092 51 HG11 VAL 8 HG11 VAL 8 5.049 12.521 -12.871 52 HG12 VAL 8 HG12 VAL 8 3.564 11.733 -13.457 53 HG13 VAL 8 HG13 VAL 8 3.452 13.061 -12.309 54 HG21 VAL 8 HG21 VAL 8 4.144 9.596 -12.842 55 HG22 VAL 8 HG22 VAL 8 5.741 10.084 -12.243 56 HG23 VAL 8 HG23 VAL 8 4.662 9.121 -11.220 57 H ASP 9 H ASP 9 2.858 12.413 -8.806 58 HA ASP 9 HA ASP 9 2.802 15.143 -9.571 59 HB2 ASP 9 HB2 ASP 9 0.917 13.641 -8.641 60 HB3 ASP 9 HB3 ASP 9 1.541 14.063 -7.045 61 H GLU 10 H GLU 10 3.866 13.611 -6.463 62 HA GLU 10 HA GLU 10 4.679 16.069 -5.332 63 HB2 GLU 10 HB2 GLU 10 5.966 14.785 -3.719 64 HB3 GLU 10 HB3 GLU 10 4.385 14.042 -4.004 65 HG2 GLU 10 HG2 GLU 10 5.496 12.481 -5.584 66 HG3 GLU 10 HG3 GLU 10 7.046 13.150 -5.212 67 H ALA 11 H ALA 11 6.291 14.096 -7.760 68 HA ALA 11 HA ALA 11 8.920 15.268 -7.351 69 HB1 ALA 11 HB1 ALA 11 9.467 14.193 -9.527 70 HB2 ALA 11 HB2 ALA 11 8.622 13.048 -8.462 71 HB3 ALA 11 HB3 ALA 11 7.762 13.836 -9.808 72 H LEU 12 H LEU 12 6.146 15.715 -9.558 73 HA LEU 12 HA LEU 12 7.194 17.839 -11.114 74 HB2 LEU 12 HB2 LEU 12 4.380 16.942 -10.423 75 HB3 LEU 12 HB3 LEU 12 4.661 18.315 -11.480 76 HG LEU 12 HG LEU 12 5.923 15.597 -12.065 77 HD11 LEU 12 HD11 LEU 12 3.445 15.391 -11.969 78 HD12 LEU 12 HD12 LEU 12 4.096 15.163 -13.594 79 HD13 LEU 12 HD13 LEU 12 3.302 16.701 -13.154 80 HD21 LEU 12 HD21 LEU 12 6.005 16.483 -14.372 81 HD22 LEU 12 HD22 LEU 12 6.925 17.504 -13.267 82 HD23 LEU 12 HD23 LEU 12 5.308 18.013 -13.814 83 H GLU 13 H GLU 13 5.554 17.776 -7.973 84 HA GLU 13 HA GLU 13 5.014 20.531 -7.703 85 HB2 GLU 13 HB2 GLU 13 5.694 18.370 -5.701 86 HB3 GLU 13 HB3 GLU 13 5.409 20.032 -5.204 87 HG2 GLU 13 HG2 GLU 13 3.126 19.821 -6.406 88 HG3 GLU 13 HG3 GLU 13 3.415 18.078 -6.361 89 H GLN 14 H GLN 14 8.075 18.825 -7.535 90 HA GLN 14 HA GLN 14 9.438 21.154 -6.273 91 HB2 GLN 14 HB2 GLN 14 10.999 18.861 -7.303 92 HB3 GLN 14 HB3 GLN 14 11.218 19.769 -5.830 93 HG2 GLN 14 HG2 GLN 14 9.228 17.546 -6.286 94 HG3 GLN 14 HG3 GLN 14 10.748 17.428 -5.439 95 HE21 GLN 14 HE21 GLN 14 9.100 16.526 -3.826 96 HE22 GLN 14 HE22 GLN 14 8.584 17.636 -2.593 97 H GLY 15 H GLY 15 8.475 20.098 -9.306 98 HA2 GLY 15 HA2 GLY 15 8.785 21.294 -11.313 99 HA3 GLY 15 HA3 GLY 15 10.375 21.843 -10.766 100 H ILE 16 H ILE 16 9.785 18.439 -10.174 101 HA ILE 16 HA ILE 16 11.599 17.846 -12.404 102 HB ILE 16 HB ILE 16 10.870 16.054 -10.079 103 HG12 ILE 16 HG12 ILE 16 13.639 17.100 -10.107 104 HG13 ILE 16 HG13 ILE 16 12.478 18.381 -9.858 105 HG21 ILE 16 HG21 ILE 16 11.645 14.803 -11.986 106 HG22 ILE 16 HG22 ILE 16 12.993 15.928 -12.264 107 HG23 ILE 16 HG23 ILE 16 12.981 14.870 -10.850 108 HD11 ILE 16 HD11 ILE 16 11.426 16.935 -8.037 109 HD12 ILE 16 HD12 ILE 16 12.851 15.896 -8.164 110 HD13 ILE 16 HD13 ILE 16 13.047 17.600 -7.711 111 H THR 17 H THR 17 10.837 17.189 -14.213 112 HA THR 17 HA THR 17 8.187 16.014 -14.492 113 HB THR 17 HB THR 17 10.439 17.054 -16.233 114 HG1 THR 17 HG1 THR 17 9.098 18.626 -16.523 115 HG21 THR 17 HG21 THR 17 8.019 15.557 -17.277 116 HG22 THR 17 HG22 THR 17 9.725 15.083 -17.421 117 HG23 THR 17 HG23 THR 17 9.171 16.543 -18.248 118 H LEU 18 H LEU 18 7.743 13.895 -14.680 119 HA LEU 18 HA LEU 18 9.999 11.980 -15.022 120 HB2 LEU 18 HB2 LEU 18 7.236 11.616 -13.784 121 HB3 LEU 18 HB3 LEU 18 8.299 10.319 -14.192 122 HG LEU 18 HG LEU 18 8.371 12.182 -11.874 123 HD11 LEU 18 HD11 LEU 18 9.342 10.119 -10.834 124 HD12 LEU 18 HD12 LEU 18 9.390 9.359 -12.460 125 HD13 LEU 18 HD13 LEU 18 7.846 9.789 -11.728 126 HD21 LEU 18 HD21 LEU 18 10.800 11.996 -11.493 127 HD22 LEU 18 HD22 LEU 18 10.466 12.925 -12.962 128 HD23 LEU 18 HD23 LEU 18 10.985 11.224 -13.092 129 H PHE 19 H PHE 19 9.922 10.428 -16.526 130 HA PHE 19 HA PHE 19 7.687 9.924 -18.296 131 HB2 PHE 19 HB2 PHE 19 8.696 10.809 -20.345 132 HB3 PHE 19 HB3 PHE 19 8.281 12.073 -19.237 133 HD1 PHE 19 HD1 PHE 19 10.751 10.998 -21.479 134 HD2 PHE 19 HD2 PHE 19 10.464 12.773 -17.538 135 HE1 PHE 19 HE1 PHE 19 12.815 12.319 -21.868 136 HE2 PHE 19 HE2 PHE 19 12.486 14.046 -17.967 137 HZ PHE 19 HZ PHE 19 13.690 13.835 -20.120 138 H VAL 20 H VAL 20 8.584 8.470 -20.208 139 HA VAL 20 HA VAL 20 10.955 6.920 -19.313 140 HB VAL 20 HB VAL 20 8.478 5.658 -20.556 141 HG11 VAL 20 HG11 VAL 20 10.827 4.423 -19.090 142 HG12 VAL 20 HG12 VAL 20 9.507 3.596 -19.964 143 HG13 VAL 20 HG13 VAL 20 10.690 4.550 -20.856 144 HG21 VAL 20 HG21 VAL 20 7.830 4.870 -18.405 145 HG22 VAL 20 HG22 VAL 20 9.284 5.564 -17.617 146 HG23 VAL 20 HG23 VAL 20 7.994 6.595 -18.254 147 H VAL 21 H VAL 21 12.520 7.340 -20.780 148 HA VAL 21 HA VAL 21 11.781 7.635 -23.664 149 HB VAL 21 HB VAL 21 14.332 8.244 -22.123 150 HG11 VAL 21 HG11 VAL 21 13.722 8.517 -25.100 151 HG12 VAL 21 HG12 VAL 21 15.173 9.170 -24.295 152 HG13 VAL 21 HG13 VAL 21 14.928 7.428 -24.404 153 HG21 VAL 21 HG21 VAL 21 13.858 10.547 -22.875 154 HG22 VAL 21 HG22 VAL 21 12.309 10.003 -23.554 155 HG23 VAL 21 HG23 VAL 21 12.627 9.866 -21.808 156 H ASN 22 H ASN 22 11.782 5.780 -24.794 157 HA ASN 22 HA ASN 22 12.146 3.627 -25.373 158 HB2 ASN 22 HB2 ASN 22 15.045 4.378 -24.921 159 HB3 ASN 22 HB3 ASN 22 14.457 3.034 -25.897 160 HD21 ASN 22 HD21 ASN 22 15.465 6.280 -26.129 161 HD22 ASN 22 HD22 ASN 22 14.590 6.694 -27.579 162 H ASN 23 H ASN 23 11.144 3.412 -22.969 163 HA ASN 23 HA ASN 23 10.871 2.123 -21.203 164 HB2 ASN 23 HB2 ASN 23 11.411 0.417 -22.919 165 HB3 ASN 23 HB3 ASN 23 13.076 0.394 -22.343 166 HD21 ASN 23 HD21 ASN 23 9.703 0.242 -20.893 167 HD22 ASN 23 HD22 ASN 23 10.061 -1.164 -19.982 168 H ARG 24 H ARG 24 13.487 4.105 -21.309 169 HA ARG 24 HA ARG 24 14.770 3.166 -18.801 170 HB2 ARG 24 HB2 ARG 24 15.421 5.563 -20.603 171 HB3 ARG 24 HB3 ARG 24 16.366 4.990 -19.236 172 HG2 ARG 24 HG2 ARG 24 15.921 3.487 -21.854 173 HG3 ARG 24 HG3 ARG 24 17.354 4.408 -21.371 174 HD2 ARG 24 HD2 ARG 24 17.487 2.846 -19.334 175 HD3 ARG 24 HD3 ARG 24 16.290 1.847 -20.175 176 HE ARG 24 HE ARG 24 17.905 1.081 -21.557 177 HH11 ARG 24 HH11 ARG 24 19.211 4.180 -20.230 178 HH12 ARG 24 HH12 ARG 24 20.743 3.928 -21.006 179 HH21 ARG 24 HH21 ARG 24 19.974 0.864 -22.461 180 HH22 ARG 24 HH22 ARG 24 21.146 2.148 -22.295 181 H LEU 25 H LEU 25 14.222 4.172 -16.864 182 HA LEU 25 HA LEU 25 12.116 6.220 -16.920 183 HB2 LEU 25 HB2 LEU 25 12.260 4.398 -15.160 184 HB3 LEU 25 HB3 LEU 25 13.710 5.137 -14.505 185 HG LEU 25 HG LEU 25 11.064 6.557 -14.879 186 HD11 LEU 25 HD11 LEU 25 12.052 5.393 -12.260 187 HD12 LEU 25 HD12 LEU 25 10.825 4.652 -13.328 188 HD13 LEU 25 HD13 LEU 25 10.508 6.212 -12.590 189 HD21 LEU 25 HD21 LEU 25 11.707 8.108 -13.064 190 HD22 LEU 25 HD22 LEU 25 12.708 8.305 -14.469 191 HD23 LEU 25 HD23 LEU 25 13.341 7.403 -13.050 192 H GLN 26 H GLN 26 12.755 8.421 -17.314 193 HA GLN 26 HA GLN 26 15.273 9.263 -16.018 194 HB2 GLN 26 HB2 GLN 26 14.753 10.467 -18.688 195 HB3 GLN 26 HB3 GLN 26 16.253 10.149 -17.841 196 HG2 GLN 26 HG2 GLN 26 15.871 7.651 -18.353 197 HG3 GLN 26 HG3 GLN 26 14.578 8.183 -19.450 198 HE21 GLN 26 HE21 GLN 26 15.647 10.352 -20.810 199 HE22 GLN 26 HE22 GLN 26 17.047 9.825 -21.685 200 H TYR 27 H TYR 27 15.281 11.807 -16.105 201 HA TYR 27 HA TYR 27 12.597 12.937 -15.911 202 HB2 TYR 27 HB2 TYR 27 13.019 13.858 -13.659 203 HB3 TYR 27 HB3 TYR 27 12.846 12.111 -13.678 204 HD1 TYR 27 HD1 TYR 27 14.672 10.638 -13.316 205 HD2 TYR 27 HD2 TYR 27 15.173 14.910 -13.048 206 HE1 TYR 27 HE1 TYR 27 16.862 10.314 -12.112 207 HE2 TYR 27 HE2 TYR 27 17.303 14.617 -11.824 208 HH TYR 27 HH TYR 27 18.741 13.082 -10.800 209 H GLU 28 H GLU 28 12.682 15.248 -15.637 210 HA GLU 28 HA GLU 28 15.226 16.546 -16.428 211 HB2 GLU 28 HB2 GLU 28 14.078 16.004 -18.465 212 HB3 GLU 28 HB3 GLU 28 12.530 16.579 -17.830 213 HG2 GLU 28 HG2 GLU 28 13.293 18.844 -17.787 214 HG3 GLU 28 HG3 GLU 28 14.953 18.361 -18.267 215 H THR 29 H THR 29 15.498 18.548 -15.406 216 HA THR 29 HA THR 29 13.256 20.046 -14.433 217 HB THR 29 HB THR 29 13.519 18.185 -12.745 218 HG1 THR 29 HG1 THR 29 12.587 20.134 -12.179 219 HG21 THR 29 HG21 THR 29 16.111 19.535 -11.978 220 HG22 THR 29 HG22 THR 29 15.960 17.934 -12.752 221 HG23 THR 29 HG23 THR 29 15.280 18.212 -11.146 222 H SER 30 H SER 30 14.016 22.103 -13.435 223 HA SER 30 HA SER 30 16.808 22.871 -14.162 224 HB2 SER 30 HB2 SER 30 14.306 24.554 -14.424 225 HB3 SER 30 HB3 SER 30 15.928 24.981 -14.944 226 HG SER 30 HG SER 30 13.985 23.632 -16.224 227 H ARG 31 H ARG 31 17.146 22.229 -11.835 228 HA ARG 31 HA ARG 31 16.904 24.539 -10.154 229 HB2 ARG 31 HB2 ARG 31 15.630 23.553 -8.325 230 HB3 ARG 31 HB3 ARG 31 14.655 23.674 -9.755 231 HG2 ARG 31 HG2 ARG 31 14.840 21.321 -10.217 232 HG3 ARG 31 HG3 ARG 31 16.065 21.065 -8.971 233 HD2 ARG 31 HD2 ARG 31 13.337 22.198 -8.367 234 HD3 ARG 31 HD3 ARG 31 13.630 20.448 -8.388 235 HE ARG 31 HE ARG 31 15.602 21.461 -6.696 236 HH11 ARG 31 HH11 ARG 31 12.089 22.053 -6.769 237 HH12 ARG 31 HH12 ARG 31 11.950 22.215 -5.087 238 HH21 ARG 31 HH21 ARG 31 15.330 21.295 -4.375 239 HH22 ARG 31 HH22 ARG 31 13.758 21.609 -3.714 240 H ASP 32 H ASP 32 17.508 23.685 -7.788 241 HA ASP 32 HA ASP 32 19.735 21.758 -7.853 242 HB2 ASP 32 HB2 ASP 32 21.056 23.242 -6.512 243 HB3 ASP 32 HB3 ASP 32 20.563 24.125 -7.954 244 H SER 33 H SER 33 20.246 21.468 -5.315 245 HA SER 33 HA SER 33 19.566 20.243 -3.567 246 HB2 SER 33 HB2 SER 33 19.287 22.794 -3.091 247 HB3 SER 33 HB3 SER 33 17.558 22.429 -3.041 248 HG SER 33 HG SER 33 19.709 21.471 -1.473 249 H ILE 34 H ILE 34 18.456 18.926 -5.633 250 HA ILE 34 HA ILE 34 15.580 18.695 -5.476 251 HB ILE 34 HB ILE 34 17.770 16.853 -6.491 252 HG12 ILE 34 HG12 ILE 34 15.440 18.205 -7.942 253 HG13 ILE 34 HG13 ILE 34 17.035 18.922 -7.768 254 HG21 ILE 34 HG21 ILE 34 14.792 16.152 -6.610 255 HG22 ILE 34 HG22 ILE 34 16.119 15.249 -7.358 256 HG23 ILE 34 HG23 ILE 34 15.975 15.312 -5.610 257 HD11 ILE 34 HD11 ILE 34 17.048 17.923 -9.892 258 HD12 ILE 34 HD12 ILE 34 17.983 16.813 -8.880 259 HD13 ILE 34 HD13 ILE 34 16.289 16.433 -9.315 260 HA PRO 35 HA PRO 35 15.395 16.590 -1.532 261 HB2 PRO 35 HB2 PRO 35 13.019 15.235 -1.831 262 HB3 PRO 35 HB3 PRO 35 13.173 16.982 -1.446 263 HG2 PRO 35 HG2 PRO 35 12.659 15.713 -4.135 264 HG3 PRO 35 HG3 PRO 35 11.851 17.124 -3.374 265 HD2 PRO 35 HD2 PRO 35 13.817 17.439 -5.188 266 HD3 PRO 35 HD3 PRO 35 13.718 18.510 -3.765 267 H THR 36 H THR 36 17.127 15.102 -1.611 268 HA THR 36 HA THR 36 17.413 13.009 -3.447 269 HB THR 36 HB THR 36 18.582 13.082 -0.657 270 HG1 THR 36 HG1 THR 36 19.927 14.601 -1.311 271 HG21 THR 36 HG21 THR 36 19.154 11.081 -2.061 272 HG22 THR 36 HG22 THR 36 20.557 12.106 -1.751 273 HG23 THR 36 HG23 THR 36 19.746 12.164 -3.335 274 H GLU 37 H GLU 37 15.515 13.085 -0.480 275 HA GLU 37 HA GLU 37 15.181 10.263 -0.152 276 HB2 GLU 37 HB2 GLU 37 13.386 10.923 1.364 277 HB3 GLU 37 HB3 GLU 37 14.810 11.938 1.586 278 HG2 GLU 37 HG2 GLU 37 13.547 13.572 -0.114 279 HG3 GLU 37 HG3 GLU 37 12.121 12.661 0.389 280 H LEU 38 H LEU 38 13.691 12.634 -2.277 281 HA LEU 38 HA LEU 38 11.425 10.935 -3.080 282 HB2 LEU 38 HB2 LEU 38 11.628 13.566 -2.764 283 HB3 LEU 38 HB3 LEU 38 12.285 13.518 -4.397 284 HG LEU 38 HG LEU 38 9.547 12.467 -3.534 285 HD11 LEU 38 HD11 LEU 38 10.350 15.019 -5.026 286 HD12 LEU 38 HD12 LEU 38 9.820 14.913 -3.321 287 HD13 LEU 38 HD13 LEU 38 8.695 14.515 -4.617 288 HD21 LEU 38 HD21 LEU 38 10.284 11.316 -5.560 289 HD22 LEU 38 HD22 LEU 38 10.761 12.878 -6.287 290 HD23 LEU 38 HD23 LEU 38 9.050 12.508 -5.988 291 H LEU 39 H LEU 39 14.503 12.261 -4.266 292 HA LEU 39 HA LEU 39 14.642 11.272 -6.861 293 HB2 LEU 39 HB2 LEU 39 16.195 12.779 -5.328 294 HB3 LEU 39 HB3 LEU 39 17.059 11.270 -5.027 295 HG LEU 39 HG LEU 39 16.598 12.658 -7.687 296 HD11 LEU 39 HD11 LEU 39 19.082 12.329 -5.957 297 HD12 LEU 39 HD12 LEU 39 18.167 13.822 -6.230 298 HD13 LEU 39 HD13 LEU 39 19.035 13.088 -7.577 299 HD21 LEU 39 HD21 LEU 39 18.172 10.112 -7.087 300 HD22 LEU 39 HD22 LEU 39 18.247 11.030 -8.617 301 HD23 LEU 39 HD23 LEU 39 16.736 10.277 -8.137 302 H ASN 40 H ASN 40 15.553 9.770 -3.834 303 HA ASN 40 HA ASN 40 16.423 7.201 -4.815 304 HB2 ASN 40 HB2 ASN 40 15.579 8.219 -2.084 305 HB3 ASN 40 HB3 ASN 40 15.722 6.492 -2.358 306 HD21 ASN 40 HD21 ASN 40 17.538 9.377 -1.813 307 HD22 ASN 40 HD22 ASN 40 19.089 8.576 -1.737 308 H LYS 41 H LYS 41 13.197 8.466 -3.909 309 HA LYS 41 HA LYS 41 11.893 5.929 -3.775 310 HB2 LYS 41 HB2 LYS 41 11.012 8.035 -2.823 311 HB3 LYS 41 HB3 LYS 41 10.713 8.674 -4.450 312 HG2 LYS 41 HG2 LYS 41 9.020 7.128 -4.908 313 HG3 LYS 41 HG3 LYS 41 9.605 6.022 -3.647 314 HD2 LYS 41 HD2 LYS 41 7.508 7.038 -2.994 315 HD3 LYS 41 HD3 LYS 41 8.834 7.458 -1.893 316 HE2 LYS 41 HE2 LYS 41 9.033 9.665 -3.236 317 HE3 LYS 41 HE3 LYS 41 7.479 9.217 -3.975 318 HZ1 LYS 41 HZ1 LYS 41 6.773 8.979 -1.514 319 HZ2 LYS 41 HZ2 LYS 41 6.827 10.436 -2.257 320 HZ3 LYS 41 HZ3 LYS 41 8.058 10.011 -1.240 321 H TRP 42 H TRP 42 12.657 8.117 -6.457 322 HA TRP 42 HA TRP 42 11.096 6.840 -8.428 323 HB2 TRP 42 HB2 TRP 42 13.799 8.115 -8.849 324 HB3 TRP 42 HB3 TRP 42 12.571 7.800 -10.089 325 HD1 TRP 42 HD1 TRP 42 10.173 9.049 -8.061 326 HE1 TRP 42 HE1 TRP 42 9.994 11.592 -7.990 327 HE3 TRP 42 HE3 TRP 42 14.836 10.192 -9.765 328 HZ2 TRP 42 HZ2 TRP 42 11.800 13.856 -8.279 329 HZ3 TRP 42 HZ3 TRP 42 15.618 12.560 -9.785 330 HH2 TRP 42 HH2 TRP 42 14.166 14.361 -8.969 331 H LYS 43 H LYS 43 14.551 6.212 -7.577 332 HA LYS 43 HA LYS 43 14.762 4.031 -9.453 333 HB2 LYS 43 HB2 LYS 43 16.814 3.379 -8.181 334 HB3 LYS 43 HB3 LYS 43 16.796 5.037 -8.784 335 HG2 LYS 43 HG2 LYS 43 16.317 5.938 -6.628 336 HG3 LYS 43 HG3 LYS 43 16.117 4.318 -5.914 337 HD2 LYS 43 HD2 LYS 43 18.741 5.333 -7.061 338 HD3 LYS 43 HD3 LYS 43 18.255 5.482 -5.369 339 HE2 LYS 43 HE2 LYS 43 17.894 2.942 -5.351 340 HE3 LYS 43 HE3 LYS 43 18.703 2.908 -6.924 341 HZ1 LYS 43 HZ1 LYS 43 20.318 2.514 -5.243 342 HZ2 LYS 43 HZ2 LYS 43 19.862 3.815 -4.354 343 HZ3 LYS 43 HZ3 LYS 43 20.605 4.008 -5.819 344 H GLN 44 H GLN 44 13.734 4.205 -6.051 345 HA GLN 44 HA GLN 44 13.738 1.478 -5.443 346 HB2 GLN 44 HB2 GLN 44 13.354 3.273 -3.779 347 HB3 GLN 44 HB3 GLN 44 11.832 3.683 -4.554 348 HG2 GLN 44 HG2 GLN 44 11.169 2.484 -2.704 349 HG3 GLN 44 HG3 GLN 44 10.998 1.331 -4.006 350 HE21 GLN 44 HE21 GLN 44 12.227 1.666 -0.917 351 HE22 GLN 44 HE22 GLN 44 13.483 0.427 -0.958 352 H HIS 45 H HIS 45 11.093 3.452 -6.877 353 HA HIS 45 HA HIS 45 9.628 0.958 -7.575 354 HB2 HIS 45 HB2 HIS 45 8.666 3.828 -7.362 355 HB3 HIS 45 HB3 HIS 45 7.674 2.379 -7.547 356 HD1 HIS 45 HD1 HIS 45 7.898 0.580 -5.396 357 HD2 HIS 45 HD2 HIS 45 9.134 4.552 -4.950 358 HE1 HIS 45 HE1 HIS 45 7.917 1.054 -2.872 359 H LYS 46 H LYS 46 11.875 1.839 -9.191 360 HA LYS 46 HA LYS 46 11.311 3.394 -11.372 361 HB2 LYS 46 HB2 LYS 46 13.509 2.240 -10.844 362 HB3 LYS 46 HB3 LYS 46 12.846 0.779 -11.582 363 HG2 LYS 46 HG2 LYS 46 12.424 2.292 -13.651 364 HG3 LYS 46 HG3 LYS 46 13.369 3.516 -12.825 365 HD2 LYS 46 HD2 LYS 46 14.689 2.330 -14.527 366 HD3 LYS 46 HD3 LYS 46 15.351 2.140 -12.908 367 HE2 LYS 46 HE2 LYS 46 15.499 0.027 -14.090 368 HE3 LYS 46 HE3 LYS 46 14.393 -0.089 -12.724 369 HZ1 LYS 46 HZ1 LYS 46 13.360 -1.194 -14.438 370 HZ2 LYS 46 HZ2 LYS 46 13.694 -0.073 -15.596 371 HZ3 LYS 46 HZ3 LYS 46 12.571 0.224 -14.420 372 H GLN 47 H GLN 47 10.614 -0.184 -11.335 373 HA GLN 47 HA GLN 47 9.387 0.016 -13.936 374 HB2 GLN 47 HB2 GLN 47 10.036 -2.100 -12.140 375 HB3 GLN 47 HB3 GLN 47 8.320 -2.256 -12.496 376 HG2 GLN 47 HG2 GLN 47 10.293 -1.755 -14.751 377 HG3 GLN 47 HG3 GLN 47 10.144 -3.358 -14.030 378 HE21 GLN 47 HE21 GLN 47 7.491 -0.943 -14.902 379 HE22 GLN 47 HE22 GLN 47 6.792 -2.025 -16.072 380 H GLU 48 H GLU 48 8.039 0.224 -10.729 381 HA GLU 48 HA GLU 48 5.286 0.123 -11.466 382 HB2 GLU 48 HB2 GLU 48 6.278 1.735 -9.097 383 HB3 GLU 48 HB3 GLU 48 4.761 0.848 -9.277 384 HG2 GLU 48 HG2 GLU 48 6.140 -1.308 -9.367 385 HG3 GLU 48 HG3 GLU 48 7.564 -0.314 -9.016 386 H LEU 49 H LEU 49 7.587 2.810 -11.277 387 HA LEU 49 HA LEU 49 5.709 4.922 -11.943 388 HB2 LEU 49 HB2 LEU 49 8.745 4.673 -12.150 389 HB3 LEU 49 HB3 LEU 49 7.888 6.133 -12.585 390 HG LEU 49 HG LEU 49 7.406 4.947 -9.841 391 HD11 LEU 49 HD11 LEU 49 9.883 5.058 -10.300 392 HD12 LEU 49 HD12 LEU 49 9.277 6.016 -8.939 393 HD13 LEU 49 HD13 LEU 49 9.699 6.814 -10.490 394 HD21 LEU 49 HD21 LEU 49 5.985 6.811 -10.305 395 HD22 LEU 49 HD22 LEU 49 7.282 7.698 -11.133 396 HD23 LEU 49 HD23 LEU 49 7.347 7.490 -9.394 397 H ILE 50 H ILE 50 8.144 3.022 -13.787 398 HA ILE 50 HA ILE 50 7.691 4.316 -16.250 399 HB ILE 50 HB ILE 50 8.400 1.412 -15.702 400 HG12 ILE 50 HG12 ILE 50 10.330 3.460 -16.847 401 HG13 ILE 50 HG13 ILE 50 10.038 3.464 -15.109 402 HG21 ILE 50 HG21 ILE 50 7.539 1.254 -17.837 403 HG22 ILE 50 HG22 ILE 50 8.308 2.748 -18.369 404 HG23 ILE 50 HG23 ILE 50 9.290 1.294 -18.067 405 HD11 ILE 50 HD11 ILE 50 12.027 2.094 -15.818 406 HD12 ILE 50 HD12 ILE 50 10.827 1.188 -14.870 407 HD13 ILE 50 HD13 ILE 50 10.940 0.965 -16.625 408 H ASP 51 H ASP 51 6.083 1.444 -14.888 409 HA ASP 51 HA ASP 51 4.465 0.923 -17.070 410 HB2 ASP 51 HB2 ASP 51 4.853 -0.350 -14.815 411 HB3 ASP 51 HB3 ASP 51 3.497 0.609 -14.217 412 H PHE 52 H PHE 52 4.034 3.246 -14.496 413 HA PHE 52 HA PHE 52 1.337 4.009 -15.135 414 HB2 PHE 52 HB2 PHE 52 2.201 4.250 -12.933 415 HB3 PHE 52 HB3 PHE 52 3.523 5.258 -13.472 416 HD1 PHE 52 HD1 PHE 52 3.373 7.485 -13.001 417 HD2 PHE 52 HD2 PHE 52 -0.244 5.330 -13.919 418 HE1 PHE 52 HE1 PHE 52 2.009 9.563 -12.619 419 HE2 PHE 52 HE2 PHE 52 -1.548 7.439 -13.657 420 HZ PHE 52 HZ PHE 52 -0.366 9.552 -12.960 421 H LEU 53 H LEU 53 4.524 5.625 -15.715 422 HA LEU 53 HA LEU 53 3.506 7.821 -17.211 423 HB2 LEU 53 HB2 LEU 53 6.189 6.440 -16.942 424 HB3 LEU 53 HB3 LEU 53 5.956 7.665 -18.178 425 HG LEU 53 HG LEU 53 7.037 8.692 -16.362 426 HD11 LEU 53 HD11 LEU 53 5.229 10.011 -17.514 427 HD12 LEU 53 HD12 LEU 53 5.549 10.540 -15.848 428 HD13 LEU 53 HD13 LEU 53 4.121 9.552 -16.209 429 HD21 LEU 53 HD21 LEU 53 6.365 7.228 -14.470 430 HD22 LEU 53 HD22 LEU 53 4.751 7.926 -14.557 431 HD23 LEU 53 HD23 LEU 53 6.142 8.940 -14.134 432 H ASN 54 H ASN 54 4.296 4.485 -18.110 433 HA ASN 54 HA ASN 54 4.265 5.060 -20.957 434 HB2 ASN 54 HB2 ASN 54 5.270 2.955 -19.523 435 HB3 ASN 54 HB3 ASN 54 3.756 2.257 -20.052 436 HD21 ASN 54 HD21 ASN 54 6.957 3.013 -20.847 437 HD22 ASN 54 HD22 ASN 54 6.857 2.989 -22.606 438 H GLN 55 H GLN 55 1.940 3.513 -18.617 439 HA GLN 55 HA GLN 55 -0.010 3.300 -20.649 440 HB2 GLN 55 HB2 GLN 55 -1.571 2.574 -18.979 441 HB3 GLN 55 HB3 GLN 55 0.005 1.846 -18.721 442 HG2 GLN 55 HG2 GLN 55 -0.614 2.374 -16.560 443 HG3 GLN 55 HG3 GLN 55 0.404 3.708 -17.001 444 HE21 GLN 55 HE21 GLN 55 -0.325 5.730 -16.720 445 HE22 GLN 55 HE22 GLN 55 -2.006 6.210 -16.506 446 H LEU 56 H LEU 56 1.057 6.104 -19.119 447 HA LEU 56 HA LEU 56 -1.465 7.615 -19.072 448 HB2 LEU 56 HB2 LEU 56 0.204 8.202 -17.464 449 HB3 LEU 56 HB3 LEU 56 1.466 8.259 -18.681 450 HG LEU 56 HG LEU 56 0.460 10.302 -19.664 451 HD11 LEU 56 HD11 LEU 56 -1.244 11.561 -18.439 452 HD12 LEU 56 HD12 LEU 56 -1.352 10.310 -17.200 453 HD13 LEU 56 HD13 LEU 56 -1.921 9.988 -18.865 454 HD21 LEU 56 HD21 LEU 56 2.251 10.330 -17.929 455 HD22 LEU 56 HD22 LEU 56 0.994 10.630 -16.716 456 HD23 LEU 56 HD23 LEU 56 1.262 11.805 -18.021 457 H ASP 57 H ASP 57 1.370 7.257 -21.199 458 HA ASP 57 HA ASP 57 0.188 9.248 -23.091 459 HB2 ASP 57 HB2 ASP 57 2.444 9.580 -21.931 460 HB3 ASP 57 HB3 ASP 57 3.054 8.304 -22.975 461 H SER 58 H SER 58 1.790 6.017 -22.997 462 HA SER 58 HA SER 58 1.191 5.599 -25.830 463 HB2 SER 58 HB2 SER 58 2.500 3.720 -23.847 464 HB3 SER 58 HB3 SER 58 2.654 3.737 -25.612 465 HG SER 58 HG SER 58 3.497 5.982 -25.251 466 H GLU 59 H GLU 59 -0.017 4.669 -22.731 467 HA GLU 59 HA GLU 59 -1.509 3.272 -21.888 468 HB2 GLU 59 HB2 GLU 59 -3.773 3.749 -22.499 469 HB3 GLU 59 HB3 GLU 59 -2.745 5.173 -22.383 470 HG2 GLU 59 HG2 GLU 59 -2.592 5.284 -24.854 471 HG3 GLU 59 HG3 GLU 59 -3.661 3.878 -24.959 472 H GLU 60 H GLU 60 -0.354 1.996 -24.703 473 HA GLU 60 HA GLU 60 -2.108 -0.188 -25.028 474 HB2 GLU 60 HB2 GLU 60 -0.979 0.737 -26.864 475 HB3 GLU 60 HB3 GLU 60 0.600 0.706 -26.056 476 HG2 GLU 60 HG2 GLU 60 0.737 -1.619 -26.125 477 HG3 GLU 60 HG3 GLU 60 -0.967 -1.805 -26.605 478 H GLN 61 H GLN 61 0.900 0.238 -23.082 479 HA GLN 61 HA GLN 61 0.688 -2.663 -22.402 480 HB2 GLN 61 HB2 GLN 61 3.057 -2.738 -22.162 481 HB3 GLN 61 HB3 GLN 61 2.615 -2.181 -23.772 482 HG2 GLN 61 HG2 GLN 61 3.094 0.208 -22.803 483 HG3 GLN 61 HG3 GLN 61 3.918 -0.656 -21.500 484 HE21 GLN 61 HE21 GLN 61 4.873 1.119 -23.779 485 HE22 GLN 61 HE22 GLN 61 6.011 0.155 -24.721 486 H THR 62 H THR 62 1.272 -3.386 -20.361 487 HA THR 62 HA THR 62 1.818 -1.744 -18.148 488 HB THR 62 HB THR 62 -0.422 -0.964 -18.279 489 HG1 THR 62 HG1 THR 62 0.497 -1.536 -16.230 490 HG21 THR 62 HG21 THR 62 -1.405 -3.843 -18.104 491 HG22 THR 62 HG22 THR 62 -1.489 -2.825 -19.565 492 HG23 THR 62 HG23 THR 62 -2.375 -2.367 -18.103 493 H LYS 63 H LYS 63 2.830 -3.120 -16.656 494 HA LYS 63 HA LYS 63 2.100 -5.961 -16.532 495 HB2 LYS 63 HB2 LYS 63 4.975 -5.106 -17.117 496 HB3 LYS 63 HB3 LYS 63 4.462 -6.697 -16.558 497 HG2 LYS 63 HG2 LYS 63 3.107 -6.960 -18.635 498 HG3 LYS 63 HG3 LYS 63 3.775 -5.425 -19.219 499 HD2 LYS 63 HD2 LYS 63 6.105 -6.472 -18.798 500 HD3 LYS 63 HD3 LYS 63 5.252 -8.019 -18.619 501 HE2 LYS 63 HE2 LYS 63 4.320 -7.655 -20.953 502 HE3 LYS 63 HE3 LYS 63 5.294 -6.174 -21.041 503 HZ1 LYS 63 HZ1 LYS 63 6.329 -8.908 -20.806 504 HZ2 LYS 63 HZ2 LYS 63 7.271 -7.560 -20.728 505 HZ3 LYS 63 HZ3 LYS 63 6.436 -7.932 -22.113 Start of MODEL 14 1 H1 GLY 1 H GLY 1 2.303 -1.598 -0.085 2 HA2 GLY 1 HA2 GLY 1 2.507 -0.920 -2.368 3 HA3 GLY 1 HA3 GLY 1 0.831 -0.592 -1.865 4 H ILE 2 H ILE 2 3.438 0.748 -3.434 5 HA ILE 2 HA ILE 2 3.066 3.583 -2.602 6 HB ILE 2 HB ILE 2 5.388 2.680 -2.867 7 HG12 ILE 2 HG12 ILE 2 6.388 4.129 -4.390 8 HG13 ILE 2 HG13 ILE 2 4.887 4.439 -5.249 9 HG21 ILE 2 HG21 ILE 2 4.269 1.418 -5.279 10 HG22 ILE 2 HG22 ILE 2 5.868 2.106 -5.490 11 HG23 ILE 2 HG23 ILE 2 5.589 0.915 -4.214 12 HD11 ILE 2 HD11 ILE 2 4.021 5.608 -3.178 13 HD12 ILE 2 HD12 ILE 2 5.601 5.302 -2.417 14 HD13 ILE 2 HD13 ILE 2 5.475 6.338 -3.841 15 H ASP 3 H ASP 3 2.676 5.214 -4.349 16 HA ASP 3 HA ASP 3 0.914 4.032 -6.418 17 HB2 ASP 3 HB2 ASP 3 0.879 6.638 -4.995 18 HB3 ASP 3 HB3 ASP 3 -0.120 6.241 -6.333 19 H ALA 4 H ALA 4 1.922 4.239 -8.215 20 HA ALA 4 HA ALA 4 4.313 5.752 -8.668 21 HB1 ALA 4 HB1 ALA 4 2.283 4.653 -10.651 22 HB2 ALA 4 HB2 ALA 4 3.900 5.281 -11.070 23 HB3 ALA 4 HB3 ALA 4 3.745 3.823 -10.068 24 H ALA 5 H ALA 5 0.866 6.484 -9.143 25 HA ALA 5 HA ALA 5 1.214 8.912 -10.623 26 HB1 ALA 5 HB1 ALA 5 -1.047 8.163 -8.684 27 HB2 ALA 5 HB2 ALA 5 -1.134 9.350 -10.003 28 HB3 ALA 5 HB3 ALA 5 -0.964 7.621 -10.367 29 H GLN 6 H GLN 6 1.087 8.234 -7.144 30 HA GLN 6 HA GLN 6 0.985 10.962 -6.248 31 HB2 GLN 6 HB2 GLN 6 1.978 8.386 -4.968 32 HB3 GLN 6 HB3 GLN 6 1.899 9.821 -4.068 33 HG2 GLN 6 HG2 GLN 6 -0.501 8.461 -5.388 34 HG3 GLN 6 HG3 GLN 6 -0.090 8.426 -3.679 35 HE21 GLN 6 HE21 GLN 6 -1.420 10.434 -6.309 36 HE22 GLN 6 HE22 GLN 6 -2.181 11.586 -5.240 37 H ILE 7 H ILE 7 3.734 8.694 -6.949 38 HA ILE 7 HA ILE 7 5.704 10.507 -6.043 39 HB ILE 7 HB ILE 7 5.918 8.341 -8.134 40 HG12 ILE 7 HG12 ILE 7 6.680 8.100 -5.213 41 HG13 ILE 7 HG13 ILE 7 5.119 7.583 -5.812 42 HG21 ILE 7 HG21 ILE 7 8.393 8.398 -7.293 43 HG22 ILE 7 HG22 ILE 7 7.876 9.806 -8.228 44 HG23 ILE 7 HG23 ILE 7 7.956 9.906 -6.458 45 HD11 ILE 7 HD11 ILE 7 7.657 6.451 -7.055 46 HD12 ILE 7 HD12 ILE 7 6.961 5.809 -5.596 47 HD13 ILE 7 HD13 ILE 7 6.005 5.816 -7.085 48 H VAL 8 H VAL 8 4.097 10.138 -9.243 49 HA VAL 8 HA VAL 8 5.871 11.958 -10.599 50 HB VAL 8 HB VAL 8 3.030 11.099 -11.259 51 HG11 VAL 8 HG11 VAL 8 3.624 13.222 -12.459 52 HG12 VAL 8 HG12 VAL 8 5.095 12.459 -13.063 53 HG13 VAL 8 HG13 VAL 8 3.504 11.841 -13.563 54 HG21 VAL 8 HG21 VAL 8 4.777 9.269 -11.218 55 HG22 VAL 8 HG22 VAL 8 4.085 9.565 -12.810 56 HG23 VAL 8 HG23 VAL 8 5.694 10.181 -12.422 57 H ASP 9 H ASP 9 2.810 12.327 -8.790 58 HA ASP 9 HA ASP 9 2.334 15.055 -9.426 59 HB2 ASP 9 HB2 ASP 9 0.716 13.408 -8.394 60 HB3 ASP 9 HB3 ASP 9 1.605 13.604 -6.868 61 H GLU 10 H GLU 10 3.932 13.619 -6.518 62 HA GLU 10 HA GLU 10 4.611 16.196 -5.497 63 HB2 GLU 10 HB2 GLU 10 5.973 15.015 -3.908 64 HB3 GLU 10 HB3 GLU 10 4.427 14.193 -4.119 65 HG2 GLU 10 HG2 GLU 10 5.533 12.560 -5.612 66 HG3 GLU 10 HG3 GLU 10 7.060 13.381 -5.366 67 H ALA 11 H ALA 11 6.256 14.107 -7.877 68 HA ALA 11 HA ALA 11 8.822 15.432 -7.607 69 HB1 ALA 11 HB1 ALA 11 9.354 14.406 -9.767 70 HB2 ALA 11 HB2 ALA 11 8.539 13.231 -8.724 71 HB3 ALA 11 HB3 ALA 11 7.636 14.025 -10.040 72 H LEU 12 H LEU 12 5.868 16.008 -9.522 73 HA LEU 12 HA LEU 12 6.909 18.204 -11.043 74 HB2 LEU 12 HB2 LEU 12 4.116 17.373 -10.242 75 HB3 LEU 12 HB3 LEU 12 4.404 18.728 -11.331 76 HG LEU 12 HG LEU 12 5.458 15.936 -11.933 77 HD11 LEU 12 HD11 LEU 12 2.979 17.273 -13.076 78 HD12 LEU 12 HD12 LEU 12 2.957 16.039 -11.809 79 HD13 LEU 12 HD13 LEU 12 3.592 15.627 -13.402 80 HD21 LEU 12 HD21 LEU 12 6.691 17.712 -13.086 81 HD22 LEU 12 HD22 LEU 12 5.169 18.408 -13.685 82 HD23 LEU 12 HD23 LEU 12 5.700 16.797 -14.215 83 H GLU 13 H GLU 13 5.575 18.033 -7.749 84 HA GLU 13 HA GLU 13 5.029 20.800 -7.389 85 HB2 GLU 13 HB2 GLU 13 5.804 18.558 -5.546 86 HB3 GLU 13 HB3 GLU 13 5.480 20.193 -4.975 87 HG2 GLU 13 HG2 GLU 13 3.204 20.034 -5.964 88 HG3 GLU 13 HG3 GLU 13 3.548 18.394 -6.456 89 H GLN 14 H GLN 14 8.023 18.864 -7.267 90 HA GLN 14 HA GLN 14 9.589 21.172 -6.283 91 HB2 GLN 14 HB2 GLN 14 11.036 18.925 -7.505 92 HB3 GLN 14 HB3 GLN 14 11.357 19.773 -6.020 93 HG2 GLN 14 HG2 GLN 14 9.384 17.515 -6.386 94 HG3 GLN 14 HG3 GLN 14 10.971 17.455 -5.630 95 HE21 GLN 14 HE21 GLN 14 7.799 17.502 -4.855 96 HE22 GLN 14 HE22 GLN 14 7.866 18.309 -3.306 97 H GLY 15 H GLY 15 8.421 20.154 -9.274 98 HA2 GLY 15 HA2 GLY 15 8.658 21.395 -11.310 99 HA3 GLY 15 HA3 GLY 15 10.228 21.993 -10.758 100 H ILE 16 H ILE 16 9.509 18.538 -10.359 101 HA ILE 16 HA ILE 16 11.454 17.991 -12.504 102 HB ILE 16 HB ILE 16 10.734 16.226 -10.166 103 HG12 ILE 16 HG12 ILE 16 13.514 17.291 -10.254 104 HG13 ILE 16 HG13 ILE 16 12.309 18.513 -9.882 105 HG21 ILE 16 HG21 ILE 16 11.473 14.914 -12.012 106 HG22 ILE 16 HG22 ILE 16 12.779 16.045 -12.411 107 HG23 ILE 16 HG23 ILE 16 12.870 15.051 -10.961 108 HD11 ILE 16 HD11 ILE 16 13.000 17.621 -7.797 109 HD12 ILE 16 HD12 ILE 16 11.383 16.939 -8.118 110 HD13 ILE 16 HD13 ILE 16 12.829 15.948 -8.352 111 H THR 17 H THR 17 10.713 17.289 -14.280 112 HA THR 17 HA THR 17 8.046 16.071 -14.536 113 HB THR 17 HB THR 17 10.318 17.053 -16.341 114 HG1 THR 17 HG1 THR 17 7.533 17.609 -16.311 115 HG21 THR 17 HG21 THR 17 9.029 16.312 -18.317 116 HG22 THR 17 HG22 THR 17 7.970 15.351 -17.241 117 HG23 THR 17 HG23 THR 17 9.703 14.979 -17.373 118 H LEU 18 H LEU 18 7.787 13.848 -14.891 119 HA LEU 18 HA LEU 18 10.230 12.129 -14.920 120 HB2 LEU 18 HB2 LEU 18 7.380 11.578 -13.958 121 HB3 LEU 18 HB3 LEU 18 8.599 10.350 -14.247 122 HG LEU 18 HG LEU 18 8.287 12.227 -11.945 123 HD11 LEU 18 HD11 LEU 18 7.850 9.797 -11.835 124 HD12 LEU 18 HD12 LEU 18 9.214 10.215 -10.785 125 HD13 LEU 18 HD13 LEU 18 9.513 9.462 -12.378 126 HD21 LEU 18 HD21 LEU 18 10.662 12.135 -11.306 127 HD22 LEU 18 HD22 LEU 18 10.462 13.023 -12.822 128 HD23 LEU 18 HD23 LEU 18 11.045 11.336 -12.849 129 H PHE 19 H PHE 19 10.284 10.463 -16.454 130 HA PHE 19 HA PHE 19 8.070 10.121 -18.319 131 HB2 PHE 19 HB2 PHE 19 9.141 10.923 -20.342 132 HB3 PHE 19 HB3 PHE 19 8.815 12.210 -19.228 133 HD1 PHE 19 HD1 PHE 19 11.224 10.842 -21.456 134 HD2 PHE 19 HD2 PHE 19 10.856 13.017 -17.754 135 HE1 PHE 19 HE1 PHE 19 13.495 11.778 -21.778 136 HE2 PHE 19 HE2 PHE 19 13.103 13.933 -18.085 137 HZ PHE 19 HZ PHE 19 14.474 13.335 -19.995 138 H VAL 20 H VAL 20 8.843 8.757 -20.318 139 HA VAL 20 HA VAL 20 11.024 6.921 -19.570 140 HB VAL 20 HB VAL 20 8.228 6.020 -20.365 141 HG11 VAL 20 HG11 VAL 20 10.657 4.321 -19.692 142 HG12 VAL 20 HG12 VAL 20 9.030 3.757 -20.160 143 HG13 VAL 20 HG13 VAL 20 10.029 4.592 -21.334 144 HG21 VAL 20 HG21 VAL 20 8.518 6.688 -17.921 145 HG22 VAL 20 HG22 VAL 20 8.043 5.018 -18.219 146 HG23 VAL 20 HG23 VAL 20 9.728 5.419 -17.782 147 H VAL 21 H VAL 21 12.306 6.631 -21.223 148 HA VAL 21 HA VAL 21 11.254 6.892 -23.988 149 HB VAL 21 HB VAL 21 12.188 8.989 -23.581 150 HG11 VAL 21 HG11 VAL 21 14.701 7.683 -22.504 151 HG12 VAL 21 HG12 VAL 21 14.538 9.401 -22.941 152 HG13 VAL 21 HG13 VAL 21 13.533 8.737 -21.649 153 HG21 VAL 21 HG21 VAL 21 14.195 7.307 -25.117 154 HG22 VAL 21 HG22 VAL 21 12.701 8.035 -25.771 155 HG23 VAL 21 HG23 VAL 21 14.037 9.061 -25.227 156 H ASN 22 H ASN 22 11.805 5.107 -25.208 157 HA ASN 22 HA ASN 22 12.562 3.011 -25.617 158 HB2 ASN 22 HB2 ASN 22 15.143 4.366 -24.738 159 HB3 ASN 22 HB3 ASN 22 15.094 2.714 -25.342 160 HD21 ASN 22 HD21 ASN 22 15.381 5.937 -26.385 161 HD22 ASN 22 HD22 ASN 22 14.998 5.615 -28.080 162 H ASN 23 H ASN 23 11.239 3.326 -23.144 163 HA ASN 23 HA ASN 23 10.661 2.194 -21.319 164 HB2 ASN 23 HB2 ASN 23 11.153 0.153 -22.769 165 HB3 ASN 23 HB3 ASN 23 12.705 0.037 -21.931 166 HD21 ASN 23 HD21 ASN 23 9.257 0.607 -21.081 167 HD22 ASN 23 HD22 ASN 23 9.207 -0.555 -19.755 168 H ARG 24 H ARG 24 13.287 3.977 -21.431 169 HA ARG 24 HA ARG 24 14.484 3.148 -18.848 170 HB2 ARG 24 HB2 ARG 24 15.455 5.211 -20.872 171 HB3 ARG 24 HB3 ARG 24 16.286 4.651 -19.409 172 HG2 ARG 24 HG2 ARG 24 16.285 2.314 -20.382 173 HG3 ARG 24 HG3 ARG 24 15.551 2.990 -21.841 174 HD2 ARG 24 HD2 ARG 24 17.564 4.540 -22.003 175 HD3 ARG 24 HD3 ARG 24 18.335 3.468 -20.799 176 HE ARG 24 HE ARG 24 17.186 1.867 -22.819 177 HH11 ARG 24 HH11 ARG 24 19.892 4.176 -22.615 178 HH12 ARG 24 HH12 ARG 24 20.741 3.489 -23.963 179 HH21 ARG 24 HH21 ARG 24 18.021 1.229 -24.645 180 HH22 ARG 24 HH22 ARG 24 19.493 1.891 -25.327 181 H LEU 25 H LEU 25 13.790 4.142 -17.060 182 HA LEU 25 HA LEU 25 11.911 6.320 -17.202 183 HB2 LEU 25 HB2 LEU 25 12.167 4.427 -15.407 184 HB3 LEU 25 HB3 LEU 25 13.456 5.389 -14.733 185 HG LEU 25 HG LEU 25 10.503 6.109 -14.961 186 HD11 LEU 25 HD11 LEU 25 10.668 6.151 -12.496 187 HD12 LEU 25 HD12 LEU 25 12.376 5.699 -12.587 188 HD13 LEU 25 HD13 LEU 25 11.119 4.580 -13.163 189 HD21 LEU 25 HD21 LEU 25 12.784 7.896 -14.044 190 HD22 LEU 25 HD22 LEU 25 11.091 8.150 -13.570 191 HD23 LEU 25 HD23 LEU 25 11.527 8.226 -15.262 192 H GLN 26 H GLN 26 12.485 8.414 -17.510 193 HA GLN 26 HA GLN 26 15.127 9.369 -16.513 194 HB2 GLN 26 HB2 GLN 26 13.704 10.160 -19.070 195 HB3 GLN 26 HB3 GLN 26 15.186 10.876 -18.429 196 HG2 GLN 26 HG2 GLN 26 15.922 8.237 -18.564 197 HG3 GLN 26 HG3 GLN 26 14.772 8.300 -19.911 198 HE21 GLN 26 HE21 GLN 26 15.182 10.793 -21.032 199 HE22 GLN 26 HE22 GLN 26 16.824 10.937 -21.602 200 H TYR 27 H TYR 27 15.062 11.820 -16.196 201 HA TYR 27 HA TYR 27 12.439 12.899 -15.665 202 HB2 TYR 27 HB2 TYR 27 12.904 13.556 -13.403 203 HB3 TYR 27 HB3 TYR 27 13.021 11.793 -13.517 204 HD1 TYR 27 HD1 TYR 27 15.220 10.700 -13.407 205 HD2 TYR 27 HD2 TYR 27 14.800 14.948 -12.900 206 HE1 TYR 27 HE1 TYR 27 17.503 10.808 -12.321 207 HE2 TYR 27 HE2 TYR 27 17.045 15.086 -11.893 208 HH TYR 27 HH TYR 27 19.115 13.769 -11.976 209 H GLU 28 H GLU 28 12.583 15.234 -15.579 210 HA GLU 28 HA GLU 28 15.191 16.342 -16.257 211 HB2 GLU 28 HB2 GLU 28 14.168 15.815 -18.409 212 HB3 GLU 28 HB3 GLU 28 12.630 16.517 -17.896 213 HG2 GLU 28 HG2 GLU 28 13.716 18.032 -19.352 214 HG3 GLU 28 HG3 GLU 28 13.694 18.710 -17.743 215 H THR 29 H THR 29 15.384 18.441 -15.392 216 HA THR 29 HA THR 29 13.103 19.931 -14.460 217 HB THR 29 HB THR 29 13.421 18.137 -12.748 218 HG1 THR 29 HG1 THR 29 12.608 20.089 -12.110 219 HG21 THR 29 HG21 THR 29 15.299 18.080 -11.267 220 HG22 THR 29 HG22 THR 29 16.156 19.315 -12.221 221 HG23 THR 29 HG23 THR 29 15.811 17.717 -12.908 222 H SER 30 H SER 30 14.192 21.787 -13.019 223 HA SER 30 HA SER 30 16.843 22.576 -13.777 224 HB2 SER 30 HB2 SER 30 15.567 23.310 -15.782 225 HB3 SER 30 HB3 SER 30 14.427 24.192 -14.742 226 HG SER 30 HG SER 30 16.281 25.344 -15.770 227 H ARG 31 H ARG 31 17.287 22.482 -11.693 228 HA ARG 31 HA ARG 31 16.860 24.555 -9.978 229 HB2 ARG 31 HB2 ARG 31 15.401 23.485 -8.195 230 HB3 ARG 31 HB3 ARG 31 14.619 24.138 -9.597 231 HG2 ARG 31 HG2 ARG 31 13.454 22.207 -9.366 232 HG3 ARG 31 HG3 ARG 31 14.582 21.746 -10.565 233 HD2 ARG 31 HD2 ARG 31 14.172 20.025 -8.785 234 HD3 ARG 31 HD3 ARG 31 15.857 20.407 -9.118 235 HE ARG 31 HE ARG 31 16.155 21.099 -6.965 236 HH11 ARG 31 HH11 ARG 31 12.634 21.625 -7.482 237 HH12 ARG 31 HH12 ARG 31 12.399 21.813 -5.775 238 HH21 ARG 31 HH21 ARG 31 15.657 21.201 -4.739 239 HH22 ARG 31 HH22 ARG 31 13.982 21.436 -4.282 240 H ASP 32 H ASP 32 17.707 24.108 -7.853 241 HA ASP 32 HA ASP 32 19.787 22.030 -7.881 242 HB2 ASP 32 HB2 ASP 32 20.884 23.434 -6.215 243 HB3 ASP 32 HB3 ASP 32 20.444 24.395 -7.617 244 H SER 33 H SER 33 20.413 21.313 -5.639 245 HA SER 33 HA SER 33 19.949 19.772 -4.053 246 HB2 SER 33 HB2 SER 33 19.926 22.269 -3.176 247 HB3 SER 33 HB3 SER 33 18.271 21.873 -2.687 248 HG SER 33 HG SER 33 20.670 21.172 -1.661 249 H ILE 34 H ILE 34 18.641 18.462 -5.587 250 HA ILE 34 HA ILE 34 15.754 18.565 -5.390 251 HB ILE 34 HB ILE 34 17.776 16.594 -6.515 252 HG12 ILE 34 HG12 ILE 34 15.421 18.103 -7.762 253 HG13 ILE 34 HG13 ILE 34 17.072 18.718 -7.695 254 HG21 ILE 34 HG21 ILE 34 15.990 15.118 -5.572 255 HG22 ILE 34 HG22 ILE 34 14.771 16.011 -6.482 256 HG23 ILE 34 HG23 ILE 34 16.023 15.087 -7.325 257 HD11 ILE 34 HD11 ILE 34 16.903 17.847 -9.836 258 HD12 ILE 34 HD12 ILE 34 17.764 16.585 -8.959 259 HD13 ILE 34 HD13 ILE 34 16.020 16.392 -9.313 260 HA PRO 35 HA PRO 35 15.392 16.575 -1.428 261 HB2 PRO 35 HB2 PRO 35 12.930 15.333 -1.792 262 HB3 PRO 35 HB3 PRO 35 13.151 17.073 -1.400 263 HG2 PRO 35 HG2 PRO 35 12.722 15.777 -4.108 264 HG3 PRO 35 HG3 PRO 35 11.902 17.224 -3.421 265 HD2 PRO 35 HD2 PRO 35 13.936 17.472 -5.129 266 HD3 PRO 35 HD3 PRO 35 13.862 18.529 -3.706 267 H THR 36 H THR 36 16.867 14.910 -1.184 268 HA THR 36 HA THR 36 17.345 12.851 -2.966 269 HB THR 36 HB THR 36 17.903 12.742 0.012 270 HG1 THR 36 HG1 THR 36 19.587 14.145 -0.333 271 HG21 THR 36 HG21 THR 36 19.523 11.932 -2.439 272 HG22 THR 36 HG22 THR 36 18.707 10.820 -1.328 273 HG23 THR 36 HG23 THR 36 20.065 11.790 -0.753 274 H GLU 37 H GLU 37 14.893 13.058 -0.480 275 HA GLU 37 HA GLU 37 14.319 10.286 -0.076 276 HB2 GLU 37 HB2 GLU 37 11.996 11.224 0.464 277 HB3 GLU 37 HB3 GLU 37 13.351 11.726 1.492 278 HG2 GLU 37 HG2 GLU 37 13.466 13.903 0.435 279 HG3 GLU 37 HG3 GLU 37 12.324 13.432 -0.816 280 H LEU 38 H LEU 38 12.994 12.691 -2.261 281 HA LEU 38 HA LEU 38 11.169 11.113 -3.717 282 HB2 LEU 38 HB2 LEU 38 11.897 13.794 -3.410 283 HB3 LEU 38 HB3 LEU 38 12.360 13.482 -5.069 284 HG LEU 38 HG LEU 38 9.620 12.886 -3.881 285 HD11 LEU 38 HD11 LEU 38 10.143 15.327 -3.821 286 HD12 LEU 38 HD12 LEU 38 8.883 14.968 -5.012 287 HD13 LEU 38 HD13 LEU 38 10.545 15.263 -5.552 288 HD21 LEU 38 HD21 LEU 38 8.897 12.902 -6.264 289 HD22 LEU 38 HD22 LEU 38 10.084 11.621 -5.939 290 HD23 LEU 38 HD23 LEU 38 10.577 13.142 -6.746 291 H LEU 39 H LEU 39 14.508 12.194 -4.373 292 HA LEU 39 HA LEU 39 14.833 11.038 -6.902 293 HB2 LEU 39 HB2 LEU 39 16.354 12.612 -5.374 294 HB3 LEU 39 HB3 LEU 39 17.182 11.102 -5.007 295 HG LEU 39 HG LEU 39 16.680 12.279 -7.781 296 HD11 LEU 39 HD11 LEU 39 18.239 13.622 -6.511 297 HD12 LEU 39 HD12 LEU 39 19.119 12.725 -7.754 298 HD13 LEU 39 HD13 LEU 39 19.165 12.181 -6.062 299 HD21 LEU 39 HD21 LEU 39 18.349 10.618 -8.596 300 HD22 LEU 39 HD22 LEU 39 16.879 9.855 -8.016 301 HD23 LEU 39 HD23 LEU 39 18.338 9.840 -6.996 302 H ASN 40 H ASN 40 15.764 9.643 -3.736 303 HA ASN 40 HA ASN 40 16.477 7.062 -4.722 304 HB2 ASN 40 HB2 ASN 40 15.682 8.074 -1.980 305 HB3 ASN 40 HB3 ASN 40 15.710 6.339 -2.276 306 HD21 ASN 40 HD21 ASN 40 17.668 8.729 -1.077 307 HD22 ASN 40 HD22 ASN 40 19.219 8.191 -1.646 308 H LYS 41 H LYS 41 13.305 8.372 -3.607 309 HA LYS 41 HA LYS 41 11.881 5.950 -3.703 310 HB2 LYS 41 HB2 LYS 41 11.043 7.962 -2.652 311 HB3 LYS 41 HB3 LYS 41 10.909 8.799 -4.200 312 HG2 LYS 41 HG2 LYS 41 9.108 7.462 -4.924 313 HG3 LYS 41 HG3 LYS 41 9.510 6.190 -3.751 314 HD2 LYS 41 HD2 LYS 41 7.520 7.227 -3.028 315 HD3 LYS 41 HD3 LYS 41 8.815 7.631 -1.896 316 HE2 LYS 41 HE2 LYS 41 9.006 9.881 -3.132 317 HE3 LYS 41 HE3 LYS 41 7.529 9.404 -3.979 318 HZ1 LYS 41 HZ1 LYS 41 6.656 9.046 -1.561 319 HZ2 LYS 41 HZ2 LYS 41 6.662 10.503 -2.291 320 HZ3 LYS 41 HZ3 LYS 41 7.817 10.205 -1.210 321 H TRP 42 H TRP 42 12.799 8.133 -6.381 322 HA TRP 42 HA TRP 42 11.114 6.948 -8.323 323 HB2 TRP 42 HB2 TRP 42 13.873 8.143 -8.747 324 HB3 TRP 42 HB3 TRP 42 12.666 7.798 -10.000 325 HD1 TRP 42 HD1 TRP 42 10.238 9.103 -8.104 326 HE1 TRP 42 HE1 TRP 42 10.002 11.641 -8.209 327 HE3 TRP 42 HE3 TRP 42 14.975 10.240 -9.607 328 HZ2 TRP 42 HZ2 TRP 42 11.744 13.912 -8.689 329 HZ3 TRP 42 HZ3 TRP 42 15.677 12.615 -9.850 330 HH2 TRP 42 HH2 TRP 42 14.106 14.434 -9.299 331 H LYS 43 H LYS 43 14.596 6.185 -7.602 332 HA LYS 43 HA LYS 43 14.587 3.990 -9.463 333 HB2 LYS 43 HB2 LYS 43 16.658 3.244 -8.343 334 HB3 LYS 43 HB3 LYS 43 16.703 4.901 -8.917 335 HG2 LYS 43 HG2 LYS 43 16.521 5.835 -6.748 336 HG3 LYS 43 HG3 LYS 43 16.034 4.288 -6.030 337 HD2 LYS 43 HD2 LYS 43 18.796 4.770 -7.170 338 HD3 LYS 43 HD3 LYS 43 18.323 4.961 -5.464 339 HE2 LYS 43 HE2 LYS 43 17.381 2.581 -5.569 340 HE3 LYS 43 HE3 LYS 43 18.178 2.403 -7.139 341 HZ1 LYS 43 HZ1 LYS 43 19.486 2.952 -4.559 342 HZ2 LYS 43 HZ2 LYS 43 20.267 2.814 -6.031 343 HZ3 LYS 43 HZ3 LYS 43 19.470 1.519 -5.364 344 H GLN 44 H GLN 44 13.856 4.203 -6.001 345 HA GLN 44 HA GLN 44 13.727 1.559 -5.271 346 HB2 GLN 44 HB2 GLN 44 13.416 3.638 -3.839 347 HB3 GLN 44 HB3 GLN 44 11.777 3.749 -4.472 348 HG2 GLN 44 HG2 GLN 44 11.410 2.740 -2.465 349 HG3 GLN 44 HG3 GLN 44 11.464 1.350 -3.530 350 HE21 GLN 44 HE21 GLN 44 12.345 2.129 -0.539 351 HE22 GLN 44 HE22 GLN 44 13.893 1.296 -0.416 352 H HIS 45 H HIS 45 11.265 3.438 -7.030 353 HA HIS 45 HA HIS 45 9.692 0.946 -7.513 354 HB2 HIS 45 HB2 HIS 45 8.637 3.778 -7.255 355 HB3 HIS 45 HB3 HIS 45 7.702 2.298 -7.480 356 HD1 HIS 45 HD1 HIS 45 7.955 0.499 -5.362 357 HD2 HIS 45 HD2 HIS 45 9.215 4.454 -4.844 358 HE1 HIS 45 HE1 HIS 45 8.324 0.833 -2.822 359 H LYS 46 H LYS 46 11.985 1.923 -9.110 360 HA LYS 46 HA LYS 46 11.409 3.382 -11.327 361 HB2 LYS 46 HB2 LYS 46 13.630 2.230 -10.773 362 HB3 LYS 46 HB3 LYS 46 12.989 0.798 -11.572 363 HG2 LYS 46 HG2 LYS 46 12.548 2.430 -13.573 364 HG3 LYS 46 HG3 LYS 46 13.529 3.562 -12.679 365 HD2 LYS 46 HD2 LYS 46 15.015 2.729 -14.149 366 HD3 LYS 46 HD3 LYS 46 15.397 1.760 -12.745 367 HE2 LYS 46 HE2 LYS 46 13.622 0.828 -15.076 368 HE3 LYS 46 HE3 LYS 46 15.365 0.628 -15.034 369 HZ1 LYS 46 HZ1 LYS 46 14.368 -1.372 -14.331 370 HZ2 LYS 46 HZ2 LYS 46 13.469 -0.650 -13.166 371 HZ3 LYS 46 HZ3 LYS 46 15.070 -0.684 -12.992 372 H GLN 47 H GLN 47 10.909 -0.154 -11.217 373 HA GLN 47 HA GLN 47 9.810 -0.483 -13.764 374 HB2 GLN 47 HB2 GLN 47 10.451 -2.061 -11.584 375 HB3 GLN 47 HB3 GLN 47 8.707 -2.173 -11.573 376 HG2 GLN 47 HG2 GLN 47 10.467 -2.753 -13.994 377 HG3 GLN 47 HG3 GLN 47 9.946 -3.971 -12.830 378 HE21 GLN 47 HE21 GLN 47 8.885 -1.856 -15.432 379 HE22 GLN 47 HE22 GLN 47 7.248 -2.424 -15.566 380 H GLU 48 H GLU 48 8.155 0.251 -10.726 381 HA GLU 48 HA GLU 48 5.478 0.111 -11.679 382 HB2 GLU 48 HB2 GLU 48 6.293 1.923 -9.392 383 HB3 GLU 48 HB3 GLU 48 4.827 0.950 -9.625 384 HG2 GLU 48 HG2 GLU 48 6.397 -1.117 -9.409 385 HG3 GLU 48 HG3 GLU 48 7.628 0.041 -8.864 386 H LEU 49 H LEU 49 7.646 2.874 -11.143 387 HA LEU 49 HA LEU 49 5.902 4.946 -12.016 388 HB2 LEU 49 HB2 LEU 49 8.905 4.637 -12.145 389 HB3 LEU 49 HB3 LEU 49 8.091 6.151 -12.539 390 HG LEU 49 HG LEU 49 7.537 4.825 -9.867 391 HD11 LEU 49 HD11 LEU 49 9.997 4.948 -10.295 392 HD12 LEU 49 HD12 LEU 49 9.403 5.840 -8.880 393 HD13 LEU 49 HD13 LEU 49 9.834 6.721 -10.385 394 HD21 LEU 49 HD21 LEU 49 7.307 7.204 -9.207 395 HD22 LEU 49 HD22 LEU 49 6.122 6.732 -10.426 396 HD23 LEU 49 HD23 LEU 49 7.540 7.697 -10.881 397 H ILE 50 H ILE 50 8.241 2.897 -13.758 398 HA ILE 50 HA ILE 50 7.914 4.188 -16.279 399 HB ILE 50 HB ILE 50 8.585 1.291 -15.626 400 HG12 ILE 50 HG12 ILE 50 10.472 3.360 -16.807 401 HG13 ILE 50 HG13 ILE 50 10.175 3.357 -15.071 402 HG21 ILE 50 HG21 ILE 50 8.583 2.619 -18.334 403 HG22 ILE 50 HG22 ILE 50 9.453 1.116 -17.992 404 HG23 ILE 50 HG23 ILE 50 7.699 1.180 -17.828 405 HD11 ILE 50 HD11 ILE 50 12.191 2.088 -15.649 406 HD12 ILE 50 HD12 ILE 50 10.971 1.040 -14.882 407 HD13 ILE 50 HD13 ILE 50 11.253 0.985 -16.647 408 H ASP 51 H ASP 51 6.223 1.298 -14.974 409 HA ASP 51 HA ASP 51 4.461 0.911 -17.092 410 HB2 ASP 51 HB2 ASP 51 4.885 -0.407 -14.884 411 HB3 ASP 51 HB3 ASP 51 3.655 0.626 -14.185 412 H PHE 52 H PHE 52 4.257 3.278 -14.461 413 HA PHE 52 HA PHE 52 1.602 4.184 -15.121 414 HB2 PHE 52 HB2 PHE 52 2.404 4.408 -12.902 415 HB3 PHE 52 HB3 PHE 52 3.750 5.434 -13.417 416 HD1 PHE 52 HD1 PHE 52 3.402 7.771 -14.032 417 HD2 PHE 52 HD2 PHE 52 0.053 5.306 -12.921 418 HE1 PHE 52 HE1 PHE 52 1.979 9.797 -13.829 419 HE2 PHE 52 HE2 PHE 52 -1.364 7.328 -12.754 420 HZ PHE 52 HZ PHE 52 -0.361 9.595 -13.163 421 H LEU 53 H LEU 53 4.855 5.736 -15.620 422 HA LEU 53 HA LEU 53 3.874 7.959 -17.128 423 HB2 LEU 53 HB2 LEU 53 6.536 6.502 -17.005 424 HB3 LEU 53 HB3 LEU 53 6.284 7.803 -18.159 425 HG LEU 53 HG LEU 53 7.470 8.751 -16.433 426 HD11 LEU 53 HD11 LEU 53 4.605 9.635 -15.932 427 HD12 LEU 53 HD12 LEU 53 5.652 10.177 -17.271 428 HD13 LEU 53 HD13 LEU 53 6.078 10.563 -15.618 429 HD21 LEU 53 HD21 LEU 53 6.792 8.819 -14.052 430 HD22 LEU 53 HD22 LEU 53 7.256 7.226 -14.644 431 HD23 LEU 53 HD23 LEU 53 5.541 7.606 -14.408 432 H ASN 54 H ASN 54 4.450 4.617 -17.998 433 HA ASN 54 HA ASN 54 4.532 5.035 -20.865 434 HB2 ASN 54 HB2 ASN 54 5.415 3.068 -19.416 435 HB3 ASN 54 HB3 ASN 54 3.785 2.449 -19.475 436 HD21 ASN 54 HD21 ASN 54 6.762 2.418 -20.768 437 HD22 ASN 54 HD22 ASN 54 6.470 2.022 -22.455 438 H GLN 55 H GLN 55 2.031 3.581 -18.646 439 HA GLN 55 HA GLN 55 0.017 3.683 -20.597 440 HB2 GLN 55 HB2 GLN 55 -1.510 3.035 -18.877 441 HB3 GLN 55 HB3 GLN 55 0.029 2.211 -18.633 442 HG2 GLN 55 HG2 GLN 55 -0.590 2.821 -16.477 443 HG3 GLN 55 HG3 GLN 55 0.600 3.984 -16.940 444 HE21 GLN 55 HE21 GLN 55 0.119 6.067 -16.237 445 HE22 GLN 55 HE22 GLN 55 -1.523 6.702 -16.144 446 H LEU 56 H LEU 56 1.261 6.251 -18.675 447 HA LEU 56 HA LEU 56 -1.005 7.976 -18.483 448 HB2 LEU 56 HB2 LEU 56 0.987 8.221 -17.102 449 HB3 LEU 56 HB3 LEU 56 2.001 8.410 -18.535 450 HG LEU 56 HG LEU 56 0.944 10.608 -18.991 451 HD11 LEU 56 HD11 LEU 56 -0.451 10.122 -16.317 452 HD12 LEU 56 HD12 LEU 56 -1.239 10.206 -17.903 453 HD13 LEU 56 HD13 LEU 56 -0.453 11.639 -17.240 454 HD21 LEU 56 HD21 LEU 56 3.026 10.381 -17.721 455 HD22 LEU 56 HD22 LEU 56 2.098 10.252 -16.202 456 HD23 LEU 56 HD23 LEU 56 2.074 11.757 -17.153 457 H ASP 57 H ASP 57 1.085 7.109 -21.103 458 HA ASP 57 HA ASP 57 -0.219 9.190 -22.779 459 HB2 ASP 57 HB2 ASP 57 2.445 9.271 -22.019 460 HB3 ASP 57 HB3 ASP 57 2.523 8.511 -23.596 461 H SER 58 H SER 58 1.656 6.082 -22.989 462 HA SER 58 HA SER 58 0.681 5.425 -25.577 463 HB2 SER 58 HB2 SER 58 1.845 3.635 -23.430 464 HB3 SER 58 HB3 SER 58 1.844 3.336 -25.172 465 HG SER 58 HG SER 58 3.393 4.846 -25.432 466 H GLU 59 H GLU 59 -0.362 4.543 -22.319 467 HA GLU 59 HA GLU 59 -1.918 3.103 -21.480 468 HB2 GLU 59 HB2 GLU 59 -4.245 3.640 -22.207 469 HB3 GLU 59 HB3 GLU 59 -3.242 4.952 -21.648 470 HG2 GLU 59 HG2 GLU 59 -2.866 5.746 -23.947 471 HG3 GLU 59 HG3 GLU 59 -3.817 4.389 -24.579 472 H GLU 60 H GLU 60 -0.356 1.581 -23.155 473 HA GLU 60 HA GLU 60 -2.363 -0.456 -24.061 474 HB2 GLU 60 HB2 GLU 60 0.001 0.603 -25.637 475 HB3 GLU 60 HB3 GLU 60 -0.662 -1.014 -25.902 476 HG2 GLU 60 HG2 GLU 60 -2.924 -0.005 -26.282 477 HG3 GLU 60 HG3 GLU 60 -2.168 1.598 -26.215 478 H GLN 61 H GLN 61 1.066 0.095 -23.132 479 HA GLN 61 HA GLN 61 1.729 -2.698 -22.967 480 HB2 GLN 61 HB2 GLN 61 2.910 -0.248 -21.623 481 HB3 GLN 61 HB3 GLN 61 3.587 -1.859 -21.467 482 HG2 GLN 61 HG2 GLN 61 3.171 -0.597 -24.200 483 HG3 GLN 61 HG3 GLN 61 4.584 -0.221 -23.221 484 HE21 GLN 61 HE21 GLN 61 5.862 -2.239 -22.337 485 HE22 GLN 61 HE22 GLN 61 5.968 -3.576 -23.449 486 H THR 62 H THR 62 0.997 -4.158 -21.491 487 HA THR 62 HA THR 62 0.075 -3.159 -18.853 488 HB THR 62 HB THR 62 -1.415 -5.340 -20.336 489 HG1 THR 62 HG1 THR 62 -1.292 -3.137 -21.461 490 HG21 THR 62 HG21 THR 62 -2.210 -3.313 -18.181 491 HG22 THR 62 HG22 THR 62 -1.866 -5.018 -17.917 492 HG23 THR 62 HG23 THR 62 -3.279 -4.546 -18.880 493 H LYS 63 H LYS 63 0.308 -4.760 -17.150 494 HA LYS 63 HA LYS 63 1.855 -7.200 -17.771 495 HB2 LYS 63 HB2 LYS 63 3.479 -6.633 -16.005 496 HB3 LYS 63 HB3 LYS 63 3.531 -5.435 -17.300 497 HG2 LYS 63 HG2 LYS 63 2.267 -3.836 -16.009 498 HG3 LYS 63 HG3 LYS 63 1.824 -5.067 -14.819 499 HD2 LYS 63 HD2 LYS 63 4.184 -5.198 -14.069 500 HD3 LYS 63 HD3 LYS 63 4.590 -3.893 -15.201 501 HE2 LYS 63 HE2 LYS 63 4.209 -2.990 -12.929 502 HE3 LYS 63 HE3 LYS 63 3.013 -2.382 -14.081 503 HZ1 LYS 63 HZ1 LYS 63 1.971 -2.989 -12.047 504 HZ2 LYS 63 HZ2 LYS 63 2.503 -4.550 -12.128 505 HZ3 LYS 63 HZ3 LYS 63 1.415 -3.917 -13.238 Start of MODEL 15 1 H1 GLY 1 H GLY 1 1.092 -0.794 0.225 2 HA2 GLY 1 HA2 GLY 1 3.250 -0.554 -0.877 3 HA3 GLY 1 HA3 GLY 1 1.934 -0.584 -2.070 4 H ILE 2 H ILE 2 2.723 0.811 -3.657 5 HA ILE 2 HA ILE 2 3.047 3.612 -2.822 6 HB ILE 2 HB ILE 2 5.345 2.634 -3.074 7 HG12 ILE 2 HG12 ILE 2 6.297 4.240 -4.443 8 HG13 ILE 2 HG13 ILE 2 4.801 4.570 -5.321 9 HG21 ILE 2 HG21 ILE 2 6.142 1.989 -5.331 10 HG22 ILE 2 HG22 ILE 2 4.910 0.886 -4.733 11 HG23 ILE 2 HG23 ILE 2 4.508 2.100 -5.965 12 HD11 ILE 2 HD11 ILE 2 5.426 6.334 -3.680 13 HD12 ILE 2 HD12 ILE 2 3.832 5.656 -3.357 14 HD13 ILE 2 HD13 ILE 2 5.235 5.156 -2.367 15 H ASP 3 H ASP 3 2.427 5.125 -4.464 16 HA ASP 3 HA ASP 3 0.735 3.949 -6.592 17 HB2 ASP 3 HB2 ASP 3 0.292 6.625 -5.350 18 HB3 ASP 3 HB3 ASP 3 -0.834 5.629 -6.243 19 H ALA 4 H ALA 4 1.784 4.350 -8.460 20 HA ALA 4 HA ALA 4 4.155 5.921 -8.625 21 HB1 ALA 4 HB1 ALA 4 2.243 4.966 -10.769 22 HB2 ALA 4 HB2 ALA 4 3.835 5.676 -11.084 23 HB3 ALA 4 HB3 ALA 4 3.716 4.124 -10.222 24 H ALA 5 H ALA 5 0.725 6.747 -9.274 25 HA ALA 5 HA ALA 5 1.151 9.274 -10.477 26 HB1 ALA 5 HB1 ALA 5 -1.135 8.409 -8.640 27 HB2 ALA 5 HB2 ALA 5 -1.159 9.754 -9.795 28 HB3 ALA 5 HB3 ALA 5 -1.045 8.080 -10.378 29 H GLN 6 H GLN 6 0.879 8.309 -7.050 30 HA GLN 6 HA GLN 6 0.915 10.957 -5.966 31 HB2 GLN 6 HB2 GLN 6 1.651 8.255 -4.805 32 HB3 GLN 6 HB3 GLN 6 1.785 9.704 -3.853 33 HG2 GLN 6 HG2 GLN 6 -0.860 9.348 -5.241 34 HG3 GLN 6 HG3 GLN 6 -0.447 8.151 -4.022 35 HE21 GLN 6 HE21 GLN 6 -0.579 11.802 -4.339 36 HE22 GLN 6 HE22 GLN 6 -1.121 12.008 -2.711 37 H ILE 7 H ILE 7 3.547 8.815 -7.041 38 HA ILE 7 HA ILE 7 5.627 10.494 -5.920 39 HB ILE 7 HB ILE 7 5.807 8.347 -8.035 40 HG12 ILE 7 HG12 ILE 7 6.488 8.013 -5.119 41 HG13 ILE 7 HG13 ILE 7 4.954 7.493 -5.810 42 HG21 ILE 7 HG21 ILE 7 8.282 8.353 -7.133 43 HG22 ILE 7 HG22 ILE 7 7.785 9.728 -8.121 44 HG23 ILE 7 HG23 ILE 7 7.854 9.868 -6.348 45 HD11 ILE 7 HD11 ILE 7 5.861 5.734 -6.982 46 HD12 ILE 7 HD12 ILE 7 7.439 6.467 -7.198 47 HD13 ILE 7 HD13 ILE 7 7.033 5.828 -5.635 48 H VAL 8 H VAL 8 4.087 10.069 -9.138 49 HA VAL 8 HA VAL 8 5.867 11.771 -10.602 50 HB VAL 8 HB VAL 8 2.974 10.861 -11.009 51 HG11 VAL 8 HG11 VAL 8 3.144 11.688 -13.337 52 HG12 VAL 8 HG12 VAL 8 3.126 13.012 -12.173 53 HG13 VAL 8 HG13 VAL 8 4.667 12.528 -12.919 54 HG21 VAL 8 HG21 VAL 8 4.824 9.169 -11.260 55 HG22 VAL 8 HG22 VAL 8 3.917 9.478 -12.745 56 HG23 VAL 8 HG23 VAL 8 5.526 10.196 -12.528 57 H ASP 9 H ASP 9 2.803 12.336 -8.871 58 HA ASP 9 HA ASP 9 2.441 15.036 -9.509 59 HB2 ASP 9 HB2 ASP 9 0.709 13.596 -8.552 60 HB3 ASP 9 HB3 ASP 9 1.632 13.441 -7.047 61 H GLU 10 H GLU 10 3.885 13.621 -6.494 62 HA GLU 10 HA GLU 10 4.565 16.185 -5.494 63 HB2 GLU 10 HB2 GLU 10 6.152 15.074 -4.019 64 HB3 GLU 10 HB3 GLU 10 4.560 14.307 -4.008 65 HG2 GLU 10 HG2 GLU 10 5.463 12.599 -5.582 66 HG3 GLU 10 HG3 GLU 10 7.056 13.276 -5.401 67 H ALA 11 H ALA 11 6.325 14.004 -7.734 68 HA ALA 11 HA ALA 11 8.736 15.504 -7.566 69 HB1 ALA 11 HB1 ALA 11 8.661 13.257 -8.607 70 HB2 ALA 11 HB2 ALA 11 7.613 13.861 -9.905 71 HB3 ALA 11 HB3 ALA 11 9.289 14.430 -9.791 72 H LEU 12 H LEU 12 5.823 15.859 -9.652 73 HA LEU 12 HA LEU 12 6.876 18.046 -11.145 74 HB2 LEU 12 HB2 LEU 12 3.985 17.338 -10.450 75 HB3 LEU 12 HB3 LEU 12 4.419 18.633 -11.549 76 HG LEU 12 HG LEU 12 5.124 15.733 -12.000 77 HD11 LEU 12 HD11 LEU 12 3.352 15.698 -13.660 78 HD12 LEU 12 HD12 LEU 12 2.896 17.366 -13.244 79 HD13 LEU 12 HD13 LEU 12 2.709 16.054 -12.055 80 HD21 LEU 12 HD21 LEU 12 6.657 17.336 -13.179 81 HD22 LEU 12 HD22 LEU 12 5.225 18.083 -13.924 82 HD23 LEU 12 HD23 LEU 12 5.667 16.401 -14.281 83 H GLU 13 H GLU 13 5.241 17.822 -8.029 84 HA GLU 13 HA GLU 13 4.779 20.618 -7.618 85 HB2 GLU 13 HB2 GLU 13 4.980 18.274 -5.704 86 HB3 GLU 13 HB3 GLU 13 4.606 19.873 -5.162 87 HG2 GLU 13 HG2 GLU 13 2.900 18.556 -7.282 88 HG3 GLU 13 HG3 GLU 13 2.656 18.268 -5.567 89 H GLN 14 H GLN 14 7.648 18.835 -7.573 90 HA GLN 14 HA GLN 14 9.040 20.968 -6.029 91 HB2 GLN 14 HB2 GLN 14 10.098 18.166 -6.445 92 HB3 GLN 14 HB3 GLN 14 10.784 19.459 -5.457 93 HG2 GLN 14 HG2 GLN 14 8.261 19.307 -4.385 94 HG3 GLN 14 HG3 GLN 14 8.468 17.675 -4.974 95 HE21 GLN 14 HE21 GLN 14 8.716 16.424 -3.317 96 HE22 GLN 14 HE22 GLN 14 9.784 16.666 -1.958 97 H GLY 15 H GLY 15 8.238 20.287 -9.103 98 HA2 GLY 15 HA2 GLY 15 8.990 21.478 -10.948 99 HA3 GLY 15 HA3 GLY 15 10.509 21.829 -10.134 100 H ILE 16 H ILE 16 9.456 18.415 -10.312 101 HA ILE 16 HA ILE 16 11.496 18.031 -12.453 102 HB ILE 16 HB ILE 16 10.799 16.132 -10.210 103 HG12 ILE 16 HG12 ILE 16 13.559 16.823 -10.044 104 HG13 ILE 16 HG13 ILE 16 12.725 18.354 -10.234 105 HG21 ILE 16 HG21 ILE 16 11.490 14.933 -12.200 106 HG22 ILE 16 HG22 ILE 16 12.822 16.061 -12.514 107 HG23 ILE 16 HG23 ILE 16 12.895 14.943 -11.152 108 HD11 ILE 16 HD11 ILE 16 13.049 17.731 -7.896 109 HD12 ILE 16 HD12 ILE 16 11.303 17.861 -8.303 110 HD13 ILE 16 HD13 ILE 16 12.068 16.269 -8.125 111 H THR 17 H THR 17 10.860 17.213 -14.265 112 HA THR 17 HA THR 17 8.148 16.115 -14.602 113 HB THR 17 HB THR 17 10.445 17.170 -16.275 114 HG1 THR 17 HG1 THR 17 8.893 18.525 -17.037 115 HG21 THR 17 HG21 THR 17 9.830 15.082 -17.398 116 HG22 THR 17 HG22 THR 17 9.399 16.492 -18.345 117 HG23 THR 17 HG23 THR 17 8.125 15.590 -17.442 118 H LEU 18 H LEU 18 7.784 13.935 -14.819 119 HA LEU 18 HA LEU 18 10.136 12.101 -15.015 120 HB2 LEU 18 HB2 LEU 18 7.296 11.648 -13.959 121 HB3 LEU 18 HB3 LEU 18 8.461 10.391 -14.275 122 HG LEU 18 HG LEU 18 8.276 12.233 -11.946 123 HD11 LEU 18 HD11 LEU 18 9.156 10.217 -10.826 124 HD12 LEU 18 HD12 LEU 18 9.407 9.441 -12.420 125 HD13 LEU 18 HD13 LEU 18 7.763 9.838 -11.860 126 HD21 LEU 18 HD21 LEU 18 10.652 12.130 -11.405 127 HD22 LEU 18 HD22 LEU 18 10.427 13.003 -12.926 128 HD23 LEU 18 HD23 LEU 18 10.971 11.308 -12.951 129 H PHE 19 H PHE 19 10.057 10.412 -16.515 130 HA PHE 19 HA PHE 19 7.828 10.008 -18.294 131 HB2 PHE 19 HB2 PHE 19 8.882 10.786 -20.374 132 HB3 PHE 19 HB3 PHE 19 8.502 12.078 -19.282 133 HD1 PHE 19 HD1 PHE 19 11.081 10.601 -21.324 134 HD2 PHE 19 HD2 PHE 19 10.473 13.045 -17.828 135 HE1 PHE 19 HE1 PHE 19 13.341 11.605 -21.609 136 HE2 PHE 19 HE2 PHE 19 12.688 14.043 -18.139 137 HZ PHE 19 HZ PHE 19 14.150 13.342 -19.995 138 H VAL 20 H VAL 20 8.697 8.575 -20.269 139 HA VAL 20 HA VAL 20 10.957 6.887 -19.416 140 HB VAL 20 HB VAL 20 8.228 5.788 -20.240 141 HG11 VAL 20 HG11 VAL 20 10.786 4.344 -19.412 142 HG12 VAL 20 HG12 VAL 20 9.236 3.592 -19.868 143 HG13 VAL 20 HG13 VAL 20 10.160 4.467 -21.075 144 HG21 VAL 20 HG21 VAL 20 8.006 4.895 -18.054 145 HG22 VAL 20 HG22 VAL 20 9.627 5.468 -17.551 146 HG23 VAL 20 HG23 VAL 20 8.317 6.610 -17.853 147 H VAL 21 H VAL 21 12.268 6.716 -21.129 148 HA VAL 21 HA VAL 21 11.046 6.940 -23.839 149 HB VAL 21 HB VAL 21 11.825 9.098 -23.304 150 HG11 VAL 21 HG11 VAL 21 14.571 7.950 -22.718 151 HG12 VAL 21 HG12 VAL 21 14.177 9.676 -22.933 152 HG13 VAL 21 HG13 VAL 21 13.459 8.783 -21.590 153 HG21 VAL 21 HG21 VAL 21 12.064 8.295 -25.583 154 HG22 VAL 21 HG22 VAL 21 13.327 9.456 -25.163 155 HG23 VAL 21 HG23 VAL 21 13.717 7.718 -25.223 156 H ASN 22 H ASN 22 11.508 5.242 -25.021 157 HA ASN 22 HA ASN 22 12.228 3.160 -25.565 158 HB2 ASN 22 HB2 ASN 22 14.955 4.345 -24.914 159 HB3 ASN 22 HB3 ASN 22 14.672 2.845 -25.793 160 HD21 ASN 22 HD21 ASN 22 15.440 6.054 -26.411 161 HD22 ASN 22 HD22 ASN 22 14.617 6.184 -27.949 162 H ASN 23 H ASN 23 11.141 3.265 -22.957 163 HA ASN 23 HA ASN 23 10.907 2.137 -21.092 164 HB2 ASN 23 HB2 ASN 23 11.095 0.221 -22.656 165 HB3 ASN 23 HB3 ASN 23 12.803 0.063 -22.217 166 HD21 ASN 23 HD21 ASN 23 9.574 0.404 -20.589 167 HD22 ASN 23 HD22 ASN 23 9.868 -0.817 -19.396 168 H ARG 24 H ARG 24 13.270 4.103 -21.377 169 HA ARG 24 HA ARG 24 14.799 3.213 -18.985 170 HB2 ARG 24 HB2 ARG 24 15.611 5.384 -20.921 171 HB3 ARG 24 HB3 ARG 24 16.559 4.606 -19.649 172 HG2 ARG 24 HG2 ARG 24 15.980 2.377 -20.980 173 HG3 ARG 24 HG3 ARG 24 15.660 3.500 -22.312 174 HD2 ARG 24 HD2 ARG 24 17.972 4.315 -22.187 175 HD3 ARG 24 HD3 ARG 24 18.261 3.240 -20.796 176 HE ARG 24 HE ARG 24 17.206 1.920 -23.185 177 HH11 ARG 24 HH11 ARG 24 20.202 2.941 -21.636 178 HH12 ARG 24 HH12 ARG 24 21.142 1.620 -22.266 179 HH21 ARG 24 HH21 ARG 24 18.400 0.265 -24.075 180 HH22 ARG 24 HH22 ARG 24 20.059 -0.034 -23.662 181 H LEU 25 H LEU 25 14.065 4.066 -17.129 182 HA LEU 25 HA LEU 25 12.076 6.170 -17.120 183 HB2 LEU 25 HB2 LEU 25 12.404 4.320 -15.364 184 HB3 LEU 25 HB3 LEU 25 13.788 5.212 -14.753 185 HG LEU 25 HG LEU 25 10.913 6.197 -14.928 186 HD11 LEU 25 HD11 LEU 25 11.109 4.497 -13.268 187 HD12 LEU 25 HD12 LEU 25 10.910 6.037 -12.469 188 HD13 LEU 25 HD13 LEU 25 12.525 5.289 -12.514 189 HD21 LEU 25 HD21 LEU 25 12.230 8.213 -14.940 190 HD22 LEU 25 HD22 LEU 25 13.349 7.579 -13.695 191 HD23 LEU 25 HD23 LEU 25 11.660 8.016 -13.313 192 H GLN 26 H GLN 26 12.586 8.285 -17.599 193 HA GLN 26 HA GLN 26 15.210 9.355 -16.686 194 HB2 GLN 26 HB2 GLN 26 13.778 9.940 -19.293 195 HB3 GLN 26 HB3 GLN 26 15.235 10.741 -18.700 196 HG2 GLN 26 HG2 GLN 26 15.893 7.996 -18.621 197 HG3 GLN 26 HG3 GLN 26 14.946 8.154 -20.095 198 HE21 GLN 26 HE21 GLN 26 15.796 9.685 -21.808 199 HE22 GLN 26 HE22 GLN 26 17.506 10.057 -21.788 200 H TYR 27 H TYR 27 15.113 11.758 -16.309 201 HA TYR 27 HA TYR 27 12.485 12.868 -15.863 202 HB2 TYR 27 HB2 TYR 27 12.823 13.430 -13.557 203 HB3 TYR 27 HB3 TYR 27 12.872 11.690 -13.759 204 HD1 TYR 27 HD1 TYR 27 14.704 10.405 -13.123 205 HD2 TYR 27 HD2 TYR 27 14.947 14.701 -13.024 206 HE1 TYR 27 HE1 TYR 27 16.808 10.247 -11.833 207 HE2 TYR 27 HE2 TYR 27 16.999 14.583 -11.654 208 HH TYR 27 HH TYR 27 18.504 11.383 -10.848 209 H GLU 28 H GLU 28 12.653 15.152 -15.679 210 HA GLU 28 HA GLU 28 15.309 16.297 -16.340 211 HB2 GLU 28 HB2 GLU 28 14.207 15.749 -18.384 212 HB3 GLU 28 HB3 GLU 28 12.686 16.504 -17.865 213 HG2 GLU 28 HG2 GLU 28 13.540 18.652 -18.056 214 HG3 GLU 28 HG3 GLU 28 15.238 18.104 -18.071 215 H THR 29 H THR 29 15.674 18.290 -15.331 216 HA THR 29 HA THR 29 13.570 19.987 -14.414 217 HB THR 29 HB THR 29 13.536 18.187 -12.715 218 HG1 THR 29 HG1 THR 29 12.994 20.055 -11.905 219 HG21 THR 29 HG21 THR 29 15.314 17.672 -11.252 220 HG22 THR 29 HG22 THR 29 16.386 18.906 -11.992 221 HG23 THR 29 HG23 THR 29 15.924 17.454 -12.887 222 H SER 30 H SER 30 14.681 21.908 -13.225 223 HA SER 30 HA SER 30 17.524 22.271 -13.961 224 HB2 SER 30 HB2 SER 30 15.270 24.230 -14.591 225 HB3 SER 30 HB3 SER 30 16.983 24.475 -14.926 226 HG SER 30 HG SER 30 15.086 22.783 -16.084 227 H ARG 31 H ARG 31 17.510 21.769 -11.513 228 HA ARG 31 HA ARG 31 17.596 24.321 -10.154 229 HB2 ARG 31 HB2 ARG 31 15.955 23.690 -8.363 230 HB3 ARG 31 HB3 ARG 31 15.234 23.929 -9.948 231 HG2 ARG 31 HG2 ARG 31 15.191 21.469 -10.314 232 HG3 ARG 31 HG3 ARG 31 15.936 21.201 -8.744 233 HD2 ARG 31 HD2 ARG 31 13.466 20.861 -8.764 234 HD3 ARG 31 HD3 ARG 31 13.984 22.094 -7.614 235 HE ARG 31 HE ARG 31 12.843 22.655 -10.332 236 HH11 ARG 31 HH11 ARG 31 13.333 23.789 -6.956 237 HH12 ARG 31 HH12 ARG 31 12.240 25.117 -7.163 238 HH21 ARG 31 HH21 ARG 31 11.670 24.501 -10.600 239 HH22 ARG 31 HH22 ARG 31 11.263 25.543 -9.287 240 H ASP 32 H ASP 32 18.068 24.065 -7.839 241 HA ASP 32 HA ASP 32 20.036 21.904 -7.287 242 HB2 ASP 32 HB2 ASP 32 19.728 24.774 -6.316 243 HB3 ASP 32 HB3 ASP 32 20.819 23.610 -5.582 244 H SER 33 H SER 33 20.157 21.578 -4.810 245 HA SER 33 HA SER 33 19.257 20.867 -2.865 246 HB2 SER 33 HB2 SER 33 18.799 23.370 -2.893 247 HB3 SER 33 HB3 SER 33 17.116 22.980 -3.267 248 HG SER 33 HG SER 33 17.344 23.267 -1.121 249 H ILE 34 H ILE 34 18.533 19.374 -5.209 250 HA ILE 34 HA ILE 34 15.777 18.894 -5.292 251 HB ILE 34 HB ILE 34 18.214 17.639 -6.393 252 HG12 ILE 34 HG12 ILE 34 15.345 17.920 -7.426 253 HG13 ILE 34 HG13 ILE 34 16.587 19.177 -7.527 254 HG21 ILE 34 HG21 ILE 34 15.845 15.831 -5.875 255 HG22 ILE 34 HG22 ILE 34 17.111 15.473 -7.071 256 HG23 ILE 34 HG23 ILE 34 17.509 15.567 -5.359 257 HD11 ILE 34 HD11 ILE 34 16.608 18.209 -9.605 258 HD12 ILE 34 HD12 ILE 34 17.954 17.377 -8.809 259 HD13 ILE 34 HD13 ILE 34 16.353 16.558 -8.983 260 HA PRO 35 HA PRO 35 15.046 16.543 -1.583 261 HB2 PRO 35 HB2 PRO 35 12.791 15.169 -2.419 262 HB3 PRO 35 HB3 PRO 35 12.768 16.888 -1.884 263 HG2 PRO 35 HG2 PRO 35 12.878 15.748 -4.698 264 HG3 PRO 35 HG3 PRO 35 11.884 17.082 -4.117 265 HD2 PRO 35 HD2 PRO 35 14.135 17.515 -5.448 266 HD3 PRO 35 HD3 PRO 35 13.710 18.535 -4.038 267 H THR 36 H THR 36 16.681 14.990 -1.387 268 HA THR 36 HA THR 36 17.346 12.975 -3.220 269 HB THR 36 HB THR 36 17.782 12.643 -0.249 270 HG1 THR 36 HG1 THR 36 19.496 14.137 -0.404 271 HG21 THR 36 HG21 THR 36 18.764 11.014 -1.879 272 HG22 THR 36 HG22 THR 36 20.004 11.899 -0.975 273 HG23 THR 36 HG23 THR 36 19.643 12.347 -2.656 274 H GLU 37 H GLU 37 14.854 13.091 -0.683 275 HA GLU 37 HA GLU 37 14.334 10.319 -0.468 276 HB2 GLU 37 HB2 GLU 37 12.122 10.989 0.378 277 HB3 GLU 37 HB3 GLU 37 13.439 11.891 1.126 278 HG2 GLU 37 HG2 GLU 37 12.946 13.851 -0.311 279 HG3 GLU 37 HG3 GLU 37 11.614 12.963 -1.057 280 H LEU 38 H LEU 38 12.917 12.768 -2.665 281 HA LEU 38 HA LEU 38 11.202 10.974 -4.094 282 HB2 LEU 38 HB2 LEU 38 12.194 13.756 -4.392 283 HB3 LEU 38 HB3 LEU 38 11.851 12.943 -5.912 284 HG LEU 38 HG LEU 38 9.552 12.511 -5.240 285 HD11 LEU 38 HD11 LEU 38 10.368 14.008 -2.709 286 HD12 LEU 38 HD12 LEU 38 9.689 12.359 -2.823 287 HD13 LEU 38 HD13 LEU 38 8.704 13.786 -3.230 288 HD21 LEU 38 HD21 LEU 38 8.822 14.849 -5.385 289 HD22 LEU 38 HD22 LEU 38 10.258 14.616 -6.401 290 HD23 LEU 38 HD23 LEU 38 10.401 15.419 -4.830 291 H LEU 39 H LEU 39 14.494 12.245 -4.714 292 HA LEU 39 HA LEU 39 14.977 11.110 -7.187 293 HB2 LEU 39 HB2 LEU 39 16.405 12.723 -6.194 294 HB3 LEU 39 HB3 LEU 39 16.841 11.662 -4.872 295 HG LEU 39 HG LEU 39 18.519 12.064 -6.707 296 HD11 LEU 39 HD11 LEU 39 17.990 9.114 -6.178 297 HD12 LEU 39 HD12 LEU 39 18.680 10.259 -5.005 298 HD13 LEU 39 HD13 LEU 39 19.524 9.906 -6.528 299 HD21 LEU 39 HD21 LEU 39 16.906 10.022 -8.281 300 HD22 LEU 39 HD22 LEU 39 18.471 10.737 -8.705 301 HD23 LEU 39 HD23 LEU 39 17.018 11.760 -8.639 302 H ASN 40 H ASN 40 15.745 9.746 -3.966 303 HA ASN 40 HA ASN 40 16.589 7.178 -4.818 304 HB2 ASN 40 HB2 ASN 40 15.447 8.098 -2.159 305 HB3 ASN 40 HB3 ASN 40 16.161 6.512 -2.450 306 HD21 ASN 40 HD21 ASN 40 17.098 8.439 -0.507 307 HD22 ASN 40 HD22 ASN 40 18.744 8.825 -0.966 308 H LYS 41 H LYS 41 13.362 8.396 -3.792 309 HA LYS 41 HA LYS 41 12.004 5.932 -3.842 310 HB2 LYS 41 HB2 LYS 41 11.197 8.017 -2.799 311 HB3 LYS 41 HB3 LYS 41 10.915 8.756 -4.378 312 HG2 LYS 41 HG2 LYS 41 9.111 7.274 -4.845 313 HG3 LYS 41 HG3 LYS 41 9.695 6.129 -3.625 314 HD2 LYS 41 HD2 LYS 41 7.682 7.174 -2.849 315 HD3 LYS 41 HD3 LYS 41 9.062 7.572 -1.804 316 HE2 LYS 41 HE2 LYS 41 9.243 9.778 -3.146 317 HE3 LYS 41 HE3 LYS 41 7.690 9.325 -3.867 318 HZ1 LYS 41 HZ1 LYS 41 8.188 10.124 -1.067 319 HZ2 LYS 41 HZ2 LYS 41 6.888 9.187 -1.478 320 HZ3 LYS 41 HZ3 LYS 41 7.075 10.639 -2.171 321 H TRP 42 H TRP 42 12.685 8.223 -6.499 322 HA TRP 42 HA TRP 42 11.092 6.939 -8.438 323 HB2 TRP 42 HB2 TRP 42 13.712 8.373 -8.937 324 HB3 TRP 42 HB3 TRP 42 12.491 7.988 -10.145 325 HD1 TRP 42 HD1 TRP 42 10.050 9.026 -8.096 326 HE1 TRP 42 HE1 TRP 42 9.639 11.552 -7.993 327 HE3 TRP 42 HE3 TRP 42 14.602 10.580 -9.751 328 HZ2 TRP 42 HZ2 TRP 42 11.224 13.974 -8.378 329 HZ3 TRP 42 HZ3 TRP 42 15.188 13.004 -9.716 330 HH2 TRP 42 HH2 TRP 42 13.547 14.663 -8.989 331 H LYS 43 H LYS 43 14.581 6.436 -7.673 332 HA LYS 43 HA LYS 43 14.782 4.315 -9.633 333 HB2 LYS 43 HB2 LYS 43 16.977 3.792 -8.509 334 HB3 LYS 43 HB3 LYS 43 16.808 5.419 -9.140 335 HG2 LYS 43 HG2 LYS 43 16.273 6.240 -6.853 336 HG3 LYS 43 HG3 LYS 43 16.553 4.606 -6.218 337 HD2 LYS 43 HD2 LYS 43 18.581 6.417 -7.589 338 HD3 LYS 43 HD3 LYS 43 18.445 6.106 -5.854 339 HE2 LYS 43 HE2 LYS 43 18.807 3.639 -6.342 340 HE3 LYS 43 HE3 LYS 43 19.144 4.093 -8.028 341 HZ1 LYS 43 HZ1 LYS 43 21.207 3.986 -6.877 342 HZ2 LYS 43 HZ2 LYS 43 20.624 4.876 -5.613 343 HZ3 LYS 43 HZ3 LYS 43 20.906 5.596 -7.034 344 H GLN 44 H GLN 44 13.903 4.370 -6.240 345 HA GLN 44 HA GLN 44 14.138 1.625 -5.639 346 HB2 GLN 44 HB2 GLN 44 13.711 3.417 -3.951 347 HB3 GLN 44 HB3 GLN 44 12.178 3.756 -4.700 348 HG2 GLN 44 HG2 GLN 44 11.392 2.558 -3.017 349 HG3 GLN 44 HG3 GLN 44 11.609 1.210 -4.120 350 HE21 GLN 44 HE21 GLN 44 11.694 1.586 -1.113 351 HE22 GLN 44 HE22 GLN 44 13.241 1.058 -0.529 352 H HIS 45 H HIS 45 11.295 3.509 -6.799 353 HA HIS 45 HA HIS 45 9.871 0.986 -7.461 354 HB2 HIS 45 HB2 HIS 45 8.776 3.811 -7.293 355 HB3 HIS 45 HB3 HIS 45 7.873 2.306 -7.357 356 HD1 HIS 45 HD1 HIS 45 8.218 0.695 -5.110 357 HD2 HIS 45 HD2 HIS 45 9.241 4.739 -5.016 358 HE1 HIS 45 HE1 HIS 45 8.207 1.391 -2.627 359 H LYS 46 H LYS 46 12.032 1.914 -9.166 360 HA LYS 46 HA LYS 46 11.343 3.408 -11.334 361 HB2 LYS 46 HB2 LYS 46 13.576 2.428 -10.913 362 HB3 LYS 46 HB3 LYS 46 12.971 0.853 -11.446 363 HG2 LYS 46 HG2 LYS 46 12.319 2.620 -13.541 364 HG3 LYS 46 HG3 LYS 46 13.867 3.209 -13.005 365 HD2 LYS 46 HD2 LYS 46 13.312 0.279 -13.657 366 HD3 LYS 46 HD3 LYS 46 13.766 1.439 -14.858 367 HE2 LYS 46 HE2 LYS 46 15.514 0.882 -12.453 368 HE3 LYS 46 HE3 LYS 46 15.632 0.030 -13.998 369 HZ1 LYS 46 HZ1 LYS 46 16.064 2.909 -13.577 370 HZ2 LYS 46 HZ2 LYS 46 15.927 2.188 -15.071 371 HZ3 LYS 46 HZ3 LYS 46 17.159 1.765 -14.090 372 H GLN 47 H GLN 47 10.808 -0.224 -11.374 373 HA GLN 47 HA GLN 47 9.511 -0.033 -13.899 374 HB2 GLN 47 HB2 GLN 47 10.294 -2.098 -12.148 375 HB3 GLN 47 HB3 GLN 47 8.557 -2.318 -12.351 376 HG2 GLN 47 HG2 GLN 47 10.364 -1.840 -14.763 377 HG3 GLN 47 HG3 GLN 47 10.288 -3.414 -14.009 378 HE21 GLN 47 HE21 GLN 47 7.610 -1.000 -14.871 379 HE22 GLN 47 HE22 GLN 47 6.804 -2.167 -15.856 380 H GLU 48 H GLU 48 8.196 0.232 -10.665 381 HA GLU 48 HA GLU 48 5.456 0.047 -11.305 382 HB2 GLU 48 HB2 GLU 48 6.359 1.804 -9.024 383 HB3 GLU 48 HB3 GLU 48 5.043 0.629 -9.103 384 HG2 GLU 48 HG2 GLU 48 6.915 -1.180 -9.264 385 HG3 GLU 48 HG3 GLU 48 8.024 0.108 -8.805 386 H LEU 49 H LEU 49 7.656 2.828 -11.101 387 HA LEU 49 HA LEU 49 5.740 4.863 -11.829 388 HB2 LEU 49 HB2 LEU 49 8.767 4.684 -12.107 389 HB3 LEU 49 HB3 LEU 49 7.867 6.120 -12.523 390 HG LEU 49 HG LEU 49 7.457 4.920 -9.772 391 HD11 LEU 49 HD11 LEU 49 9.711 6.812 -10.494 392 HD12 LEU 49 HD12 LEU 49 9.909 5.054 -10.270 393 HD13 LEU 49 HD13 LEU 49 9.324 6.036 -8.913 394 HD21 LEU 49 HD21 LEU 49 5.984 6.765 -10.329 395 HD22 LEU 49 HD22 LEU 49 7.331 7.721 -10.983 396 HD23 LEU 49 HD23 LEU 49 7.245 7.386 -9.260 397 H ILE 50 H ILE 50 8.114 2.901 -13.657 398 HA ILE 50 HA ILE 50 7.691 4.193 -16.118 399 HB ILE 50 HB ILE 50 8.444 1.303 -15.546 400 HG12 ILE 50 HG12 ILE 50 10.262 3.372 -16.813 401 HG13 ILE 50 HG13 ILE 50 10.051 3.384 -15.059 402 HG21 ILE 50 HG21 ILE 50 9.229 1.211 -17.995 403 HG22 ILE 50 HG22 ILE 50 7.499 1.102 -17.693 404 HG23 ILE 50 HG23 ILE 50 8.181 2.623 -18.244 405 HD11 ILE 50 HD11 ILE 50 10.970 1.191 -14.819 406 HD12 ILE 50 HD12 ILE 50 10.858 0.839 -16.552 407 HD13 ILE 50 HD13 ILE 50 12.017 2.045 -15.974 408 H ASP 51 H ASP 51 6.033 1.292 -14.845 409 HA ASP 51 HA ASP 51 4.337 0.851 -17.026 410 HB2 ASP 51 HB2 ASP 51 4.655 -0.502 -14.867 411 HB3 ASP 51 HB3 ASP 51 3.520 0.620 -14.099 412 H PHE 52 H PHE 52 4.013 3.183 -14.374 413 HA PHE 52 HA PHE 52 1.394 4.062 -15.102 414 HB2 PHE 52 HB2 PHE 52 2.228 4.322 -12.877 415 HB3 PHE 52 HB3 PHE 52 3.534 5.364 -13.408 416 HD1 PHE 52 HD1 PHE 52 3.182 7.689 -13.957 417 HD2 PHE 52 HD2 PHE 52 -0.152 5.188 -12.882 418 HE1 PHE 52 HE1 PHE 52 1.786 9.708 -13.602 419 HE2 PHE 52 HE2 PHE 52 -1.560 7.219 -12.594 420 HZ PHE 52 HZ PHE 52 -0.524 9.496 -12.887 421 H LEU 53 H LEU 53 4.638 5.601 -15.605 422 HA LEU 53 HA LEU 53 3.648 7.779 -17.166 423 HB2 LEU 53 HB2 LEU 53 6.325 6.386 -16.930 424 HB3 LEU 53 HB3 LEU 53 6.084 7.637 -18.126 425 HG LEU 53 HG LEU 53 7.196 8.658 -16.425 426 HD11 LEU 53 HD11 LEU 53 4.331 9.507 -15.944 427 HD12 LEU 53 HD12 LEU 53 5.357 10.018 -17.312 428 HD13 LEU 53 HD13 LEU 53 5.794 10.461 -15.676 429 HD21 LEU 53 HD21 LEU 53 6.552 8.734 -14.055 430 HD22 LEU 53 HD22 LEU 53 6.967 7.110 -14.618 431 HD23 LEU 53 HD23 LEU 53 5.271 7.551 -14.380 432 H ASN 54 H ASN 54 4.307 4.412 -17.996 433 HA ASN 54 HA ASN 54 4.438 4.871 -20.857 434 HB2 ASN 54 HB2 ASN 54 5.165 2.748 -19.271 435 HB3 ASN 54 HB3 ASN 54 3.654 2.153 -19.851 436 HD21 ASN 54 HD21 ASN 54 6.880 3.174 -20.550 437 HD22 ASN 54 HD22 ASN 54 7.009 2.619 -22.195 438 H GLN 55 H GLN 55 1.915 3.523 -18.634 439 HA GLN 55 HA GLN 55 -0.043 3.452 -20.715 440 HB2 GLN 55 HB2 GLN 55 -1.610 2.801 -19.034 441 HB3 GLN 55 HB3 GLN 55 -0.062 1.994 -18.760 442 HG2 GLN 55 HG2 GLN 55 -0.759 2.567 -16.623 443 HG3 GLN 55 HG3 GLN 55 0.435 3.756 -17.034 444 HE21 GLN 55 HE21 GLN 55 -0.081 5.720 -16.174 445 HE22 GLN 55 HE22 GLN 55 -1.714 6.340 -16.008 446 H LEU 56 H LEU 56 1.007 6.041 -18.568 447 HA LEU 56 HA LEU 56 -1.289 7.722 -18.711 448 HB2 LEU 56 HB2 LEU 56 0.487 7.942 -17.033 449 HB3 LEU 56 HB3 LEU 56 1.682 8.227 -18.303 450 HG LEU 56 HG LEU 56 0.614 10.410 -18.810 451 HD11 LEU 56 HD11 LEU 56 -1.033 11.340 -17.209 452 HD12 LEU 56 HD12 LEU 56 -1.119 9.769 -16.372 453 HD13 LEU 56 HD13 LEU 56 -1.689 9.938 -18.050 454 HD21 LEU 56 HD21 LEU 56 1.342 11.492 -16.697 455 HD22 LEU 56 HD22 LEU 56 2.501 10.323 -17.341 456 HD23 LEU 56 HD23 LEU 56 1.472 9.887 -15.952 457 H ASP 57 H ASP 57 1.242 7.063 -21.016 458 HA ASP 57 HA ASP 57 0.292 9.360 -22.697 459 HB2 ASP 57 HB2 ASP 57 2.710 9.163 -21.617 460 HB3 ASP 57 HB3 ASP 57 3.022 8.109 -22.983 461 H SER 58 H SER 58 0.956 5.907 -22.673 462 HA SER 58 HA SER 58 0.204 5.780 -25.573 463 HB2 SER 58 HB2 SER 58 2.073 3.954 -24.017 464 HB3 SER 58 HB3 SER 58 1.612 3.777 -25.717 465 HG SER 58 HG SER 58 2.910 6.007 -24.549 466 H GLU 59 H GLU 59 -0.768 4.896 -22.439 467 HA GLU 59 HA GLU 59 -2.129 3.416 -21.476 468 HB2 GLU 59 HB2 GLU 59 -4.376 3.590 -22.196 469 HB3 GLU 59 HB3 GLU 59 -3.561 5.128 -22.451 470 HG2 GLU 59 HG2 GLU 59 -3.437 4.744 -24.850 471 HG3 GLU 59 HG3 GLU 59 -3.973 3.066 -24.676 472 H GLU 60 H GLU 60 -0.672 1.942 -24.017 473 HA GLU 60 HA GLU 60 -2.279 -0.561 -23.558 474 HB2 GLU 60 HB2 GLU 60 -1.897 -1.097 -25.882 475 HB3 GLU 60 HB3 GLU 60 -2.611 0.519 -25.736 476 HG2 GLU 60 HG2 GLU 60 -0.181 1.428 -25.907 477 HG3 GLU 60 HG3 GLU 60 0.312 -0.174 -26.296 478 H GLN 61 H GLN 61 0.950 0.719 -23.527 479 HA GLN 61 HA GLN 61 2.992 -0.203 -23.332 480 HB2 GLN 61 HB2 GLN 61 1.385 -0.796 -21.237 481 HB3 GLN 61 HB3 GLN 61 1.960 -2.409 -21.599 482 HG2 GLN 61 HG2 GLN 61 3.536 0.092 -20.954 483 HG3 GLN 61 HG3 GLN 61 3.376 -1.323 -19.927 484 HE21 GLN 61 HE21 GLN 61 5.143 0.114 -22.581 485 HE22 GLN 61 HE22 GLN 61 6.085 -1.332 -23.027 486 H THR 62 H THR 62 1.695 -1.190 -25.678 487 HA THR 62 HA THR 62 2.129 -3.988 -26.075 488 HB THR 62 HB THR 62 1.964 -1.729 -28.111 489 HG1 THR 62 HG1 THR 62 -0.014 -3.189 -26.707 490 HG21 THR 62 HG21 THR 62 0.786 -3.427 -29.532 491 HG22 THR 62 HG22 THR 62 1.300 -4.682 -28.398 492 HG23 THR 62 HG23 THR 62 2.507 -3.752 -29.306 493 H LYS 63 H LYS 63 4.471 -1.529 -25.805 494 HA LYS 63 HA LYS 63 6.484 -2.864 -27.528 495 HB2 LYS 63 HB2 LYS 63 7.711 -0.674 -27.118 496 HB3 LYS 63 HB3 LYS 63 6.270 -0.624 -28.130 497 HG2 LYS 63 HG2 LYS 63 4.928 0.350 -26.332 498 HG3 LYS 63 HG3 LYS 63 6.208 0.074 -25.152 499 HD2 LYS 63 HD2 LYS 63 6.101 2.434 -25.795 500 HD3 LYS 63 HD3 LYS 63 7.644 1.697 -26.239 501 HE2 LYS 63 HE2 LYS 63 6.983 3.048 -28.081 502 HE3 LYS 63 HE3 LYS 63 6.784 1.376 -28.575 503 HZ1 LYS 63 HZ1 LYS 63 4.990 2.618 -29.303 504 HZ2 LYS 63 HZ2 LYS 63 4.659 3.303 -27.870 505 HZ3 LYS 63 HZ3 LYS 63 4.356 1.701 -28.075 Start of MODEL 16 1 H1 GLY 1 H GLY 1 3.867 -0.790 -0.566 2 HA2 GLY 1 HA2 GLY 1 2.032 -0.740 -2.189 3 HA3 GLY 1 HA3 GLY 1 0.992 -0.126 -0.891 4 H ILE 2 H ILE 2 2.709 0.790 -3.570 5 HA ILE 2 HA ILE 2 2.948 3.588 -2.709 6 HB ILE 2 HB ILE 2 5.278 2.623 -2.827 7 HG12 ILE 2 HG12 ILE 2 6.358 4.001 -4.371 8 HG13 ILE 2 HG13 ILE 2 4.848 4.277 -5.271 9 HG21 ILE 2 HG21 ILE 2 4.330 1.593 -5.498 10 HG22 ILE 2 HG22 ILE 2 6.009 1.879 -5.234 11 HG23 ILE 2 HG23 ILE 2 5.161 0.714 -4.207 12 HD11 ILE 2 HD11 ILE 2 5.430 6.218 -3.877 13 HD12 ILE 2 HD12 ILE 2 3.953 5.493 -3.249 14 HD13 ILE 2 HD13 ILE 2 5.526 5.196 -2.442 15 H ASP 3 H ASP 3 2.566 5.010 -4.512 16 HA ASP 3 HA ASP 3 0.969 3.768 -6.681 17 HB2 ASP 3 HB2 ASP 3 0.464 6.413 -5.332 18 HB3 ASP 3 HB3 ASP 3 -0.474 5.662 -6.589 19 H ALA 4 H ALA 4 1.939 4.196 -8.498 20 HA ALA 4 HA ALA 4 4.331 5.721 -8.767 21 HB1 ALA 4 HB1 ALA 4 3.917 5.475 -11.208 22 HB2 ALA 4 HB2 ALA 4 3.736 3.927 -10.344 23 HB3 ALA 4 HB3 ALA 4 2.295 4.843 -10.842 24 H ALA 5 H ALA 5 0.948 6.513 -9.428 25 HA ALA 5 HA ALA 5 1.231 9.074 -10.563 26 HB1 ALA 5 HB1 ALA 5 -0.903 7.874 -10.569 27 HB2 ALA 5 HB2 ALA 5 -0.953 7.861 -8.788 28 HB3 ALA 5 HB3 ALA 5 -1.123 9.384 -9.650 29 H GLN 6 H GLN 6 0.997 8.161 -7.134 30 HA GLN 6 HA GLN 6 0.876 10.792 -6.048 31 HB2 GLN 6 HB2 GLN 6 1.907 8.114 -5.011 32 HB3 GLN 6 HB3 GLN 6 2.084 9.560 -4.046 33 HG2 GLN 6 HG2 GLN 6 -0.659 8.819 -5.120 34 HG3 GLN 6 HG3 GLN 6 0.008 8.006 -3.698 35 HE21 GLN 6 HE21 GLN 6 -1.844 10.754 -4.601 36 HE22 GLN 6 HE22 GLN 6 -1.466 11.729 -3.212 37 H ILE 7 H ILE 7 3.660 8.729 -6.964 38 HA ILE 7 HA ILE 7 5.634 10.482 -5.930 39 HB ILE 7 HB ILE 7 5.866 8.377 -8.094 40 HG12 ILE 7 HG12 ILE 7 6.536 7.852 -5.204 41 HG13 ILE 7 HG13 ILE 7 4.906 7.597 -5.743 42 HG21 ILE 7 HG21 ILE 7 7.837 9.675 -6.171 43 HG22 ILE 7 HG22 ILE 7 8.245 8.269 -7.196 44 HG23 ILE 7 HG23 ILE 7 7.839 9.833 -7.925 45 HD11 ILE 7 HD11 ILE 7 6.834 6.330 -7.560 46 HD12 ILE 7 HD12 ILE 7 6.907 5.713 -5.875 47 HD13 ILE 7 HD13 ILE 7 5.397 5.681 -6.797 48 H VAL 8 H VAL 8 4.091 10.182 -9.173 49 HA VAL 8 HA VAL 8 5.936 12.015 -10.448 50 HB VAL 8 HB VAL 8 3.142 11.087 -11.222 51 HG11 VAL 8 HG11 VAL 8 3.724 11.852 -13.535 52 HG12 VAL 8 HG12 VAL 8 3.594 13.190 -12.400 53 HG13 VAL 8 HG13 VAL 8 5.200 12.616 -12.891 54 HG21 VAL 8 HG21 VAL 8 4.670 9.232 -11.240 55 HG22 VAL 8 HG22 VAL 8 4.435 9.730 -12.917 56 HG23 VAL 8 HG23 VAL 8 5.917 10.197 -12.065 57 H ASP 9 H ASP 9 2.780 12.346 -8.803 58 HA ASP 9 HA ASP 9 2.265 15.036 -9.461 59 HB2 ASP 9 HB2 ASP 9 0.686 13.374 -8.450 60 HB3 ASP 9 HB3 ASP 9 1.570 13.496 -6.930 61 H GLU 10 H GLU 10 3.811 13.693 -6.472 62 HA GLU 10 HA GLU 10 4.486 16.251 -5.450 63 HB2 GLU 10 HB2 GLU 10 5.989 15.084 -3.935 64 HB3 GLU 10 HB3 GLU 10 4.403 14.297 -4.020 65 HG2 GLU 10 HG2 GLU 10 5.457 12.583 -5.481 66 HG3 GLU 10 HG3 GLU 10 7.001 13.416 -5.342 67 H ALA 11 H ALA 11 6.281 14.124 -7.691 68 HA ALA 11 HA ALA 11 8.707 15.628 -7.525 69 HB1 ALA 11 HB1 ALA 11 9.298 14.493 -9.665 70 HB2 ALA 11 HB2 ALA 11 8.514 13.321 -8.591 71 HB3 ALA 11 HB3 ALA 11 7.608 14.046 -9.931 72 H LEU 12 H LEU 12 5.797 15.899 -9.621 73 HA LEU 12 HA LEU 12 6.860 18.020 -11.229 74 HB2 LEU 12 HB2 LEU 12 4.063 17.032 -10.613 75 HB3 LEU 12 HB3 LEU 12 4.310 18.430 -11.660 76 HG LEU 12 HG LEU 12 5.546 15.700 -12.192 77 HD11 LEU 12 HD11 LEU 12 3.081 15.606 -12.270 78 HD12 LEU 12 HD12 LEU 12 3.830 15.386 -13.857 79 HD13 LEU 12 HD13 LEU 12 3.067 16.939 -13.438 80 HD21 LEU 12 HD21 LEU 12 5.219 18.186 -13.952 81 HD22 LEU 12 HD22 LEU 12 5.843 16.612 -14.498 82 HD23 LEU 12 HD23 LEU 12 6.751 17.560 -13.312 83 H GLU 13 H GLU 13 5.345 17.970 -8.063 84 HA GLU 13 HA GLU 13 4.667 20.809 -8.013 85 HB2 GLU 13 HB2 GLU 13 4.977 18.672 -5.873 86 HB3 GLU 13 HB3 GLU 13 4.711 20.374 -5.481 87 HG2 GLU 13 HG2 GLU 13 2.706 19.882 -7.342 88 HG3 GLU 13 HG3 GLU 13 2.799 18.349 -6.456 89 H GLN 14 H GLN 14 7.521 18.888 -7.455 90 HA GLN 14 HA GLN 14 9.089 21.060 -6.254 91 HB2 GLN 14 HB2 GLN 14 9.647 18.222 -7.142 92 HB3 GLN 14 HB3 GLN 14 10.887 19.264 -6.432 93 HG2 GLN 14 HG2 GLN 14 9.695 19.322 -4.339 94 HG3 GLN 14 HG3 GLN 14 8.290 18.501 -5.031 95 HE21 GLN 14 HE21 GLN 14 8.817 17.179 -3.049 96 HE22 GLN 14 HE22 GLN 14 9.911 15.838 -3.251 97 H GLY 15 H GLY 15 8.135 20.188 -9.397 98 HA2 GLY 15 HA2 GLY 15 8.733 21.421 -11.344 99 HA3 GLY 15 HA3 GLY 15 10.256 21.895 -10.591 100 H ILE 16 H ILE 16 9.531 18.479 -10.293 101 HA ILE 16 HA ILE 16 11.528 17.960 -12.402 102 HB ILE 16 HB ILE 16 10.764 16.212 -10.052 103 HG12 ILE 16 HG12 ILE 16 13.550 17.179 -10.064 104 HG13 ILE 16 HG13 ILE 16 12.433 18.508 -9.939 105 HG21 ILE 16 HG21 ILE 16 11.500 14.862 -11.897 106 HG22 ILE 16 HG22 ILE 16 12.821 15.975 -12.302 107 HG23 ILE 16 HG23 ILE 16 12.901 14.992 -10.838 108 HD11 ILE 16 HD11 ILE 16 12.961 17.833 -7.724 109 HD12 ILE 16 HD12 ILE 16 11.282 17.321 -8.070 110 HD13 ILE 16 HD13 ILE 16 12.616 16.141 -8.079 111 H THR 17 H THR 17 10.777 17.273 -14.195 112 HA THR 17 HA THR 17 8.114 16.127 -14.535 113 HB THR 17 HB THR 17 10.518 16.858 -16.267 114 HG1 THR 17 HG1 THR 17 8.012 18.037 -16.586 115 HG21 THR 17 HG21 THR 17 9.231 16.404 -18.259 116 HG22 THR 17 HG22 THR 17 7.878 15.761 -17.266 117 HG23 THR 17 HG23 THR 17 9.447 14.944 -17.297 118 H LEU 18 H LEU 18 7.755 13.896 -14.799 119 HA LEU 18 HA LEU 18 10.131 12.086 -14.914 120 HB2 LEU 18 HB2 LEU 18 7.298 11.645 -13.850 121 HB3 LEU 18 HB3 LEU 18 8.424 10.364 -14.203 122 HG LEU 18 HG LEU 18 8.255 12.110 -11.830 123 HD11 LEU 18 HD11 LEU 18 9.680 9.468 -12.411 124 HD12 LEU 18 HD12 LEU 18 8.007 9.623 -11.905 125 HD13 LEU 18 HD13 LEU 18 9.290 10.127 -10.796 126 HD21 LEU 18 HD21 LEU 18 10.313 13.103 -12.746 127 HD22 LEU 18 HD22 LEU 18 10.997 11.485 -12.973 128 HD23 LEU 18 HD23 LEU 18 10.683 12.110 -11.325 129 H PHE 19 H PHE 19 10.142 10.472 -16.502 130 HA PHE 19 HA PHE 19 7.895 10.106 -18.278 131 HB2 PHE 19 HB2 PHE 19 8.923 10.985 -20.301 132 HB3 PHE 19 HB3 PHE 19 8.554 12.237 -19.167 133 HD1 PHE 19 HD1 PHE 19 10.921 11.075 -21.458 134 HD2 PHE 19 HD2 PHE 19 10.607 13.089 -17.671 135 HE1 PHE 19 HE1 PHE 19 13.161 12.104 -21.815 136 HE2 PHE 19 HE2 PHE 19 12.765 14.172 -18.076 137 HZ PHE 19 HZ PHE 19 14.105 13.666 -20.077 138 H VAL 20 H VAL 20 8.729 8.795 -20.302 139 HA VAL 20 HA VAL 20 11.042 7.091 -19.608 140 HB VAL 20 HB VAL 20 8.350 5.930 -20.426 141 HG11 VAL 20 HG11 VAL 20 10.889 4.495 -19.614 142 HG12 VAL 20 HG12 VAL 20 9.336 3.764 -20.080 143 HG13 VAL 20 HG13 VAL 20 10.268 4.649 -21.274 144 HG21 VAL 20 HG21 VAL 20 8.148 4.971 -18.247 145 HG22 VAL 20 HG22 VAL 20 9.765 5.555 -17.747 146 HG23 VAL 20 HG23 VAL 20 8.435 6.688 -17.992 147 H VAL 21 H VAL 21 12.250 6.627 -21.356 148 HA VAL 21 HA VAL 21 11.097 7.026 -24.076 149 HB VAL 21 HB VAL 21 13.829 8.108 -23.289 150 HG11 VAL 21 HG11 VAL 21 13.629 9.248 -25.506 151 HG12 VAL 21 HG12 VAL 21 13.553 7.501 -25.673 152 HG13 VAL 21 HG13 VAL 21 12.067 8.471 -25.765 153 HG21 VAL 21 HG21 VAL 21 11.240 9.670 -23.534 154 HG22 VAL 21 HG22 VAL 21 12.313 9.505 -22.112 155 HG23 VAL 21 HG23 VAL 21 12.870 10.391 -23.539 156 H ASN 22 H ASN 22 11.716 5.292 -25.364 157 HA ASN 22 HA ASN 22 12.537 3.196 -25.824 158 HB2 ASN 22 HB2 ASN 22 15.075 4.623 -24.935 159 HB3 ASN 22 HB3 ASN 22 15.078 3.001 -25.595 160 HD21 ASN 22 HD21 ASN 22 15.705 6.046 -26.583 161 HD22 ASN 22 HD22 ASN 22 15.132 5.934 -28.238 162 H ASN 23 H ASN 23 11.283 3.459 -23.284 163 HA ASN 23 HA ASN 23 10.778 2.298 -21.457 164 HB2 ASN 23 HB2 ASN 23 11.308 0.327 -23.012 165 HB3 ASN 23 HB3 ASN 23 12.819 0.174 -22.113 166 HD21 ASN 23 HD21 ASN 23 9.270 0.557 -21.491 167 HD22 ASN 23 HD22 ASN 23 9.232 -0.632 -20.200 168 H ARG 24 H ARG 24 13.436 4.028 -21.644 169 HA ARG 24 HA ARG 24 14.781 3.189 -19.137 170 HB2 ARG 24 HB2 ARG 24 15.386 5.488 -21.066 171 HB3 ARG 24 HB3 ARG 24 16.376 4.974 -19.719 172 HG2 ARG 24 HG2 ARG 24 15.777 3.341 -22.223 173 HG3 ARG 24 HG3 ARG 24 17.251 4.227 -21.878 174 HD2 ARG 24 HD2 ARG 24 18.125 2.601 -20.633 175 HD3 ARG 24 HD3 ARG 24 16.652 2.390 -19.684 176 HE ARG 24 HE ARG 24 16.787 1.250 -22.427 177 HH11 ARG 24 HH11 ARG 24 16.440 0.637 -18.977 178 HH12 ARG 24 HH12 ARG 24 16.574 -1.069 -19.068 179 HH21 ARG 24 HH21 ARG 24 16.804 -1.024 -22.649 180 HH22 ARG 24 HH22 ARG 24 16.743 -2.046 -21.272 181 H LEU 25 H LEU 25 14.258 4.186 -17.200 182 HA LEU 25 HA LEU 25 12.080 6.144 -17.333 183 HB2 LEU 25 HB2 LEU 25 12.564 4.373 -15.463 184 HB3 LEU 25 HB3 LEU 25 13.741 5.533 -14.848 185 HG LEU 25 HG LEU 25 10.744 6.006 -15.268 186 HD11 LEU 25 HD11 LEU 25 10.602 5.996 -12.867 187 HD12 LEU 25 HD12 LEU 25 12.344 5.730 -12.693 188 HD13 LEU 25 HD13 LEU 25 11.286 4.486 -13.414 189 HD21 LEU 25 HD21 LEU 25 11.160 8.049 -13.763 190 HD22 LEU 25 HD22 LEU 25 11.649 8.181 -15.424 191 HD23 LEU 25 HD23 LEU 25 12.881 7.881 -14.171 192 H GLN 26 H GLN 26 12.380 8.317 -17.600 193 HA GLN 26 HA GLN 26 15.062 9.505 -17.103 194 HB2 GLN 26 HB2 GLN 26 13.023 9.838 -19.335 195 HB3 GLN 26 HB3 GLN 26 14.325 10.995 -19.032 196 HG2 GLN 26 HG2 GLN 26 14.891 8.040 -19.564 197 HG3 GLN 26 HG3 GLN 26 14.739 9.239 -20.852 198 HE21 GLN 26 HE21 GLN 26 16.163 11.201 -20.699 199 HE22 GLN 26 HE22 GLN 26 17.675 11.159 -19.863 200 H TYR 27 H TYR 27 14.978 11.771 -16.509 201 HA TYR 27 HA TYR 27 12.429 12.911 -15.794 202 HB2 TYR 27 HB2 TYR 27 12.900 13.406 -13.517 203 HB3 TYR 27 HB3 TYR 27 12.977 11.674 -13.734 204 HD1 TYR 27 HD1 TYR 27 15.090 10.497 -13.497 205 HD2 TYR 27 HD2 TYR 27 14.902 14.754 -12.977 206 HE1 TYR 27 HE1 TYR 27 17.321 10.443 -12.369 207 HE2 TYR 27 HE2 TYR 27 17.109 14.737 -11.862 208 HH TYR 27 HH TYR 27 19.102 11.789 -11.581 209 H GLU 28 H GLU 28 12.639 15.225 -15.541 210 HA GLU 28 HA GLU 28 15.247 16.323 -16.201 211 HB2 GLU 28 HB2 GLU 28 14.130 15.990 -18.361 212 HB3 GLU 28 HB3 GLU 28 12.624 16.684 -17.727 213 HG2 GLU 28 HG2 GLU 28 13.649 18.294 -19.107 214 HG3 GLU 28 HG3 GLU 28 13.777 18.857 -17.432 215 H THR 29 H THR 29 15.461 18.383 -15.270 216 HA THR 29 HA THR 29 13.264 19.776 -14.013 217 HB THR 29 HB THR 29 13.564 18.026 -12.411 218 HG1 THR 29 HG1 THR 29 14.968 20.222 -11.367 219 HG21 THR 29 HG21 THR 29 15.954 17.334 -13.030 220 HG22 THR 29 HG22 THR 29 15.481 17.306 -11.344 221 HG23 THR 29 HG23 THR 29 16.466 18.647 -11.953 222 H SER 30 H SER 30 14.358 21.717 -12.754 223 HA SER 30 HA SER 30 16.962 22.440 -13.858 224 HB2 SER 30 HB2 SER 30 14.509 24.223 -14.183 225 HB3 SER 30 HB3 SER 30 16.148 24.490 -14.832 226 HG SER 30 HG SER 30 15.778 22.566 -16.119 227 H ARG 31 H ARG 31 17.007 21.732 -11.445 228 HA ARG 31 HA ARG 31 17.226 24.208 -9.921 229 HB2 ARG 31 HB2 ARG 31 15.710 23.583 -8.154 230 HB3 ARG 31 HB3 ARG 31 14.855 23.630 -9.675 231 HG2 ARG 31 HG2 ARG 31 14.009 21.655 -9.196 232 HG3 ARG 31 HG3 ARG 31 15.540 20.976 -9.634 233 HD2 ARG 31 HD2 ARG 31 14.681 20.109 -7.452 234 HD3 ARG 31 HD3 ARG 31 16.321 20.769 -7.434 235 HE ARG 31 HE ARG 31 15.778 22.376 -6.008 236 HH11 ARG 31 HH11 ARG 31 12.701 20.837 -7.044 237 HH12 ARG 31 HH12 ARG 31 11.776 21.739 -5.920 238 HH21 ARG 31 HH21 ARG 31 14.292 23.816 -4.847 239 HH22 ARG 31 HH22 ARG 31 12.645 23.331 -4.642 240 H ASP 32 H ASP 32 18.167 23.928 -7.845 241 HA ASP 32 HA ASP 32 20.212 21.811 -7.689 242 HB2 ASP 32 HB2 ASP 32 21.243 23.324 -6.077 243 HB3 ASP 32 HB3 ASP 32 20.828 24.247 -7.512 244 H SER 33 H SER 33 20.688 21.138 -5.429 245 HA SER 33 HA SER 33 20.151 19.936 -3.610 246 HB2 SER 33 HB2 SER 33 18.232 22.191 -2.950 247 HB3 SER 33 HB3 SER 33 19.186 21.185 -1.843 248 HG SER 33 HG SER 33 19.929 23.326 -3.500 249 H ILE 34 H ILE 34 18.772 18.780 -5.728 250 HA ILE 34 HA ILE 34 15.983 18.609 -5.349 251 HB ILE 34 HB ILE 34 18.050 16.759 -6.553 252 HG12 ILE 34 HG12 ILE 34 15.479 17.992 -7.659 253 HG13 ILE 34 HG13 ILE 34 17.042 18.789 -7.683 254 HG21 ILE 34 HG21 ILE 34 16.350 15.104 -7.255 255 HG22 ILE 34 HG22 ILE 34 16.487 15.120 -5.508 256 HG23 ILE 34 HG23 ILE 34 15.112 15.914 -6.279 257 HD11 ILE 34 HD11 ILE 34 17.902 16.688 -8.931 258 HD12 ILE 34 HD12 ILE 34 16.152 16.390 -9.230 259 HD13 ILE 34 HD13 ILE 34 16.933 17.899 -9.774 260 HA PRO 35 HA PRO 35 15.732 16.599 -1.423 261 HB2 PRO 35 HB2 PRO 35 13.235 15.398 -1.735 262 HB3 PRO 35 HB3 PRO 35 13.502 17.129 -1.296 263 HG2 PRO 35 HG2 PRO 35 12.903 15.875 -3.972 264 HG3 PRO 35 HG3 PRO 35 12.220 17.384 -3.269 265 HD2 PRO 35 HD2 PRO 35 14.168 17.459 -5.088 266 HD3 PRO 35 HD3 PRO 35 14.160 18.595 -3.713 267 H THR 36 H THR 36 17.260 14.940 -1.369 268 HA THR 36 HA THR 36 17.440 12.844 -3.234 269 HB THR 36 HB THR 36 18.409 12.770 -0.368 270 HG1 THR 36 HG1 THR 36 19.738 14.034 -2.547 271 HG21 THR 36 HG21 THR 36 19.645 11.730 -2.953 272 HG22 THR 36 HG22 THR 36 18.877 10.753 -1.697 273 HG23 THR 36 HG23 THR 36 20.362 11.628 -1.319 274 H GLU 37 H GLU 37 15.355 13.276 -0.471 275 HA GLU 37 HA GLU 37 14.693 10.571 0.130 276 HB2 GLU 37 HB2 GLU 37 12.628 11.615 1.119 277 HB3 GLU 37 HB3 GLU 37 14.140 12.338 1.666 278 HG2 GLU 37 HG2 GLU 37 13.828 14.240 0.112 279 HG3 GLU 37 HG3 GLU 37 12.315 13.535 -0.469 280 H LEU 38 H LEU 38 13.435 12.938 -2.274 281 HA LEU 38 HA LEU 38 11.437 11.077 -3.184 282 HB2 LEU 38 HB2 LEU 38 11.504 13.805 -3.282 283 HB3 LEU 38 HB3 LEU 38 12.189 13.473 -4.844 284 HG LEU 38 HG LEU 38 9.461 13.086 -3.762 285 HD11 LEU 38 HD11 LEU 38 9.049 13.426 -6.415 286 HD12 LEU 38 HD12 LEU 38 10.661 14.150 -6.277 287 HD13 LEU 38 HD13 LEU 38 9.307 14.725 -5.295 288 HD21 LEU 38 HD21 LEU 38 9.694 10.795 -4.200 289 HD22 LEU 38 HD22 LEU 38 10.374 11.091 -5.806 290 HD23 LEU 38 HD23 LEU 38 8.681 11.505 -5.435 291 H LEU 39 H LEU 39 14.573 12.326 -4.294 292 HA LEU 39 HA LEU 39 14.734 11.120 -6.803 293 HB2 LEU 39 HB2 LEU 39 16.379 12.675 -5.453 294 HB3 LEU 39 HB3 LEU 39 17.168 11.167 -4.998 295 HG LEU 39 HG LEU 39 16.689 12.251 -7.797 296 HD11 LEU 39 HD11 LEU 39 18.412 13.389 -6.468 297 HD12 LEU 39 HD12 LEU 39 19.075 12.568 -7.873 298 HD13 LEU 39 HD13 LEU 39 19.266 11.853 -6.252 299 HD21 LEU 39 HD21 LEU 39 16.652 9.863 -8.094 300 HD22 LEU 39 HD22 LEU 39 18.057 9.646 -7.014 301 HD23 LEU 39 HD23 LEU 39 18.232 10.440 -8.606 302 H ASN 40 H ASN 40 15.693 9.773 -3.663 303 HA ASN 40 HA ASN 40 16.377 7.182 -4.722 304 HB2 ASN 40 HB2 ASN 40 15.908 8.101 -1.878 305 HB3 ASN 40 HB3 ASN 40 16.200 6.407 -2.295 306 HD21 ASN 40 HD21 ASN 40 18.023 8.432 -0.801 307 HD22 ASN 40 HD22 ASN 40 19.472 8.458 -1.774 308 H LYS 41 H LYS 41 13.281 8.544 -3.512 309 HA LYS 41 HA LYS 41 11.902 6.043 -3.483 310 HB2 LYS 41 HB2 LYS 41 10.916 7.944 -2.422 311 HB3 LYS 41 HB3 LYS 41 10.882 8.881 -3.919 312 HG2 LYS 41 HG2 LYS 41 9.134 7.640 -4.851 313 HG3 LYS 41 HG3 LYS 41 9.451 6.230 -3.817 314 HD2 LYS 41 HD2 LYS 41 7.504 7.023 -2.951 315 HD3 LYS 41 HD3 LYS 41 8.690 7.695 -1.832 316 HE2 LYS 41 HE2 LYS 41 8.237 9.566 -4.024 317 HE3 LYS 41 HE3 LYS 41 6.674 8.992 -3.457 318 HZ1 LYS 41 HZ1 LYS 41 7.287 9.634 -1.224 319 HZ2 LYS 41 HZ2 LYS 41 7.152 10.850 -2.275 320 HZ3 LYS 41 HZ3 LYS 41 8.645 10.414 -1.784 321 H TRP 42 H TRP 42 12.645 8.344 -6.200 322 HA TRP 42 HA TRP 42 11.066 7.045 -8.123 323 HB2 TRP 42 HB2 TRP 42 13.744 8.303 -8.663 324 HB3 TRP 42 HB3 TRP 42 12.450 7.940 -9.831 325 HD1 TRP 42 HD1 TRP 42 10.086 9.242 -7.985 326 HE1 TRP 42 HE1 TRP 42 9.867 11.797 -8.013 327 HE3 TRP 42 HE3 TRP 42 14.801 10.412 -9.532 328 HZ2 TRP 42 HZ2 TRP 42 11.639 14.070 -8.324 329 HZ3 TRP 42 HZ3 TRP 42 15.521 12.819 -9.657 330 HH2 TRP 42 HH2 TRP 42 14.004 14.596 -8.927 331 H LYS 43 H LYS 43 14.552 6.405 -7.399 332 HA LYS 43 HA LYS 43 14.611 4.175 -9.247 333 HB2 LYS 43 HB2 LYS 43 16.724 3.509 -8.123 334 HB3 LYS 43 HB3 LYS 43 16.714 5.154 -8.730 335 HG2 LYS 43 HG2 LYS 43 16.415 6.089 -6.564 336 HG3 LYS 43 HG3 LYS 43 16.138 4.492 -5.818 337 HD2 LYS 43 HD2 LYS 43 18.755 5.303 -7.107 338 HD3 LYS 43 HD3 LYS 43 18.391 5.505 -5.388 339 HE2 LYS 43 HE2 LYS 43 17.996 3.081 -5.134 340 HE3 LYS 43 HE3 LYS 43 18.349 2.831 -6.842 341 HZ1 LYS 43 HZ1 LYS 43 20.278 3.872 -4.858 342 HZ2 LYS 43 HZ2 LYS 43 20.587 3.594 -6.466 343 HZ3 LYS 43 HZ3 LYS 43 20.217 2.352 -5.432 344 H GLN 44 H GLN 44 13.645 4.420 -5.846 345 HA GLN 44 HA GLN 44 13.767 1.748 -5.113 346 HB2 GLN 44 HB2 GLN 44 13.202 3.758 -3.634 347 HB3 GLN 44 HB3 GLN 44 11.595 3.745 -4.339 348 HG2 GLN 44 HG2 GLN 44 11.348 2.649 -2.291 349 HG3 GLN 44 HG3 GLN 44 11.268 1.406 -3.515 350 HE21 GLN 44 HE21 GLN 44 11.874 -0.062 -1.645 351 HE22 GLN 44 HE22 GLN 44 13.619 -0.371 -1.519 352 H HIS 45 H HIS 45 11.217 3.469 -6.960 353 HA HIS 45 HA HIS 45 9.925 0.840 -7.507 354 HB2 HIS 45 HB2 HIS 45 8.447 3.451 -7.183 355 HB3 HIS 45 HB3 HIS 45 7.794 1.845 -7.293 356 HD1 HIS 45 HD1 HIS 45 7.993 0.307 -5.109 357 HD2 HIS 45 HD2 HIS 45 9.206 4.302 -4.753 358 HE1 HIS 45 HE1 HIS 45 8.225 0.801 -2.571 359 H LYS 46 H LYS 46 11.962 1.855 -9.092 360 HA LYS 46 HA LYS 46 11.304 3.511 -11.242 361 HB2 LYS 46 HB2 LYS 46 13.569 2.457 -10.744 362 HB3 LYS 46 HB3 LYS 46 12.966 0.968 -11.469 363 HG2 LYS 46 HG2 LYS 46 12.508 2.415 -13.566 364 HG3 LYS 46 HG3 LYS 46 13.437 3.684 -12.775 365 HD2 LYS 46 HD2 LYS 46 15.424 2.413 -12.819 366 HD3 LYS 46 HD3 LYS 46 14.541 0.908 -13.185 367 HE2 LYS 46 HE2 LYS 46 13.953 1.731 -15.382 368 HE3 LYS 46 HE3 LYS 46 14.797 3.263 -15.063 369 HZ1 LYS 46 HZ1 LYS 46 16.829 1.997 -14.867 370 HZ2 LYS 46 HZ2 LYS 46 16.087 1.657 -16.329 371 HZ3 LYS 46 HZ3 LYS 46 16.019 0.575 -15.089 372 H GLN 47 H GLN 47 10.758 -0.103 -11.174 373 HA GLN 47 HA GLN 47 9.594 -0.020 -13.789 374 HB2 GLN 47 HB2 GLN 47 10.297 -2.014 -11.954 375 HB3 GLN 47 HB3 GLN 47 8.557 -2.225 -12.164 376 HG2 GLN 47 HG2 GLN 47 10.397 -1.902 -14.578 377 HG3 GLN 47 HG3 GLN 47 10.286 -3.438 -13.732 378 HE21 GLN 47 HE21 GLN 47 7.653 -1.038 -14.623 379 HE22 GLN 47 HE22 GLN 47 6.737 -2.209 -15.452 380 H GLU 48 H GLU 48 8.147 0.333 -10.589 381 HA GLU 48 HA GLU 48 5.429 0.219 -11.441 382 HB2 GLU 48 HB2 GLU 48 6.378 1.917 -9.105 383 HB3 GLU 48 HB3 GLU 48 4.833 1.088 -9.345 384 HG2 GLU 48 HG2 GLU 48 6.153 -1.124 -9.306 385 HG3 GLU 48 HG3 GLU 48 7.548 -0.157 -8.795 386 H LEU 49 H LEU 49 7.650 3.019 -11.047 387 HA LEU 49 HA LEU 49 5.869 5.041 -11.991 388 HB2 LEU 49 HB2 LEU 49 8.871 4.694 -12.096 389 HB3 LEU 49 HB3 LEU 49 8.089 6.131 -12.744 390 HG LEU 49 HG LEU 49 7.872 5.260 -9.827 391 HD11 LEU 49 HD11 LEU 49 10.142 5.709 -10.520 392 HD12 LEU 49 HD12 LEU 49 9.545 7.091 -9.557 393 HD13 LEU 49 HD13 LEU 49 9.657 7.238 -11.318 394 HD21 LEU 49 HD21 LEU 49 6.037 6.746 -10.227 395 HD22 LEU 49 HD22 LEU 49 6.957 7.714 -11.394 396 HD23 LEU 49 HD23 LEU 49 7.333 7.808 -9.669 397 H ILE 50 H ILE 50 8.299 3.059 -13.687 398 HA ILE 50 HA ILE 50 7.925 4.184 -16.254 399 HB ILE 50 HB ILE 50 8.515 1.280 -15.549 400 HG12 ILE 50 HG12 ILE 50 10.533 3.189 -16.789 401 HG13 ILE 50 HG13 ILE 50 10.262 3.267 -15.052 402 HG21 ILE 50 HG21 ILE 50 9.406 1.031 -17.929 403 HG22 ILE 50 HG22 ILE 50 7.660 1.195 -17.806 404 HG23 ILE 50 HG23 ILE 50 8.631 2.589 -18.289 405 HD11 ILE 50 HD11 ILE 50 11.122 1.116 -14.661 406 HD12 ILE 50 HD12 ILE 50 10.855 0.571 -16.319 407 HD13 ILE 50 HD13 ILE 50 12.149 1.729 -15.965 408 H ASP 51 H ASP 51 6.234 1.358 -14.904 409 HA ASP 51 HA ASP 51 4.582 0.838 -17.111 410 HB2 ASP 51 HB2 ASP 51 5.025 -0.297 -14.700 411 HB3 ASP 51 HB3 ASP 51 3.535 0.521 -14.304 412 H PHE 52 H PHE 52 4.237 3.191 -14.521 413 HA PHE 52 HA PHE 52 1.568 4.015 -15.197 414 HB2 PHE 52 HB2 PHE 52 2.393 4.223 -12.986 415 HB3 PHE 52 HB3 PHE 52 3.754 5.214 -13.494 416 HD1 PHE 52 HD1 PHE 52 3.626 7.483 -13.048 417 HD2 PHE 52 HD2 PHE 52 -0.004 5.333 -13.916 418 HE1 PHE 52 HE1 PHE 52 2.274 9.571 -12.717 419 HE2 PHE 52 HE2 PHE 52 -1.285 7.430 -13.714 420 HZ PHE 52 HZ PHE 52 -0.110 9.555 -13.094 421 H LEU 53 H LEU 53 4.777 5.623 -15.749 422 HA LEU 53 HA LEU 53 3.764 7.801 -17.247 423 HB2 LEU 53 HB2 LEU 53 6.452 6.448 -17.042 424 HB3 LEU 53 HB3 LEU 53 6.195 7.706 -18.236 425 HG LEU 53 HG LEU 53 7.273 8.729 -16.421 426 HD11 LEU 53 HD11 LEU 53 5.376 10.001 -17.504 427 HD12 LEU 53 HD12 LEU 53 5.808 10.538 -15.878 428 HD13 LEU 53 HD13 LEU 53 4.364 9.545 -16.121 429 HD21 LEU 53 HD21 LEU 53 5.181 7.642 -14.558 430 HD22 LEU 53 HD22 LEU 53 6.415 8.850 -14.139 431 HD23 LEU 53 HD23 LEU 53 6.913 7.225 -14.630 432 H ASN 54 H ASN 54 4.529 4.472 -18.134 433 HA ASN 54 HA ASN 54 4.532 4.942 -20.993 434 HB2 ASN 54 HB2 ASN 54 5.438 2.899 -19.507 435 HB3 ASN 54 HB3 ASN 54 3.893 2.196 -19.910 436 HD21 ASN 54 HD21 ASN 54 7.023 2.379 -20.786 437 HD22 ASN 54 HD22 ASN 54 6.895 2.164 -22.540 438 H GLN 55 H GLN 55 2.091 3.380 -18.801 439 HA GLN 55 HA GLN 55 0.085 3.355 -20.791 440 HB2 GLN 55 HB2 GLN 55 -1.415 2.648 -19.052 441 HB3 GLN 55 HB3 GLN 55 0.153 1.891 -18.826 442 HG2 GLN 55 HG2 GLN 55 -0.413 2.440 -16.668 443 HG3 GLN 55 HG3 GLN 55 0.640 3.724 -17.132 444 HE21 GLN 55 HE21 GLN 55 -0.019 5.805 -16.838 445 HE22 GLN 55 HE22 GLN 55 -1.705 6.308 -16.654 446 H LEU 56 H LEU 56 1.278 6.118 -19.174 447 HA LEU 56 HA LEU 56 -1.044 7.581 -18.607 448 HB2 LEU 56 HB2 LEU 56 1.568 8.037 -18.253 449 HB3 LEU 56 HB3 LEU 56 1.412 8.981 -19.693 450 HG LEU 56 HG LEU 56 0.001 9.357 -17.033 451 HD11 LEU 56 HD11 LEU 56 2.369 10.216 -17.454 452 HD12 LEU 56 HD12 LEU 56 1.192 11.446 -16.970 453 HD13 LEU 56 HD13 LEU 56 1.676 11.301 -18.680 454 HD21 LEU 56 HD21 LEU 56 -1.117 11.356 -17.959 455 HD22 LEU 56 HD22 LEU 56 -1.732 9.824 -18.561 456 HD23 LEU 56 HD23 LEU 56 -0.669 10.818 -19.607 457 H ASP 57 H ASP 57 0.975 7.642 -21.519 458 HA ASP 57 HA ASP 57 -1.251 8.898 -23.040 459 HB2 ASP 57 HB2 ASP 57 1.078 9.971 -22.674 460 HB3 ASP 57 HB3 ASP 57 1.608 8.881 -23.957 461 H SER 58 H SER 58 1.268 6.270 -23.254 462 HA SER 58 HA SER 58 0.379 5.450 -25.850 463 HB2 SER 58 HB2 SER 58 1.750 3.754 -23.722 464 HB3 SER 58 HB3 SER 58 1.730 3.489 -25.473 465 HG SER 58 HG SER 58 3.236 4.887 -25.738 466 H GLU 59 H GLU 59 -0.515 4.640 -22.592 467 HA GLU 59 HA GLU 59 -1.997 3.251 -21.572 468 HB2 GLU 59 HB2 GLU 59 -4.290 3.701 -22.056 469 HB3 GLU 59 HB3 GLU 59 -3.320 5.163 -22.106 470 HG2 GLU 59 HG2 GLU 59 -3.392 5.213 -24.540 471 HG3 GLU 59 HG3 GLU 59 -4.224 3.653 -24.579 472 H GLU 60 H GLU 60 -0.743 2.049 -24.200 473 HA GLU 60 HA GLU 60 -2.501 -0.259 -24.568 474 HB2 GLU 60 HB2 GLU 60 -1.151 -0.649 -26.544 475 HB3 GLU 60 HB3 GLU 60 -1.693 1.001 -26.453 476 HG2 GLU 60 HG2 GLU 60 0.424 1.473 -27.062 477 HG3 GLU 60 HG3 GLU 60 0.705 1.444 -25.337 478 H GLN 61 H GLN 61 0.225 0.339 -22.463 479 HA GLN 61 HA GLN 61 0.508 -2.566 -22.168 480 HB2 GLN 61 HB2 GLN 61 2.847 -2.441 -22.170 481 HB3 GLN 61 HB3 GLN 61 2.282 -1.782 -23.689 482 HG2 GLN 61 HG2 GLN 61 3.636 -0.036 -23.361 483 HG3 GLN 61 HG3 GLN 61 2.666 0.483 -21.999 484 HE21 GLN 61 HE21 GLN 61 5.727 -0.580 -22.991 485 HE22 GLN 61 HE22 GLN 61 6.392 -1.064 -21.431 486 H THR 62 H THR 62 0.758 -3.245 -20.141 487 HA THR 62 HA THR 62 1.812 -1.820 -17.977 488 HB THR 62 HB THR 62 -0.221 -0.485 -18.032 489 HG1 THR 62 HG1 THR 62 0.642 -1.339 -16.010 490 HG21 THR 62 HG21 THR 62 -1.772 -3.116 -17.951 491 HG22 THR 62 HG22 THR 62 -1.762 -1.920 -19.264 492 HG23 THR 62 HG23 THR 62 -2.471 -1.504 -17.708 493 H LYS 63 H LYS 63 1.672 -3.315 -15.975 494 HA LYS 63 HA LYS 63 0.476 -5.895 -16.213 495 HB2 LYS 63 HB2 LYS 63 2.427 -7.343 -16.340 496 HB3 LYS 63 HB3 LYS 63 2.266 -6.382 -17.795 497 HG2 LYS 63 HG2 LYS 63 3.870 -4.738 -16.635 498 HG3 LYS 63 HG3 LYS 63 4.279 -6.088 -15.555 499 HD2 LYS 63 HD2 LYS 63 4.987 -7.416 -17.527 500 HD3 LYS 63 HD3 LYS 63 4.536 -6.077 -18.593 501 HE2 LYS 63 HE2 LYS 63 6.760 -6.112 -16.510 502 HE3 LYS 63 HE3 LYS 63 6.910 -5.936 -18.270 503 HZ1 LYS 63 HZ1 LYS 63 7.148 -3.804 -17.297 504 HZ2 LYS 63 HZ2 LYS 63 5.791 -3.998 -16.375 505 HZ3 LYS 63 HZ3 LYS 63 5.639 -3.824 -18.001 Start of MODEL 17 1 H1 GLY 1 H GLY 1 0.879 1.114 0.621 2 HA2 GLY 1 HA2 GLY 1 2.954 -0.037 0.034 3 HA3 GLY 1 HA3 GLY 1 2.199 -0.462 -1.519 4 H ILE 2 H ILE 2 2.541 0.946 -3.252 5 HA ILE 2 HA ILE 2 2.983 3.767 -2.668 6 HB ILE 2 HB ILE 2 5.263 2.717 -2.699 7 HG12 ILE 2 HG12 ILE 2 6.343 4.102 -4.201 8 HG13 ILE 2 HG13 ILE 2 4.906 4.358 -5.187 9 HG21 ILE 2 HG21 ILE 2 4.205 1.267 -5.017 10 HG22 ILE 2 HG22 ILE 2 5.732 2.036 -5.391 11 HG23 ILE 2 HG23 ILE 2 5.610 0.936 -4.008 12 HD11 ILE 2 HD11 ILE 2 5.266 5.273 -2.290 13 HD12 ILE 2 HD12 ILE 2 5.481 6.291 -3.726 14 HD13 ILE 2 HD13 ILE 2 3.886 5.671 -3.344 15 H ASP 3 H ASP 3 2.810 5.045 -4.669 16 HA ASP 3 HA ASP 3 1.260 3.764 -6.798 17 HB2 ASP 3 HB2 ASP 3 0.513 6.233 -5.261 18 HB3 ASP 3 HB3 ASP 3 -0.211 5.747 -6.771 19 H ALA 4 H ALA 4 2.184 4.300 -8.521 20 HA ALA 4 HA ALA 4 4.481 5.997 -8.723 21 HB1 ALA 4 HB1 ALA 4 4.029 5.761 -11.219 22 HB2 ALA 4 HB2 ALA 4 4.158 4.208 -10.339 23 HB3 ALA 4 HB3 ALA 4 2.569 4.855 -10.797 24 H ALA 5 H ALA 5 1.011 6.462 -9.361 25 HA ALA 5 HA ALA 5 1.028 9.000 -10.544 26 HB1 ALA 5 HB1 ALA 5 -0.952 7.876 -8.482 27 HB2 ALA 5 HB2 ALA 5 -1.271 9.196 -9.617 28 HB3 ALA 5 HB3 ALA 5 -1.003 7.548 -10.220 29 H GLN 6 H GLN 6 1.085 8.133 -7.091 30 HA GLN 6 HA GLN 6 0.995 10.815 -6.060 31 HB2 GLN 6 HB2 GLN 6 1.893 8.104 -4.947 32 HB3 GLN 6 HB3 GLN 6 1.923 9.561 -3.966 33 HG2 GLN 6 HG2 GLN 6 -0.607 8.504 -5.321 34 HG3 GLN 6 HG3 GLN 6 -0.076 8.020 -3.717 35 HE21 GLN 6 HE21 GLN 6 -0.987 11.015 -5.588 36 HE22 GLN 6 HE22 GLN 6 -1.538 11.847 -4.154 37 H ILE 7 H ILE 7 3.719 8.584 -6.863 38 HA ILE 7 HA ILE 7 5.726 10.395 -5.903 39 HB ILE 7 HB ILE 7 5.923 8.289 -8.054 40 HG12 ILE 7 HG12 ILE 7 6.653 7.906 -5.138 41 HG13 ILE 7 HG13 ILE 7 5.134 7.377 -5.820 42 HG21 ILE 7 HG21 ILE 7 8.371 8.276 -7.430 43 HG22 ILE 7 HG22 ILE 7 7.876 9.852 -8.003 44 HG23 ILE 7 HG23 ILE 7 8.050 9.576 -6.254 45 HD11 ILE 7 HD11 ILE 7 6.221 5.822 -7.337 46 HD12 ILE 7 HD12 ILE 7 7.831 6.367 -6.844 47 HD13 ILE 7 HD13 ILE 7 6.827 5.553 -5.696 48 H VAL 8 H VAL 8 4.124 10.003 -9.082 49 HA VAL 8 HA VAL 8 5.842 11.762 -10.549 50 HB VAL 8 HB VAL 8 2.980 10.796 -10.969 51 HG11 VAL 8 HG11 VAL 8 4.706 12.423 -12.889 52 HG12 VAL 8 HG12 VAL 8 3.225 11.549 -13.341 53 HG13 VAL 8 HG13 VAL 8 3.138 12.893 -12.205 54 HG21 VAL 8 HG21 VAL 8 3.914 9.264 -12.499 55 HG22 VAL 8 HG22 VAL 8 5.493 10.092 -12.523 56 HG23 VAL 8 HG23 VAL 8 4.979 9.175 -11.099 57 H ASP 9 H ASP 9 2.769 12.322 -8.724 58 HA ASP 9 HA ASP 9 2.667 15.031 -9.532 59 HB2 ASP 9 HB2 ASP 9 0.775 13.612 -8.538 60 HB3 ASP 9 HB3 ASP 9 1.454 14.019 -6.948 61 H GLU 10 H GLU 10 4.084 13.597 -6.536 62 HA GLU 10 HA GLU 10 4.734 16.174 -5.428 63 HB2 GLU 10 HB2 GLU 10 6.242 14.956 -3.915 64 HB3 GLU 10 HB3 GLU 10 4.646 14.183 -4.010 65 HG2 GLU 10 HG2 GLU 10 5.493 12.559 -5.587 66 HG3 GLU 10 HG3 GLU 10 7.085 13.320 -5.620 67 H ALA 11 H ALA 11 6.322 14.076 -7.838 68 HA ALA 11 HA ALA 11 8.875 15.407 -7.666 69 HB1 ALA 11 HB1 ALA 11 9.392 14.289 -9.789 70 HB2 ALA 11 HB2 ALA 11 8.586 13.150 -8.695 71 HB3 ALA 11 HB3 ALA 11 7.681 13.891 -10.036 72 H LEU 12 H LEU 12 5.962 15.719 -9.709 73 HA LEU 12 HA LEU 12 6.813 17.929 -11.260 74 HB2 LEU 12 HB2 LEU 12 4.076 16.895 -10.443 75 HB3 LEU 12 HB3 LEU 12 4.242 18.321 -11.457 76 HG LEU 12 HG LEU 12 5.440 15.617 -12.199 77 HD11 LEU 12 HD11 LEU 12 3.557 15.409 -13.770 78 HD12 LEU 12 HD12 LEU 12 2.850 16.919 -13.141 79 HD13 LEU 12 HD13 LEU 12 2.985 15.487 -12.096 80 HD21 LEU 12 HD21 LEU 12 6.575 17.495 -13.302 81 HD22 LEU 12 HD22 LEU 12 5.016 18.165 -13.817 82 HD23 LEU 12 HD23 LEU 12 5.584 16.616 -14.469 83 H GLU 13 H GLU 13 5.432 17.801 -7.959 84 HA GLU 13 HA GLU 13 4.828 20.554 -7.722 85 HB2 GLU 13 HB2 GLU 13 5.550 18.340 -5.794 86 HB3 GLU 13 HB3 GLU 13 5.522 19.996 -5.244 87 HG2 GLU 13 HG2 GLU 13 3.115 20.002 -6.350 88 HG3 GLU 13 HG3 GLU 13 3.267 18.258 -6.249 89 H GLN 14 H GLN 14 7.914 18.825 -7.507 90 HA GLN 14 HA GLN 14 9.268 21.269 -6.538 91 HB2 GLN 14 HB2 GLN 14 10.795 19.016 -7.731 92 HB3 GLN 14 HB3 GLN 14 11.209 20.019 -6.367 93 HG2 GLN 14 HG2 GLN 14 9.343 17.641 -6.394 94 HG3 GLN 14 HG3 GLN 14 10.932 17.749 -5.671 95 HE21 GLN 14 HE21 GLN 14 7.737 17.709 -4.867 96 HE22 GLN 14 HE22 GLN 14 7.765 18.624 -3.370 97 H GLY 15 H GLY 15 8.290 19.886 -9.537 98 HA2 GLY 15 HA2 GLY 15 8.301 21.104 -11.597 99 HA3 GLY 15 HA3 GLY 15 9.854 21.846 -11.168 100 H ILE 16 H ILE 16 9.654 18.507 -10.287 101 HA ILE 16 HA ILE 16 11.461 17.890 -12.456 102 HB ILE 16 HB ILE 16 10.665 16.159 -10.097 103 HG12 ILE 16 HG12 ILE 16 13.411 17.336 -10.146 104 HG13 ILE 16 HG13 ILE 16 12.148 18.491 -9.824 105 HG21 ILE 16 HG21 ILE 16 11.503 14.867 -11.972 106 HG22 ILE 16 HG22 ILE 16 12.870 15.969 -12.199 107 HG23 ILE 16 HG23 ILE 16 12.779 14.938 -10.769 108 HD11 ILE 16 HD11 ILE 16 11.306 16.889 -8.008 109 HD12 ILE 16 HD12 ILE 16 12.841 16.031 -8.209 110 HD13 ILE 16 HD13 ILE 16 12.859 17.720 -7.716 111 H THR 17 H THR 17 10.638 17.334 -14.282 112 HA THR 17 HA THR 17 8.026 16.029 -14.484 113 HB THR 17 HB THR 17 10.143 17.085 -16.399 114 HG1 THR 17 HG1 THR 17 8.522 18.586 -16.785 115 HG21 THR 17 HG21 THR 17 7.589 15.604 -17.103 116 HG22 THR 17 HG22 THR 17 9.253 15.074 -17.421 117 HG23 THR 17 HG23 THR 17 8.624 16.509 -18.250 118 H LEU 18 H LEU 18 7.723 13.889 -14.899 119 HA LEU 18 HA LEU 18 10.119 12.122 -15.067 120 HB2 LEU 18 HB2 LEU 18 7.286 11.612 -14.026 121 HB3 LEU 18 HB3 LEU 18 8.479 10.369 -14.342 122 HG LEU 18 HG LEU 18 8.244 12.247 -12.022 123 HD11 LEU 18 HD11 LEU 18 9.476 9.485 -12.507 124 HD12 LEU 18 HD12 LEU 18 7.829 9.819 -11.943 125 HD13 LEU 18 HD13 LEU 18 9.201 10.237 -10.902 126 HD21 LEU 18 HD21 LEU 18 10.969 11.484 -13.119 127 HD22 LEU 18 HD22 LEU 18 10.664 12.131 -11.473 128 HD23 LEU 18 HD23 LEU 18 10.332 13.120 -12.905 129 H PHE 19 H PHE 19 10.132 10.459 -16.606 130 HA PHE 19 HA PHE 19 7.914 10.057 -18.389 131 HB2 PHE 19 HB2 PHE 19 8.885 10.952 -20.422 132 HB3 PHE 19 HB3 PHE 19 8.563 12.205 -19.263 133 HD1 PHE 19 HD1 PHE 19 10.842 11.117 -21.631 134 HD2 PHE 19 HD2 PHE 19 10.629 13.049 -17.799 135 HE1 PHE 19 HE1 PHE 19 13.134 12.069 -21.976 136 HE2 PHE 19 HE2 PHE 19 12.838 14.058 -18.193 137 HZ PHE 19 HZ PHE 19 14.150 13.519 -20.184 138 H VAL 20 H VAL 20 8.783 8.710 -20.371 139 HA VAL 20 HA VAL 20 11.116 7.083 -19.593 140 HB VAL 20 HB VAL 20 8.532 5.742 -20.436 141 HG11 VAL 20 HG11 VAL 20 11.050 4.686 -19.070 142 HG12 VAL 20 HG12 VAL 20 9.697 3.735 -19.728 143 HG13 VAL 20 HG13 VAL 20 10.767 4.625 -20.814 144 HG21 VAL 20 HG21 VAL 20 8.224 6.791 -18.165 145 HG22 VAL 20 HG22 VAL 20 8.113 5.037 -18.213 146 HG23 VAL 20 HG23 VAL 20 9.589 5.835 -17.576 147 H VAL 21 H VAL 21 12.404 6.826 -21.280 148 HA VAL 21 HA VAL 21 11.312 7.063 -24.040 149 HB VAL 21 HB VAL 21 13.910 8.088 -22.886 150 HG11 VAL 21 HG11 VAL 21 14.421 7.202 -25.076 151 HG12 VAL 21 HG12 VAL 21 12.970 7.967 -25.786 152 HG13 VAL 21 HG13 VAL 21 14.322 8.963 -25.200 153 HG21 VAL 21 HG21 VAL 21 11.618 9.551 -24.285 154 HG22 VAL 21 HG22 VAL 21 11.869 9.495 -22.537 155 HG23 VAL 21 HG23 VAL 21 13.070 10.279 -23.567 156 H ASN 22 H ASN 22 11.516 5.184 -25.100 157 HA ASN 22 HA ASN 22 12.026 3.015 -25.533 158 HB2 ASN 22 HB2 ASN 22 14.859 4.016 -25.158 159 HB3 ASN 22 HB3 ASN 22 14.369 2.555 -26.011 160 HD21 ASN 22 HD21 ASN 22 15.610 5.384 -26.743 161 HD22 ASN 22 HD22 ASN 22 14.822 5.651 -28.289 162 H ASN 23 H ASN 23 11.100 3.142 -22.949 163 HA ASN 23 HA ASN 23 10.888 2.141 -21.145 164 HB2 ASN 23 HB2 ASN 23 11.205 0.186 -22.544 165 HB3 ASN 23 HB3 ASN 23 12.942 0.187 -22.192 166 HD21 ASN 23 HD21 ASN 23 9.854 0.372 -20.227 167 HD22 ASN 23 HD22 ASN 23 10.358 -0.907 -19.183 168 H ARG 24 H ARG 24 13.628 3.915 -21.588 169 HA ARG 24 HA ARG 24 14.883 3.295 -18.986 170 HB2 ARG 24 HB2 ARG 24 15.704 5.267 -21.175 171 HB3 ARG 24 HB3 ARG 24 16.612 4.864 -19.702 172 HG2 ARG 24 HG2 ARG 24 16.533 2.413 -20.498 173 HG3 ARG 24 HG3 ARG 24 15.917 3.043 -22.033 174 HD2 ARG 24 HD2 ARG 24 17.978 4.395 -22.277 175 HD3 ARG 24 HD3 ARG 24 18.628 3.645 -20.806 176 HE ARG 24 HE ARG 24 17.763 1.577 -22.490 177 HH11 ARG 24 HH11 ARG 24 20.125 4.223 -22.899 178 HH12 ARG 24 HH12 ARG 24 21.107 3.349 -24.009 179 HH21 ARG 24 HH21 ARG 24 19.252 0.321 -23.717 180 HH22 ARG 24 HH22 ARG 24 20.685 1.052 -24.367 181 H LEU 25 H LEU 25 14.198 4.374 -17.182 182 HA LEU 25 HA LEU 25 12.155 6.450 -17.423 183 HB2 LEU 25 HB2 LEU 25 12.308 4.564 -15.655 184 HB3 LEU 25 HB3 LEU 25 13.538 5.506 -14.878 185 HG LEU 25 HG LEU 25 10.652 6.340 -15.365 186 HD11 LEU 25 HD11 LEU 25 12.172 5.769 -12.783 187 HD12 LEU 25 HD12 LEU 25 10.944 4.716 -13.518 188 HD13 LEU 25 HD13 LEU 25 10.484 6.294 -12.894 189 HD21 LEU 25 HD21 LEU 25 12.866 7.921 -14.025 190 HD22 LEU 25 HD22 LEU 25 11.129 8.256 -13.808 191 HD23 LEU 25 HD23 LEU 25 11.834 8.406 -15.407 192 H GLN 26 H GLN 26 12.806 8.549 -17.947 193 HA GLN 26 HA GLN 26 15.298 9.545 -16.618 194 HB2 GLN 26 HB2 GLN 26 14.135 10.709 -19.132 195 HB3 GLN 26 HB3 GLN 26 15.714 10.937 -18.454 196 HG2 GLN 26 HG2 GLN 26 16.306 8.558 -19.053 197 HG3 GLN 26 HG3 GLN 26 14.739 8.373 -19.848 198 HE21 GLN 26 HE21 GLN 26 17.909 9.852 -20.166 199 HE22 GLN 26 HE22 GLN 26 17.643 10.387 -21.821 200 H TYR 27 H TYR 27 15.196 12.023 -16.357 201 HA TYR 27 HA TYR 27 12.508 13.066 -15.897 202 HB2 TYR 27 HB2 TYR 27 12.971 13.808 -13.645 203 HB3 TYR 27 HB3 TYR 27 12.952 12.065 -13.769 204 HD1 TYR 27 HD1 TYR 27 15.072 10.788 -13.691 205 HD2 TYR 27 HD2 TYR 27 14.931 14.999 -12.875 206 HE1 TYR 27 HE1 TYR 27 17.291 10.640 -12.450 207 HE2 TYR 27 HE2 TYR 27 17.061 14.873 -11.626 208 HH TYR 27 HH TYR 27 18.762 13.502 -10.862 209 H GLU 28 H GLU 28 12.510 15.352 -15.690 210 HA GLU 28 HA GLU 28 14.991 16.696 -16.624 211 HB2 GLU 28 HB2 GLU 28 13.734 16.240 -18.582 212 HB3 GLU 28 HB3 GLU 28 12.215 16.769 -17.852 213 HG2 GLU 28 HG2 GLU 28 12.619 18.957 -18.223 214 HG3 GLU 28 HG3 GLU 28 14.337 18.846 -17.806 215 H THR 29 H THR 29 15.389 18.437 -15.331 216 HA THR 29 HA THR 29 13.312 20.122 -14.274 217 HB THR 29 HB THR 29 13.376 18.124 -12.747 218 HG1 THR 29 HG1 THR 29 12.949 20.439 -12.080 219 HG21 THR 29 HG21 THR 29 15.849 17.683 -12.931 220 HG22 THR 29 HG22 THR 29 15.185 17.652 -11.312 221 HG23 THR 29 HG23 THR 29 16.105 19.072 -11.852 222 H SER 30 H SER 30 14.405 21.834 -12.895 223 HA SER 30 HA SER 30 17.238 22.311 -13.451 224 HB2 SER 30 HB2 SER 30 15.948 23.214 -15.387 225 HB3 SER 30 HB3 SER 30 15.030 24.235 -14.262 226 HG SER 30 HG SER 30 16.853 25.277 -15.248 227 H ARG 31 H ARG 31 17.367 21.907 -11.178 228 HA ARG 31 HA ARG 31 16.984 24.216 -9.550 229 HB2 ARG 31 HB2 ARG 31 15.612 23.185 -7.774 230 HB3 ARG 31 HB3 ARG 31 14.719 23.490 -9.258 231 HG2 ARG 31 HG2 ARG 31 14.911 21.105 -9.879 232 HG3 ARG 31 HG3 ARG 31 15.752 20.771 -8.358 233 HD2 ARG 31 HD2 ARG 31 12.979 21.979 -8.603 234 HD3 ARG 31 HD3 ARG 31 13.279 20.263 -8.314 235 HE ARG 31 HE ARG 31 14.580 21.168 -6.215 236 HH11 ARG 31 HH11 ARG 31 11.520 22.579 -7.374 237 HH12 ARG 31 HH12 ARG 31 11.109 23.224 -5.814 238 HH21 ARG 31 HH21 ARG 31 13.961 21.819 -4.237 239 HH22 ARG 31 HH22 ARG 31 12.475 22.652 -3.929 240 H ASP 32 H ASP 32 18.139 24.018 -7.562 241 HA ASP 32 HA ASP 32 20.193 21.864 -7.590 242 HB2 ASP 32 HB2 ASP 32 20.118 24.681 -6.437 243 HB3 ASP 32 HB3 ASP 32 21.334 23.488 -5.978 244 H SER 33 H SER 33 20.812 21.070 -5.381 245 HA SER 33 HA SER 33 20.334 19.989 -3.476 246 HB2 SER 33 HB2 SER 33 20.215 22.519 -2.888 247 HB3 SER 33 HB3 SER 33 18.477 22.275 -2.744 248 HG SER 33 HG SER 33 20.425 20.739 -1.343 249 H ILE 34 H ILE 34 18.817 18.920 -5.599 250 HA ILE 34 HA ILE 34 16.047 18.818 -5.211 251 HB ILE 34 HB ILE 34 18.085 17.070 -6.523 252 HG12 ILE 34 HG12 ILE 34 15.360 18.121 -7.420 253 HG13 ILE 34 HG13 ILE 34 16.875 19.004 -7.561 254 HG21 ILE 34 HG21 ILE 34 15.288 15.922 -6.078 255 HG22 ILE 34 HG22 ILE 34 16.531 15.274 -7.159 256 HG23 ILE 34 HG23 ILE 34 16.805 15.260 -5.437 257 HD11 ILE 34 HD11 ILE 34 17.767 17.046 -8.949 258 HD12 ILE 34 HD12 ILE 34 16.078 16.477 -9.037 259 HD13 ILE 34 HD13 ILE 34 16.526 18.078 -9.676 260 HA PRO 35 HA PRO 35 15.487 16.636 -1.409 261 HB2 PRO 35 HB2 PRO 35 12.997 15.488 -1.902 262 HB3 PRO 35 HB3 PRO 35 13.280 17.188 -1.383 263 HG2 PRO 35 HG2 PRO 35 12.738 16.123 -4.155 264 HG3 PRO 35 HG3 PRO 35 12.107 17.605 -3.376 265 HD2 PRO 35 HD2 PRO 35 14.175 17.624 -5.139 266 HD3 PRO 35 HD3 PRO 35 14.109 18.752 -3.759 267 H THR 36 H THR 36 16.918 14.904 -1.232 268 HA THR 36 HA THR 36 17.270 12.901 -3.196 269 HB THR 36 HB THR 36 18.039 12.673 -0.283 270 HG1 THR 36 HG1 THR 36 19.257 14.288 -2.288 271 HG21 THR 36 HG21 THR 36 18.641 10.765 -1.730 272 HG22 THR 36 HG22 THR 36 20.070 11.624 -1.159 273 HG23 THR 36 HG23 THR 36 19.497 11.860 -2.829 274 H GLU 37 H GLU 37 14.964 13.193 -0.544 275 HA GLU 37 HA GLU 37 14.400 10.410 -0.177 276 HB2 GLU 37 HB2 GLU 37 12.337 11.174 0.860 277 HB3 GLU 37 HB3 GLU 37 13.736 12.087 1.439 278 HG2 GLU 37 HG2 GLU 37 13.113 13.934 -0.188 279 HG3 GLU 37 HG3 GLU 37 11.629 13.048 -0.548 280 H LEU 38 H LEU 38 13.226 12.864 -2.445 281 HA LEU 38 HA LEU 38 11.237 11.231 -3.755 282 HB2 LEU 38 HB2 LEU 38 12.304 13.961 -3.925 283 HB3 LEU 38 HB3 LEU 38 12.244 13.253 -5.529 284 HG LEU 38 HG LEU 38 9.844 12.688 -5.189 285 HD11 LEU 38 HD11 LEU 38 8.712 13.926 -3.286 286 HD12 LEU 38 HD12 LEU 38 10.304 14.201 -2.563 287 HD13 LEU 38 HD13 LEU 38 9.685 12.536 -2.779 288 HD21 LEU 38 HD21 LEU 38 10.512 15.620 -4.680 289 HD22 LEU 38 HD22 LEU 38 9.041 14.978 -5.413 290 HD23 LEU 38 HD23 LEU 38 10.584 14.823 -6.274 291 H LEU 39 H LEU 39 14.548 12.311 -4.538 292 HA LEU 39 HA LEU 39 14.885 11.040 -6.967 293 HB2 LEU 39 HB2 LEU 39 16.478 12.537 -5.418 294 HB3 LEU 39 HB3 LEU 39 17.244 10.974 -5.121 295 HG LEU 39 HG LEU 39 16.716 12.314 -7.804 296 HD11 LEU 39 HD11 LEU 39 19.291 11.726 -6.330 297 HD12 LEU 39 HD12 LEU 39 18.502 13.316 -6.437 298 HD13 LEU 39 HD13 LEU 39 19.141 12.558 -7.907 299 HD21 LEU 39 HD21 LEU 39 18.142 9.660 -7.302 300 HD22 LEU 39 HD22 LEU 39 18.133 10.555 -8.841 301 HD23 LEU 39 HD23 LEU 39 16.633 9.896 -8.213 302 H ASN 40 H ASN 40 15.615 9.739 -3.750 303 HA ASN 40 HA ASN 40 16.285 7.087 -4.633 304 HB2 ASN 40 HB2 ASN 40 15.516 8.166 -1.908 305 HB3 ASN 40 HB3 ASN 40 15.695 6.431 -2.191 306 HD21 ASN 40 HD21 ASN 40 17.464 8.249 -0.502 307 HD22 ASN 40 HD22 ASN 40 19.030 8.161 -1.291 308 H LYS 41 H LYS 41 13.115 8.509 -3.619 309 HA LYS 41 HA LYS 41 11.742 6.045 -3.645 310 HB2 LYS 41 HB2 LYS 41 10.887 8.219 -2.745 311 HB3 LYS 41 HB3 LYS 41 10.589 8.789 -4.380 312 HG2 LYS 41 HG2 LYS 41 8.870 7.247 -4.737 313 HG3 LYS 41 HG3 LYS 41 9.519 6.092 -3.568 314 HD2 LYS 41 HD2 LYS 41 7.446 7.063 -2.751 315 HD3 LYS 41 HD3 LYS 41 8.807 7.482 -1.689 316 HE2 LYS 41 HE2 LYS 41 8.989 9.688 -2.865 317 HE3 LYS 41 HE3 LYS 41 7.645 9.222 -3.891 318 HZ1 LYS 41 HZ1 LYS 41 6.856 10.610 -2.286 319 HZ2 LYS 41 HZ2 LYS 41 7.531 9.821 -1.020 320 HZ3 LYS 41 HZ3 LYS 41 6.268 9.136 -1.854 321 H TRP 42 H TRP 42 12.596 8.222 -6.309 322 HA TRP 42 HA TRP 42 11.026 6.995 -8.303 323 HB2 TRP 42 HB2 TRP 42 13.745 8.229 -8.750 324 HB3 TRP 42 HB3 TRP 42 12.483 7.983 -9.947 325 HD1 TRP 42 HD1 TRP 42 10.228 9.231 -7.721 326 HE1 TRP 42 HE1 TRP 42 10.058 11.760 -7.578 327 HE3 TRP 42 HE3 TRP 42 14.768 10.332 -9.676 328 HZ2 TRP 42 HZ2 TRP 42 11.793 14.023 -8.158 329 HZ3 TRP 42 HZ3 TRP 42 15.543 12.698 -9.833 330 HH2 TRP 42 HH2 TRP 42 14.107 14.525 -9.012 331 H LYS 43 H LYS 43 14.458 6.309 -7.402 332 HA LYS 43 HA LYS 43 14.631 4.110 -9.277 333 HB2 LYS 43 HB2 LYS 43 16.647 3.405 -7.955 334 HB3 LYS 43 HB3 LYS 43 16.701 5.016 -8.671 335 HG2 LYS 43 HG2 LYS 43 16.213 6.058 -6.549 336 HG3 LYS 43 HG3 LYS 43 16.026 4.469 -5.755 337 HD2 LYS 43 HD2 LYS 43 18.600 5.433 -7.017 338 HD3 LYS 43 HD3 LYS 43 18.184 5.660 -5.316 339 HE2 LYS 43 HE2 LYS 43 17.927 3.212 -5.024 340 HE3 LYS 43 HE3 LYS 43 18.406 2.958 -6.704 341 HZ1 LYS 43 HZ1 LYS 43 20.100 4.179 -4.611 342 HZ2 LYS 43 HZ2 LYS 43 20.559 3.934 -6.181 343 HZ3 LYS 43 HZ3 LYS 43 20.216 2.662 -5.175 344 H GLN 44 H GLN 44 13.719 4.318 -5.836 345 HA GLN 44 HA GLN 44 13.607 1.643 -5.167 346 HB2 GLN 44 HB2 GLN 44 13.229 3.672 -3.678 347 HB3 GLN 44 HB3 GLN 44 11.606 3.779 -4.335 348 HG2 GLN 44 HG2 GLN 44 11.293 2.666 -2.304 349 HG3 GLN 44 HG3 GLN 44 11.226 1.394 -3.501 350 HE21 GLN 44 HE21 GLN 44 11.993 -0.348 -2.360 351 HE22 GLN 44 HE22 GLN 44 13.649 -0.456 -1.774 352 H HIS 45 H HIS 45 11.116 3.540 -6.943 353 HA HIS 45 HA HIS 45 9.661 0.983 -7.492 354 HB2 HIS 45 HB2 HIS 45 8.482 3.759 -7.117 355 HB3 HIS 45 HB3 HIS 45 7.596 2.263 -7.390 356 HD1 HIS 45 HD1 HIS 45 7.909 0.378 -5.326 357 HD2 HIS 45 HD2 HIS 45 9.099 4.359 -4.690 358 HE1 HIS 45 HE1 HIS 45 8.263 0.675 -2.760 359 H LYS 46 H LYS 46 11.829 2.091 -9.065 360 HA LYS 46 HA LYS 46 11.125 3.557 -11.297 361 HB2 LYS 46 HB2 LYS 46 13.366 2.967 -10.736 362 HB3 LYS 46 HB3 LYS 46 13.080 1.260 -11.067 363 HG2 LYS 46 HG2 LYS 46 12.784 1.768 -13.444 364 HG3 LYS 46 HG3 LYS 46 12.783 3.491 -13.107 365 HD2 LYS 46 HD2 LYS 46 14.866 3.205 -13.962 366 HD3 LYS 46 HD3 LYS 46 15.201 3.181 -12.241 367 HE2 LYS 46 HE2 LYS 46 14.921 0.742 -14.072 368 HE3 LYS 46 HE3 LYS 46 16.430 1.478 -13.570 369 HZ1 LYS 46 HZ1 LYS 46 15.852 0.891 -11.266 370 HZ2 LYS 46 HZ2 LYS 46 16.025 -0.400 -12.266 371 HZ3 LYS 46 HZ3 LYS 46 14.522 0.049 -11.824 372 H GLN 47 H GLN 47 10.680 -0.094 -11.158 373 HA GLN 47 HA GLN 47 9.608 -0.032 -13.840 374 HB2 GLN 47 HB2 GLN 47 10.029 -2.090 -11.830 375 HB3 GLN 47 HB3 GLN 47 8.440 -2.291 -12.562 376 HG2 GLN 47 HG2 GLN 47 10.842 -1.805 -14.297 377 HG3 GLN 47 HG3 GLN 47 10.555 -3.424 -13.641 378 HE21 GLN 47 HE21 GLN 47 8.018 -1.170 -14.778 379 HE22 GLN 47 HE22 GLN 47 7.578 -2.110 -16.161 380 H GLU 48 H GLU 48 8.106 0.394 -10.723 381 HA GLU 48 HA GLU 48 5.387 0.158 -11.586 382 HB2 GLU 48 HB2 GLU 48 6.094 1.967 -9.277 383 HB3 GLU 48 HB3 GLU 48 4.770 0.818 -9.487 384 HG2 GLU 48 HG2 GLU 48 6.610 -1.021 -9.360 385 HG3 GLU 48 HG3 GLU 48 7.673 0.282 -8.792 386 H LEU 49 H LEU 49 7.599 2.890 -11.213 387 HA LEU 49 HA LEU 49 5.833 4.989 -12.050 388 HB2 LEU 49 HB2 LEU 49 8.843 4.669 -12.154 389 HB3 LEU 49 HB3 LEU 49 8.033 6.158 -12.630 390 HG LEU 49 HG LEU 49 7.468 4.956 -9.894 391 HD11 LEU 49 HD11 LEU 49 9.753 6.839 -10.560 392 HD12 LEU 49 HD12 LEU 49 9.918 5.091 -10.285 393 HD13 LEU 49 HD13 LEU 49 9.299 6.115 -8.978 394 HD21 LEU 49 HD21 LEU 49 6.015 6.806 -10.479 395 HD22 LEU 49 HD22 LEU 49 7.373 7.756 -11.110 396 HD23 LEU 49 HD23 LEU 49 7.252 7.421 -9.384 397 H ILE 50 H ILE 50 8.237 2.995 -13.790 398 HA ILE 50 HA ILE 50 7.841 4.263 -16.306 399 HB ILE 50 HB ILE 50 8.640 1.391 -15.662 400 HG12 ILE 50 HG12 ILE 50 10.466 3.497 -16.857 401 HG13 ILE 50 HG13 ILE 50 10.137 3.524 -15.122 402 HG21 ILE 50 HG21 ILE 50 7.793 1.132 -17.816 403 HG22 ILE 50 HG22 ILE 50 8.388 2.689 -18.357 404 HG23 ILE 50 HG23 ILE 50 9.527 1.353 -18.077 405 HD11 ILE 50 HD11 ILE 50 11.307 1.141 -16.612 406 HD12 ILE 50 HD12 ILE 50 12.169 2.274 -15.542 407 HD13 ILE 50 HD13 ILE 50 10.928 1.217 -14.875 408 H ASP 51 H ASP 51 6.305 1.341 -14.984 409 HA ASP 51 HA ASP 51 4.523 0.745 -17.031 410 HB2 ASP 51 HB2 ASP 51 5.071 -0.582 -15.016 411 HB3 ASP 51 HB3 ASP 51 4.242 0.580 -13.996 412 H PHE 52 H PHE 52 4.238 3.200 -14.443 413 HA PHE 52 HA PHE 52 1.561 3.975 -15.122 414 HB2 PHE 52 HB2 PHE 52 2.384 4.291 -12.920 415 HB3 PHE 52 HB3 PHE 52 3.676 5.352 -13.474 416 HD1 PHE 52 HD1 PHE 52 3.225 7.677 -14.128 417 HD2 PHE 52 HD2 PHE 52 0.021 5.100 -12.822 418 HE1 PHE 52 HE1 PHE 52 1.786 9.657 -13.751 419 HE2 PHE 52 HE2 PHE 52 -1.417 7.084 -12.477 420 HZ PHE 52 HZ PHE 52 -0.483 9.391 -12.875 421 H LEU 53 H LEU 53 4.722 5.677 -15.656 422 HA LEU 53 HA LEU 53 3.662 7.862 -17.128 423 HB2 LEU 53 HB2 LEU 53 6.365 6.488 -17.058 424 HB3 LEU 53 HB3 LEU 53 6.067 7.772 -18.212 425 HG LEU 53 HG LEU 53 7.256 8.750 -16.523 426 HD11 LEU 53 HD11 LEU 53 4.378 9.578 -15.984 427 HD12 LEU 53 HD12 LEU 53 5.377 10.112 -17.365 428 HD13 LEU 53 HD13 LEU 53 5.840 10.545 -15.722 429 HD21 LEU 53 HD21 LEU 53 5.381 7.596 -14.457 430 HD22 LEU 53 HD22 LEU 53 6.623 8.821 -14.138 431 HD23 LEU 53 HD23 LEU 53 7.092 7.221 -14.726 432 H ASN 54 H ASN 54 4.419 4.561 -18.118 433 HA ASN 54 HA ASN 54 4.295 5.124 -20.962 434 HB2 ASN 54 HB2 ASN 54 5.401 3.151 -19.568 435 HB3 ASN 54 HB3 ASN 54 3.870 2.360 -19.812 436 HD21 ASN 54 HD21 ASN 54 6.834 2.442 -20.822 437 HD22 ASN 54 HD22 ASN 54 6.755 2.169 -22.530 438 H GLN 55 H GLN 55 2.018 3.387 -18.671 439 HA GLN 55 HA GLN 55 -0.047 3.314 -20.601 440 HB2 GLN 55 HB2 GLN 55 -1.503 2.577 -18.836 441 HB3 GLN 55 HB3 GLN 55 0.093 1.826 -18.730 442 HG2 GLN 55 HG2 GLN 55 -0.357 2.214 -16.523 443 HG3 GLN 55 HG3 GLN 55 0.626 3.589 -16.965 444 HE21 GLN 55 HE21 GLN 55 -0.092 5.633 -16.476 445 HE22 GLN 55 HE22 GLN 55 -1.722 5.971 -15.905 446 H LEU 56 H LEU 56 0.985 5.926 -18.589 447 HA LEU 56 HA LEU 56 -1.369 7.502 -18.410 448 HB2 LEU 56 HB2 LEU 56 0.563 7.887 -17.014 449 HB3 LEU 56 HB3 LEU 56 1.603 8.083 -18.420 450 HG LEU 56 HG LEU 56 0.503 10.224 -18.981 451 HD11 LEU 56 HD11 LEU 56 -1.707 9.815 -17.892 452 HD12 LEU 56 HD12 LEU 56 -0.946 11.302 -17.329 453 HD13 LEU 56 HD13 LEU 56 -0.923 9.857 -16.293 454 HD21 LEU 56 HD21 LEU 56 1.504 11.483 -17.126 455 HD22 LEU 56 HD22 LEU 56 2.548 10.170 -17.670 456 HD23 LEU 56 HD23 LEU 56 1.617 9.996 -16.163 457 H ASP 57 H ASP 57 0.848 6.936 -21.088 458 HA ASP 57 HA ASP 57 -0.677 8.981 -22.660 459 HB2 ASP 57 HB2 ASP 57 1.841 9.452 -21.811 460 HB3 ASP 57 HB3 ASP 57 2.217 8.594 -23.298 461 H SER 58 H SER 58 1.491 6.080 -22.953 462 HA SER 58 HA SER 58 0.652 5.585 -25.655 463 HB2 SER 58 HB2 SER 58 1.973 3.725 -23.648 464 HB3 SER 58 HB3 SER 58 1.954 3.562 -25.412 465 HG SER 58 HG SER 58 3.547 4.910 -25.541 466 H GLU 59 H GLU 59 -0.538 4.685 -22.481 467 HA GLU 59 HA GLU 59 -2.103 3.256 -21.682 468 HB2 GLU 59 HB2 GLU 59 -4.312 3.830 -22.393 469 HB3 GLU 59 HB3 GLU 59 -3.291 5.263 -22.330 470 HG2 GLU 59 HG2 GLU 59 -3.057 5.273 -24.773 471 HG3 GLU 59 HG3 GLU 59 -3.999 3.786 -24.903 472 H GLU 60 H GLU 60 -0.409 1.774 -23.603 473 HA GLU 60 HA GLU 60 -2.269 -0.484 -24.058 474 HB2 GLU 60 HB2 GLU 60 -1.596 -0.764 -26.338 475 HB3 GLU 60 HB3 GLU 60 -2.153 0.899 -26.164 476 HG2 GLU 60 HG2 GLU 60 0.189 1.705 -26.068 477 HG3 GLU 60 HG3 GLU 60 0.789 0.062 -26.135 478 H GLN 61 H GLN 61 0.465 0.356 -22.370 479 HA GLN 61 HA GLN 61 2.449 -1.311 -23.282 480 HB2 GLN 61 HB2 GLN 61 2.529 0.805 -21.955 481 HB3 GLN 61 HB3 GLN 61 1.626 0.028 -20.661 482 HG2 GLN 61 HG2 GLN 61 3.913 0.155 -20.106 483 HG3 GLN 61 HG3 GLN 61 3.391 -1.519 -20.287 484 HE21 GLN 61 HE21 GLN 61 4.210 0.491 -23.151 485 HE22 GLN 61 HE22 GLN 61 5.717 -0.321 -23.470 486 H THR 62 H THR 62 3.035 -3.366 -22.644 487 HA THR 62 HA THR 62 1.784 -4.727 -20.496 488 HB THR 62 HB THR 62 0.088 -4.983 -22.351 489 HG1 THR 62 HG1 THR 62 -0.247 -6.445 -20.972 490 HG21 THR 62 HG21 THR 62 0.412 -6.709 -23.994 491 HG22 THR 62 HG22 THR 62 2.090 -6.925 -23.533 492 HG23 THR 62 HG23 THR 62 1.564 -5.391 -24.297 493 H LYS 63 H LYS 63 2.730 -7.212 -20.886 494 HA LYS 63 HA LYS 63 5.644 -6.819 -21.463 495 HB2 LYS 63 HB2 LYS 63 4.373 -8.123 -19.013 496 HB3 LYS 63 HB3 LYS 63 6.084 -8.220 -19.456 497 HG2 LYS 63 HG2 LYS 63 6.297 -5.766 -19.321 498 HG3 LYS 63 HG3 LYS 63 4.596 -5.612 -18.901 499 HD2 LYS 63 HD2 LYS 63 6.115 -5.403 -16.970 500 HD3 LYS 63 HD3 LYS 63 4.908 -6.671 -16.782 501 HE2 LYS 63 HE2 LYS 63 7.130 -7.370 -15.943 502 HE3 LYS 63 HE3 LYS 63 6.536 -8.399 -17.250 503 HZ1 LYS 63 HZ1 LYS 63 8.796 -7.934 -17.651 504 HZ2 LYS 63 HZ2 LYS 63 8.595 -6.301 -17.476 505 HZ3 LYS 63 HZ3 LYS 63 7.958 -7.099 -18.776 Start of MODEL 18 1 H1 GLY 1 H GLY 1 3.801 0.131 0.770 2 HA2 GLY 1 HA2 GLY 1 3.568 -0.822 -1.521 3 HA3 GLY 1 HA3 GLY 1 1.855 -0.358 -1.403 4 H ILE 2 H ILE 2 2.730 0.858 -3.518 5 HA ILE 2 HA ILE 2 3.139 3.641 -2.729 6 HB ILE 2 HB ILE 2 5.431 2.670 -3.002 7 HG12 ILE 2 HG12 ILE 2 6.435 4.212 -4.355 8 HG13 ILE 2 HG13 ILE 2 4.959 4.464 -5.355 9 HG21 ILE 2 HG21 ILE 2 4.344 1.790 -5.688 10 HG22 ILE 2 HG22 ILE 2 6.028 2.220 -5.552 11 HG23 ILE 2 HG23 ILE 2 5.386 0.941 -4.531 12 HD11 ILE 2 HD11 ILE 2 5.492 6.372 -3.897 13 HD12 ILE 2 HD12 ILE 2 3.916 5.692 -3.515 14 HD13 ILE 2 HD13 ILE 2 5.314 5.340 -2.457 15 H ASP 3 H ASP 3 2.559 5.101 -4.578 16 HA ASP 3 HA ASP 3 0.861 3.747 -6.577 17 HB2 ASP 3 HB2 ASP 3 0.290 6.440 -5.447 18 HB3 ASP 3 HB3 ASP 3 -0.777 5.346 -6.291 19 H ALA 4 H ALA 4 1.879 4.069 -8.437 20 HA ALA 4 HA ALA 4 4.179 5.651 -8.820 21 HB1 ALA 4 HB1 ALA 4 2.122 4.649 -10.812 22 HB2 ALA 4 HB2 ALA 4 3.726 5.289 -11.235 23 HB3 ALA 4 HB3 ALA 4 3.586 3.792 -10.284 24 H ALA 5 H ALA 5 0.764 6.459 -9.550 25 HA ALA 5 HA ALA 5 1.222 8.952 -10.794 26 HB1 ALA 5 HB1 ALA 5 -0.940 7.667 -10.768 27 HB2 ALA 5 HB2 ALA 5 -1.129 8.124 -9.057 28 HB3 ALA 5 HB3 ALA 5 -1.127 9.378 -10.321 29 H GLN 6 H GLN 6 1.122 8.084 -7.341 30 HA GLN 6 HA GLN 6 0.796 10.789 -6.375 31 HB2 GLN 6 HB2 GLN 6 1.716 8.179 -5.108 32 HB3 GLN 6 HB3 GLN 6 1.727 9.672 -4.213 33 HG2 GLN 6 HG2 GLN 6 -0.779 8.541 -5.532 34 HG3 GLN 6 HG3 GLN 6 -0.287 8.198 -3.876 35 HE21 GLN 6 HE21 GLN 6 -1.480 10.773 -6.057 36 HE22 GLN 6 HE22 GLN 6 -1.925 11.870 -4.784 37 H ILE 7 H ILE 7 3.594 8.621 -7.044 38 HA ILE 7 HA ILE 7 5.544 10.420 -6.097 39 HB ILE 7 HB ILE 7 5.832 8.362 -8.275 40 HG12 ILE 7 HG12 ILE 7 6.491 7.869 -5.371 41 HG13 ILE 7 HG13 ILE 7 4.980 7.358 -6.117 42 HG21 ILE 7 HG21 ILE 7 7.863 9.577 -6.330 43 HG22 ILE 7 HG22 ILE 7 8.247 8.382 -7.589 44 HG23 ILE 7 HG23 ILE 7 7.751 9.996 -8.057 45 HD11 ILE 7 HD11 ILE 7 6.079 5.865 -7.644 46 HD12 ILE 7 HD12 ILE 7 7.691 6.438 -7.183 47 HD13 ILE 7 HD13 ILE 7 6.749 5.571 -6.034 48 H VAL 8 H VAL 8 3.992 10.132 -9.316 49 HA VAL 8 HA VAL 8 5.748 12.006 -10.633 50 HB VAL 8 HB VAL 8 2.890 11.131 -11.301 51 HG11 VAL 8 HG11 VAL 8 3.466 13.295 -12.456 52 HG12 VAL 8 HG12 VAL 8 4.908 12.505 -13.126 53 HG13 VAL 8 HG13 VAL 8 3.294 11.937 -13.570 54 HG21 VAL 8 HG21 VAL 8 4.430 9.254 -11.349 55 HG22 VAL 8 HG22 VAL 8 4.121 9.749 -13.021 56 HG23 VAL 8 HG23 VAL 8 5.640 10.204 -12.242 57 H ASP 9 H ASP 9 2.688 12.362 -8.850 58 HA ASP 9 HA ASP 9 2.175 15.081 -9.433 59 HB2 ASP 9 HB2 ASP 9 0.692 13.260 -8.454 60 HB3 ASP 9 HB3 ASP 9 1.414 13.599 -6.888 61 H GLU 10 H GLU 10 3.732 13.614 -6.490 62 HA GLU 10 HA GLU 10 4.439 16.146 -5.404 63 HB2 GLU 10 HB2 GLU 10 5.930 14.935 -3.920 64 HB3 GLU 10 HB3 GLU 10 4.348 14.147 -4.042 65 HG2 GLU 10 HG2 GLU 10 5.339 12.527 -5.647 66 HG3 GLU 10 HG3 GLU 10 6.923 13.247 -5.372 67 H ALA 11 H ALA 11 6.192 14.039 -7.729 68 HA ALA 11 HA ALA 11 8.637 15.474 -7.523 69 HB1 ALA 11 HB1 ALA 11 9.129 14.469 -9.778 70 HB2 ALA 11 HB2 ALA 11 8.433 13.266 -8.679 71 HB3 ALA 11 HB3 ALA 11 7.429 14.001 -9.935 72 H LEU 12 H LEU 12 5.670 16.019 -9.506 73 HA LEU 12 HA LEU 12 6.762 18.215 -10.989 74 HB2 LEU 12 HB2 LEU 12 3.910 17.384 -10.298 75 HB3 LEU 12 HB3 LEU 12 4.233 18.791 -11.299 76 HG LEU 12 HG LEU 12 5.142 16.006 -11.993 77 HD11 LEU 12 HD11 LEU 12 2.824 17.609 -13.093 78 HD12 LEU 12 HD12 LEU 12 2.709 16.188 -12.028 79 HD13 LEU 12 HD13 LEU 12 3.371 16.024 -13.658 80 HD21 LEU 12 HD21 LEU 12 5.202 18.593 -13.590 81 HD22 LEU 12 HD22 LEU 12 5.574 16.988 -14.256 82 HD23 LEU 12 HD23 LEU 12 6.618 17.686 -13.028 83 H GLU 13 H GLU 13 5.358 18.034 -7.777 84 HA GLU 13 HA GLU 13 4.672 20.846 -7.508 85 HB2 GLU 13 HB2 GLU 13 5.379 18.609 -5.561 86 HB3 GLU 13 HB3 GLU 13 5.227 20.271 -5.020 87 HG2 GLU 13 HG2 GLU 13 2.881 20.089 -6.287 88 HG3 GLU 13 HG3 GLU 13 3.128 18.365 -5.957 89 H GLN 14 H GLN 14 7.512 18.878 -7.087 90 HA GLN 14 HA GLN 14 9.199 20.990 -5.961 91 HB2 GLN 14 HB2 GLN 14 9.775 18.210 -7.044 92 HB3 GLN 14 HB3 GLN 14 10.922 19.205 -6.131 93 HG2 GLN 14 HG2 GLN 14 9.506 19.032 -4.152 94 HG3 GLN 14 HG3 GLN 14 8.247 18.201 -5.024 95 HE21 GLN 14 HE21 GLN 14 8.748 16.683 -3.055 96 HE22 GLN 14 HE22 GLN 14 9.948 15.457 -3.406 97 H GLY 15 H GLY 15 8.128 20.065 -9.112 98 HA2 GLY 15 HA2 GLY 15 8.553 21.272 -11.046 99 HA3 GLY 15 HA3 GLY 15 10.084 21.854 -10.389 100 H ILE 16 H ILE 16 9.310 18.380 -10.277 101 HA ILE 16 HA ILE 16 11.318 17.896 -12.402 102 HB ILE 16 HB ILE 16 10.585 16.104 -10.062 103 HG12 ILE 16 HG12 ILE 16 13.409 16.503 -10.120 104 HG13 ILE 16 HG13 ILE 16 12.752 18.060 -10.434 105 HG21 ILE 16 HG21 ILE 16 12.408 14.633 -10.968 106 HG22 ILE 16 HG22 ILE 16 11.120 14.835 -12.124 107 HG23 ILE 16 HG23 ILE 16 12.610 15.753 -12.336 108 HD11 ILE 16 HD11 ILE 16 11.966 16.336 -8.039 109 HD12 ILE 16 HD12 ILE 16 13.194 17.622 -8.020 110 HD13 ILE 16 HD13 ILE 16 11.465 17.992 -8.342 111 H THR 17 H THR 17 10.554 17.193 -14.176 112 HA THR 17 HA THR 17 7.853 16.105 -14.554 113 HB THR 17 HB THR 17 10.303 16.845 -16.198 114 HG1 THR 17 HG1 THR 17 7.799 18.111 -16.305 115 HG21 THR 17 HG21 THR 17 9.171 15.058 -17.356 116 HG22 THR 17 HG22 THR 17 9.057 16.596 -18.225 117 HG23 THR 17 HG23 THR 17 7.641 15.952 -17.312 118 H LEU 18 H LEU 18 7.526 13.804 -14.838 119 HA LEU 18 HA LEU 18 9.965 12.103 -15.002 120 HB2 LEU 18 HB2 LEU 18 7.182 11.464 -13.909 121 HB3 LEU 18 HB3 LEU 18 8.469 10.306 -14.228 122 HG LEU 18 HG LEU 18 8.092 12.093 -11.890 123 HD11 LEU 18 HD11 LEU 18 7.944 9.630 -11.833 124 HD12 LEU 18 HD12 LEU 18 9.259 10.208 -10.793 125 HD13 LEU 18 HD13 LEU 18 9.621 9.504 -12.399 126 HD21 LEU 18 HD21 LEU 18 10.847 11.593 -13.023 127 HD22 LEU 18 HD22 LEU 18 10.531 12.266 -11.390 128 HD23 LEU 18 HD23 LEU 18 10.071 13.163 -12.845 129 H PHE 19 H PHE 19 10.001 10.482 -16.536 130 HA PHE 19 HA PHE 19 7.771 9.956 -18.300 131 HB2 PHE 19 HB2 PHE 19 8.765 10.891 -20.351 132 HB3 PHE 19 HB3 PHE 19 8.309 12.132 -19.229 133 HD1 PHE 19 HD1 PHE 19 10.951 10.909 -21.299 134 HD2 PHE 19 HD2 PHE 19 10.164 13.209 -17.753 135 HE1 PHE 19 HE1 PHE 19 13.100 12.103 -21.574 136 HE2 PHE 19 HE2 PHE 19 12.289 14.391 -18.035 137 HZ PHE 19 HZ PHE 19 13.812 13.831 -19.904 138 H VAL 20 H VAL 20 8.636 8.576 -20.234 139 HA VAL 20 HA VAL 20 11.095 7.099 -19.427 140 HB VAL 20 HB VAL 20 8.548 5.798 -20.474 141 HG11 VAL 20 HG11 VAL 20 9.595 3.715 -19.897 142 HG12 VAL 20 HG12 VAL 20 10.754 4.621 -20.880 143 HG13 VAL 20 HG13 VAL 20 10.970 4.529 -19.123 144 HG21 VAL 20 HG21 VAL 20 9.600 5.657 -17.600 145 HG22 VAL 20 HG22 VAL 20 8.258 6.668 -18.107 146 HG23 VAL 20 HG23 VAL 20 8.112 4.928 -18.263 147 H VAL 21 H VAL 21 12.379 6.482 -21.153 148 HA VAL 21 HA VAL 21 11.536 7.277 -23.886 149 HB VAL 21 HB VAL 21 14.201 8.009 -22.588 150 HG11 VAL 21 HG11 VAL 21 13.155 8.494 -25.419 151 HG12 VAL 21 HG12 VAL 21 14.682 9.114 -24.765 152 HG13 VAL 21 HG13 VAL 21 14.459 7.375 -24.971 153 HG21 VAL 21 HG21 VAL 21 12.580 9.565 -21.837 154 HG22 VAL 21 HG22 VAL 21 13.523 10.359 -23.119 155 HG23 VAL 21 HG23 VAL 21 11.900 9.762 -23.472 156 H ASN 22 H ASN 22 11.737 5.430 -25.078 157 HA ASN 22 HA ASN 22 12.243 3.309 -25.631 158 HB2 ASN 22 HB2 ASN 22 15.029 4.286 -24.906 159 HB3 ASN 22 HB3 ASN 22 14.684 2.811 -25.799 160 HD21 ASN 22 HD21 ASN 22 15.703 5.904 -26.430 161 HD22 ASN 22 HD22 ASN 22 14.943 6.085 -27.981 162 H ASN 23 H ASN 23 11.134 3.428 -23.023 163 HA ASN 23 HA ASN 23 10.656 2.173 -21.331 164 HB2 ASN 23 HB2 ASN 23 11.035 0.261 -22.872 165 HB3 ASN 23 HB3 ASN 23 12.683 0.111 -22.233 166 HD21 ASN 23 HD21 ASN 23 9.225 0.318 -21.068 167 HD22 ASN 23 HD22 ASN 23 9.517 -0.772 -19.750 168 H ARG 24 H ARG 24 13.508 3.778 -21.514 169 HA ARG 24 HA ARG 24 14.543 2.963 -18.861 170 HB2 ARG 24 HB2 ARG 24 15.609 4.895 -20.962 171 HB3 ARG 24 HB3 ARG 24 16.424 4.460 -19.463 172 HG2 ARG 24 HG2 ARG 24 16.600 2.111 -20.175 173 HG3 ARG 24 HG3 ARG 24 15.657 2.453 -21.635 174 HD2 ARG 24 HD2 ARG 24 17.423 4.108 -22.319 175 HD3 ARG 24 HD3 ARG 24 18.421 3.505 -20.974 176 HE ARG 24 HE ARG 24 17.358 1.480 -22.829 177 HH11 ARG 24 HH11 ARG 24 20.003 3.791 -22.490 178 HH12 ARG 24 HH12 ARG 24 21.126 2.819 -23.400 179 HH21 ARG 24 HH21 ARG 24 18.805 0.249 -24.087 180 HH22 ARG 24 HH22 ARG 24 20.369 0.901 -24.469 181 H LEU 25 H LEU 25 13.693 4.000 -17.115 182 HA LEU 25 HA LEU 25 11.886 6.251 -17.358 183 HB2 LEU 25 HB2 LEU 25 11.480 4.719 -15.610 184 HB3 LEU 25 HB3 LEU 25 13.158 4.742 -15.067 185 HG LEU 25 HG LEU 25 12.919 6.962 -14.205 186 HD11 LEU 25 HD11 LEU 25 10.621 7.989 -13.939 187 HD12 LEU 25 HD12 LEU 25 10.042 6.854 -15.191 188 HD13 LEU 25 HD13 LEU 25 11.314 8.070 -15.526 189 HD21 LEU 25 HD21 LEU 25 10.794 5.088 -13.180 190 HD22 LEU 25 HD22 LEU 25 11.466 6.501 -12.315 191 HD23 LEU 25 HD23 LEU 25 12.516 5.150 -12.710 192 H GLN 26 H GLN 26 12.379 8.357 -17.476 193 HA GLN 26 HA GLN 26 14.962 9.350 -16.464 194 HB2 GLN 26 HB2 GLN 26 13.501 10.057 -19.063 195 HB3 GLN 26 HB3 GLN 26 14.898 10.928 -18.442 196 HG2 GLN 26 HG2 GLN 26 16.113 8.616 -18.512 197 HG3 GLN 26 HG3 GLN 26 14.800 8.143 -19.600 198 HE21 GLN 26 HE21 GLN 26 14.401 10.674 -20.888 199 HE22 GLN 26 HE22 GLN 26 15.779 11.116 -21.830 200 H TYR 27 H TYR 27 14.861 11.910 -16.493 201 HA TYR 27 HA TYR 27 12.268 12.996 -15.860 202 HB2 TYR 27 HB2 TYR 27 12.759 13.628 -13.579 203 HB3 TYR 27 HB3 TYR 27 12.791 11.905 -13.773 204 HD1 TYR 27 HD1 TYR 27 14.912 10.608 -13.614 205 HD2 TYR 27 HD2 TYR 27 14.800 14.879 -12.958 206 HE1 TYR 27 HE1 TYR 27 17.056 10.475 -12.385 207 HE2 TYR 27 HE2 TYR 27 16.914 14.751 -11.727 208 HH TYR 27 HH TYR 27 18.594 13.356 -10.888 209 H GLU 28 H GLU 28 12.451 15.368 -15.312 210 HA GLU 28 HA GLU 28 14.981 16.619 -16.132 211 HB2 GLU 28 HB2 GLU 28 13.915 16.213 -18.208 212 HB3 GLU 28 HB3 GLU 28 12.342 16.798 -17.635 213 HG2 GLU 28 HG2 GLU 28 12.944 18.998 -17.673 214 HG3 GLU 28 HG3 GLU 28 14.693 18.680 -17.525 215 H THR 29 H THR 29 15.286 18.576 -15.194 216 HA THR 29 HA THR 29 13.243 20.296 -14.170 217 HB THR 29 HB THR 29 13.173 18.797 -12.341 218 HG1 THR 29 HG1 THR 29 13.492 20.271 -10.811 219 HG21 THR 29 HG21 THR 29 15.077 18.189 -10.956 220 HG22 THR 29 HG22 THR 29 16.200 19.014 -12.059 221 HG23 THR 29 HG23 THR 29 15.309 17.562 -12.588 222 H SER 30 H SER 30 14.488 22.182 -13.022 223 HA SER 30 HA SER 30 17.192 22.574 -14.219 224 HB2 SER 30 HB2 SER 30 15.119 24.758 -14.009 225 HB3 SER 30 HB3 SER 30 16.581 24.742 -14.999 226 HG SER 30 HG SER 30 15.603 23.301 -16.406 227 H ARG 31 H ARG 31 15.856 22.152 -11.308 228 HA ARG 31 HA ARG 31 17.217 24.489 -10.075 229 HB2 ARG 31 HB2 ARG 31 16.002 23.893 -8.017 230 HB3 ARG 31 HB3 ARG 31 14.889 24.159 -9.355 231 HG2 ARG 31 HG2 ARG 31 14.299 21.975 -9.520 232 HG3 ARG 31 HG3 ARG 31 15.831 21.328 -8.974 233 HD2 ARG 31 HD2 ARG 31 14.395 20.773 -7.234 234 HD3 ARG 31 HD3 ARG 31 15.233 22.193 -6.626 235 HE ARG 31 HE ARG 31 12.449 22.036 -7.699 236 HH11 ARG 31 HH11 ARG 31 14.663 23.854 -5.520 237 HH12 ARG 31 HH12 ARG 31 13.516 25.118 -5.309 238 HH21 ARG 31 HH21 ARG 31 11.021 23.698 -7.417 239 HH22 ARG 31 HH22 ARG 31 11.386 24.990 -6.337 240 H ASP 32 H ASP 32 18.170 24.012 -7.907 241 HA ASP 32 HA ASP 32 20.121 21.789 -8.121 242 HB2 ASP 32 HB2 ASP 32 21.567 23.098 -6.827 243 HB3 ASP 32 HB3 ASP 32 20.879 24.233 -7.980 244 H SER 33 H SER 33 20.879 21.247 -5.698 245 HA SER 33 HA SER 33 20.392 19.815 -3.998 246 HB2 SER 33 HB2 SER 33 20.341 22.264 -3.220 247 HB3 SER 33 HB3 SER 33 18.594 22.069 -3.050 248 HG SER 33 HG SER 33 19.120 20.279 -1.637 249 H ILE 34 H ILE 34 18.911 18.667 -5.893 250 HA ILE 34 HA ILE 34 16.111 18.626 -5.424 251 HB ILE 34 HB ILE 34 18.092 16.755 -6.709 252 HG12 ILE 34 HG12 ILE 34 15.548 18.104 -7.756 253 HG13 ILE 34 HG13 ILE 34 17.124 18.875 -7.758 254 HG21 ILE 34 HG21 ILE 34 16.452 15.120 -7.396 255 HG22 ILE 34 HG22 ILE 34 16.447 15.161 -5.639 256 HG23 ILE 34 HG23 ILE 34 15.149 15.945 -6.545 257 HD11 ILE 34 HD11 ILE 34 16.209 16.494 -9.358 258 HD12 ILE 34 HD12 ILE 34 16.994 18.005 -9.894 259 HD13 ILE 34 HD13 ILE 34 17.955 16.797 -9.055 260 HA PRO 35 HA PRO 35 15.871 16.580 -1.501 261 HB2 PRO 35 HB2 PRO 35 13.445 15.256 -1.805 262 HB3 PRO 35 HB3 PRO 35 13.600 17.011 -1.451 263 HG2 PRO 35 HG2 PRO 35 13.177 15.605 -4.104 264 HG3 PRO 35 HG3 PRO 35 12.350 17.062 -3.468 265 HD2 PRO 35 HD2 PRO 35 14.307 17.304 -5.212 266 HD3 PRO 35 HD3 PRO 35 14.189 18.428 -3.847 267 H THR 36 H THR 36 17.430 14.949 -1.357 268 HA THR 36 HA THR 36 17.720 12.837 -3.196 269 HB THR 36 HB THR 36 19.514 13.601 -1.782 270 HG1 THR 36 HG1 THR 36 20.292 11.598 -1.178 271 HG21 THR 36 HG21 THR 36 18.028 12.320 0.545 272 HG22 THR 36 HG22 THR 36 18.375 14.053 0.323 273 HG23 THR 36 HG23 THR 36 19.695 12.925 0.591 274 H GLU 37 H GLU 37 15.624 13.108 -0.358 275 HA GLU 37 HA GLU 37 14.931 10.391 -0.054 276 HB2 GLU 37 HB2 GLU 37 12.905 11.246 1.068 277 HB3 GLU 37 HB3 GLU 37 14.372 12.075 1.587 278 HG2 GLU 37 HG2 GLU 37 13.746 13.926 -0.096 279 HG3 GLU 37 HG3 GLU 37 12.127 13.203 -0.088 280 H LEU 38 H LEU 38 13.359 12.921 -2.120 281 HA LEU 38 HA LEU 38 11.544 10.990 -3.194 282 HB2 LEU 38 HB2 LEU 38 11.556 13.742 -3.212 283 HB3 LEU 38 HB3 LEU 38 12.145 13.424 -4.824 284 HG LEU 38 HG LEU 38 9.455 13.099 -3.611 285 HD11 LEU 38 HD11 LEU 38 9.192 13.204 -6.430 286 HD12 LEU 38 HD12 LEU 38 10.567 14.242 -6.043 287 HD13 LEU 38 HD13 LEU 38 8.993 14.499 -5.283 288 HD21 LEU 38 HD21 LEU 38 9.651 10.822 -3.906 289 HD22 LEU 38 HD22 LEU 38 10.259 10.971 -5.559 290 HD23 LEU 38 HD23 LEU 38 8.587 11.441 -5.167 291 H LEU 39 H LEU 39 14.684 12.277 -4.199 292 HA LEU 39 HA LEU 39 14.861 11.267 -6.797 293 HB2 LEU 39 HB2 LEU 39 16.532 12.636 -5.158 294 HB3 LEU 39 HB3 LEU 39 17.330 11.071 -5.103 295 HG LEU 39 HG LEU 39 16.667 12.717 -7.577 296 HD11 LEU 39 HD11 LEU 39 19.108 13.067 -7.707 297 HD12 LEU 39 HD12 LEU 39 19.323 12.117 -6.217 298 HD13 LEU 39 HD13 LEU 39 18.457 13.668 -6.168 299 HD21 LEU 39 HD21 LEU 39 16.692 10.277 -8.134 300 HD22 LEU 39 HD22 LEU 39 18.322 10.174 -7.447 301 HD23 LEU 39 HD23 LEU 39 18.025 11.167 -8.881 302 H ASN 40 H ASN 40 15.810 9.754 -3.752 303 HA ASN 40 HA ASN 40 16.433 7.180 -4.796 304 HB2 ASN 40 HB2 ASN 40 15.804 8.160 -2.001 305 HB3 ASN 40 HB3 ASN 40 16.018 6.447 -2.348 306 HD21 ASN 40 HD21 ASN 40 17.683 9.560 -2.245 307 HD22 ASN 40 HD22 ASN 40 19.292 8.938 -2.407 308 H LYS 41 H LYS 41 13.336 8.545 -3.538 309 HA LYS 41 HA LYS 41 11.896 6.091 -3.586 310 HB2 LYS 41 HB2 LYS 41 11.028 8.061 -2.461 311 HB3 LYS 41 HB3 LYS 41 10.898 8.938 -3.992 312 HG2 LYS 41 HG2 LYS 41 9.090 7.662 -4.755 313 HG3 LYS 41 HG3 LYS 41 9.494 6.310 -3.674 314 HD2 LYS 41 HD2 LYS 41 7.564 7.080 -2.785 315 HD3 LYS 41 HD3 LYS 41 8.778 7.808 -1.731 316 HE2 LYS 41 HE2 LYS 41 8.232 9.610 -3.907 317 HE3 LYS 41 HE3 LYS 41 6.688 8.992 -3.392 318 HZ1 LYS 41 HZ1 LYS 41 7.355 11.027 -2.255 319 HZ2 LYS 41 HZ2 LYS 41 8.572 10.212 -1.446 320 HZ3 LYS 41 HZ3 LYS 41 7.002 9.830 -1.242 321 H TRP 42 H TRP 42 12.735 8.350 -6.244 322 HA TRP 42 HA TRP 42 11.019 7.163 -8.161 323 HB2 TRP 42 HB2 TRP 42 13.712 8.440 -8.716 324 HB3 TRP 42 HB3 TRP 42 12.405 8.178 -9.859 325 HD1 TRP 42 HD1 TRP 42 10.096 9.322 -7.861 326 HE1 TRP 42 HE1 TRP 42 9.817 11.852 -7.705 327 HE3 TRP 42 HE3 TRP 42 14.741 10.699 -9.425 328 HZ2 TRP 42 HZ2 TRP 42 11.475 14.190 -8.046 329 HZ3 TRP 42 HZ3 TRP 42 15.321 13.109 -9.622 330 HH2 TRP 42 HH2 TRP 42 13.782 14.834 -8.752 331 H LYS 43 H LYS 43 14.518 6.474 -7.486 332 HA LYS 43 HA LYS 43 14.543 4.345 -9.429 333 HB2 LYS 43 HB2 LYS 43 16.645 3.596 -8.292 334 HB3 LYS 43 HB3 LYS 43 16.657 5.227 -8.954 335 HG2 LYS 43 HG2 LYS 43 16.454 6.216 -6.778 336 HG3 LYS 43 HG3 LYS 43 16.204 4.634 -5.998 337 HD2 LYS 43 HD2 LYS 43 18.727 5.270 -7.553 338 HD3 LYS 43 HD3 LYS 43 18.551 5.679 -5.834 339 HE2 LYS 43 HE2 LYS 43 18.304 3.428 -5.169 340 HE3 LYS 43 HE3 LYS 43 18.019 2.872 -6.820 341 HZ1 LYS 43 HZ1 LYS 43 20.230 2.411 -5.927 342 HZ2 LYS 43 HZ2 LYS 43 20.600 4.006 -5.958 343 HZ3 LYS 43 HZ3 LYS 43 20.234 3.215 -7.373 344 H GLN 44 H GLN 44 13.819 4.410 -5.963 345 HA GLN 44 HA GLN 44 13.829 1.721 -5.347 346 HB2 GLN 44 HB2 GLN 44 13.451 3.671 -3.799 347 HB3 GLN 44 HB3 GLN 44 11.828 3.832 -4.449 348 HG2 GLN 44 HG2 GLN 44 11.461 2.694 -2.473 349 HG3 GLN 44 HG3 GLN 44 11.392 1.431 -3.654 350 HE21 GLN 44 HE21 GLN 44 11.836 0.201 -1.526 351 HE22 GLN 44 HE22 GLN 44 13.510 -0.323 -1.393 352 H HIS 45 H HIS 45 11.284 3.537 -7.051 353 HA HIS 45 HA HIS 45 9.739 1.016 -7.446 354 HB2 HIS 45 HB2 HIS 45 8.718 3.861 -7.190 355 HB3 HIS 45 HB3 HIS 45 7.750 2.396 -7.355 356 HD1 HIS 45 HD1 HIS 45 7.997 0.611 -5.239 357 HD2 HIS 45 HD2 HIS 45 9.301 4.560 -4.753 358 HE1 HIS 45 HE1 HIS 45 8.267 0.984 -2.694 359 H LYS 46 H LYS 46 11.918 1.875 -9.104 360 HA LYS 46 HA LYS 46 11.293 3.367 -11.348 361 HB2 LYS 46 HB2 LYS 46 13.518 2.569 -10.924 362 HB3 LYS 46 HB3 LYS 46 13.038 0.876 -11.152 363 HG2 LYS 46 HG2 LYS 46 12.694 1.177 -13.492 364 HG3 LYS 46 HG3 LYS 46 12.700 2.948 -13.356 365 HD2 LYS 46 HD2 LYS 46 15.119 2.781 -12.639 366 HD3 LYS 46 HD3 LYS 46 15.047 1.054 -13.068 367 HE2 LYS 46 HE2 LYS 46 14.433 1.671 -15.391 368 HE3 LYS 46 HE3 LYS 46 14.523 3.383 -14.931 369 HZ1 LYS 46 HZ1 LYS 46 16.719 1.483 -15.203 370 HZ2 LYS 46 HZ2 LYS 46 16.894 2.851 -14.259 371 HZ3 LYS 46 HZ3 LYS 46 16.549 2.975 -15.845 372 H GLN 47 H GLN 47 10.722 -0.251 -11.203 373 HA GLN 47 HA GLN 47 9.467 -0.192 -13.768 374 HB2 GLN 47 HB2 GLN 47 9.942 -2.182 -11.680 375 HB3 GLN 47 HB3 GLN 47 8.362 -2.406 -12.396 376 HG2 GLN 47 HG2 GLN 47 10.766 -1.933 -14.178 377 HG3 GLN 47 HG3 GLN 47 10.484 -3.548 -13.504 378 HE21 GLN 47 HE21 GLN 47 7.943 -1.258 -14.580 379 HE22 GLN 47 HE22 GLN 47 7.451 -2.191 -15.954 380 H GLU 48 H GLU 48 8.185 0.270 -10.567 381 HA GLU 48 HA GLU 48 5.413 0.040 -11.283 382 HB2 GLU 48 HB2 GLU 48 6.411 1.781 -9.007 383 HB3 GLU 48 HB3 GLU 48 4.888 0.901 -9.148 384 HG2 GLU 48 HG2 GLU 48 6.327 -1.263 -9.186 385 HG3 GLU 48 HG3 GLU 48 7.674 -0.239 -8.718 386 H LEU 49 H LEU 49 7.608 2.836 -11.081 387 HA LEU 49 HA LEU 49 5.737 4.836 -11.968 388 HB2 LEU 49 HB2 LEU 49 8.762 4.584 -12.167 389 HB3 LEU 49 HB3 LEU 49 7.922 6.024 -12.697 390 HG LEU 49 HG LEU 49 7.544 4.978 -9.859 391 HD11 LEU 49 HD11 LEU 49 9.943 5.190 -10.436 392 HD12 LEU 49 HD12 LEU 49 9.390 6.304 -9.171 393 HD13 LEU 49 HD13 LEU 49 9.674 6.908 -10.838 394 HD21 LEU 49 HD21 LEU 49 7.103 7.615 -11.324 395 HD22 LEU 49 HD22 LEU 49 7.298 7.540 -9.577 396 HD23 LEU 49 HD23 LEU 49 5.954 6.683 -10.353 397 H ILE 50 H ILE 50 8.102 2.794 -13.671 398 HA ILE 50 HA ILE 50 7.732 3.913 -16.281 399 HB ILE 50 HB ILE 50 8.423 1.075 -15.448 400 HG12 ILE 50 HG12 ILE 50 10.220 3.131 -16.815 401 HG13 ILE 50 HG13 ILE 50 10.001 3.174 -15.072 402 HG21 ILE 50 HG21 ILE 50 9.200 0.701 -17.804 403 HG22 ILE 50 HG22 ILE 50 7.466 0.923 -17.695 404 HG23 ILE 50 HG23 ILE 50 8.476 2.260 -18.266 405 HD11 ILE 50 HD11 ILE 50 12.027 1.950 -15.673 406 HD12 ILE 50 HD12 ILE 50 10.862 0.896 -14.850 407 HD13 ILE 50 HD13 ILE 50 11.085 0.779 -16.610 408 H ASP 51 H ASP 51 6.006 1.177 -14.665 409 HA ASP 51 HA ASP 51 4.214 0.659 -16.749 410 HB2 ASP 51 HB2 ASP 51 4.841 -0.643 -14.589 411 HB3 ASP 51 HB3 ASP 51 3.563 0.270 -13.822 412 H PHE 52 H PHE 52 4.313 3.406 -14.906 413 HA PHE 52 HA PHE 52 1.416 4.019 -15.304 414 HB2 PHE 52 HB2 PHE 52 2.218 4.299 -13.011 415 HB3 PHE 52 HB3 PHE 52 3.559 5.288 -13.562 416 HD1 PHE 52 HD1 PHE 52 3.384 7.609 -13.509 417 HD2 PHE 52 HD2 PHE 52 -0.227 5.264 -13.678 418 HE1 PHE 52 HE1 PHE 52 2.008 9.693 -13.409 419 HE2 PHE 52 HE2 PHE 52 -1.574 7.339 -13.528 420 HZ PHE 52 HZ PHE 52 -0.397 9.577 -13.382 421 H LEU 53 H LEU 53 4.705 5.562 -15.648 422 HA LEU 53 HA LEU 53 3.799 7.721 -17.258 423 HB2 LEU 53 HB2 LEU 53 6.472 6.351 -16.893 424 HB3 LEU 53 HB3 LEU 53 6.258 7.633 -18.071 425 HG LEU 53 HG LEU 53 7.257 8.669 -16.336 426 HD11 LEU 53 HD11 LEU 53 5.744 10.390 -15.578 427 HD12 LEU 53 HD12 LEU 53 4.341 9.355 -15.847 428 HD13 LEU 53 HD13 LEU 53 5.306 9.939 -17.226 429 HD21 LEU 53 HD21 LEU 53 7.080 7.076 -14.585 430 HD22 LEU 53 HD22 LEU 53 5.352 7.408 -14.374 431 HD23 LEU 53 HD23 LEU 53 6.552 8.656 -13.979 432 H ASN 54 H ASN 54 4.460 4.366 -18.135 433 HA ASN 54 HA ASN 54 4.811 4.903 -20.970 434 HB2 ASN 54 HB2 ASN 54 5.449 2.766 -19.471 435 HB3 ASN 54 HB3 ASN 54 3.872 2.203 -19.980 436 HD21 ASN 54 HD21 ASN 54 7.101 2.343 -20.686 437 HD22 ASN 54 HD22 ASN 54 7.059 1.991 -22.412 438 H GLN 55 H GLN 55 2.177 3.416 -19.018 439 HA GLN 55 HA GLN 55 0.257 3.536 -21.063 440 HB2 GLN 55 HB2 GLN 55 -1.331 2.813 -19.423 441 HB3 GLN 55 HB3 GLN 55 0.221 2.006 -19.158 442 HG2 GLN 55 HG2 GLN 55 -0.496 2.433 -17.039 443 HG3 GLN 55 HG3 GLN 55 0.698 3.664 -17.366 444 HE21 GLN 55 HE21 GLN 55 0.053 5.790 -16.864 445 HE22 GLN 55 HE22 GLN 55 -1.613 6.265 -16.553 446 H LEU 56 H LEU 56 1.400 6.078 -18.997 447 HA LEU 56 HA LEU 56 -0.912 7.719 -18.914 448 HB2 LEU 56 HB2 LEU 56 1.725 7.878 -17.953 449 HB3 LEU 56 HB3 LEU 56 1.696 9.152 -19.130 450 HG LEU 56 HG LEU 56 -0.206 8.817 -16.769 451 HD11 LEU 56 HD11 LEU 56 2.062 10.788 -17.308 452 HD12 LEU 56 HD12 LEU 56 2.076 9.446 -16.137 453 HD13 LEU 56 HD13 LEU 56 0.981 10.816 -15.900 454 HD21 LEU 56 HD21 LEU 56 -1.391 9.946 -18.550 455 HD22 LEU 56 HD22 LEU 56 -0.020 11.040 -18.851 456 HD23 LEU 56 HD23 LEU 56 -0.944 11.131 -17.336 457 H ASP 57 H ASP 57 1.605 7.291 -21.363 458 HA ASP 57 HA ASP 57 0.355 9.430 -23.029 459 HB2 ASP 57 HB2 ASP 57 2.880 9.392 -22.178 460 HB3 ASP 57 HB3 ASP 57 3.090 8.323 -23.564 461 H SER 58 H SER 58 1.656 6.069 -23.157 462 HA SER 58 HA SER 58 0.637 5.775 -25.893 463 HB2 SER 58 HB2 SER 58 2.303 3.929 -24.147 464 HB3 SER 58 HB3 SER 58 1.973 3.716 -25.865 465 HG SER 58 HG SER 58 4.039 4.764 -25.316 466 H GLU 59 H GLU 59 -0.574 5.078 -22.706 467 HA GLU 59 HA GLU 59 -2.024 3.732 -21.837 468 HB2 GLU 59 HB2 GLU 59 -3.260 5.404 -23.488 469 HB3 GLU 59 HB3 GLU 59 -3.749 3.889 -24.274 470 HG2 GLU 59 HG2 GLU 59 -4.260 3.144 -21.746 471 HG3 GLU 59 HG3 GLU 59 -4.161 4.870 -21.431 472 H GLU 60 H GLU 60 0.025 2.197 -23.246 473 HA GLU 60 HA GLU 60 -1.385 -0.408 -23.369 474 HB2 GLU 60 HB2 GLU 60 0.608 0.763 -25.349 475 HB3 GLU 60 HB3 GLU 60 0.332 -0.980 -25.186 476 HG2 GLU 60 HG2 GLU 60 -2.091 -0.599 -25.667 477 HG3 GLU 60 HG3 GLU 60 -1.679 1.062 -26.100 478 H GLN 61 H GLN 61 0.922 -1.970 -23.698 479 HA GLN 61 HA GLN 61 2.352 -3.093 -22.684 480 HB2 GLN 61 HB2 GLN 61 3.373 -0.282 -22.424 481 HB3 GLN 61 HB3 GLN 61 4.271 -1.663 -21.832 482 HG2 GLN 61 HG2 GLN 61 3.258 -1.603 -24.678 483 HG3 GLN 61 HG3 GLN 61 4.744 -0.784 -24.239 484 HE21 GLN 61 HE21 GLN 61 5.956 -2.572 -22.444 485 HE22 GLN 61 HE22 GLN 61 6.378 -4.012 -23.366 486 H THR 62 H THR 62 -0.008 -2.074 -21.032 487 HA THR 62 HA THR 62 0.567 -1.774 -18.334 488 HB THR 62 HB THR 62 -1.668 -3.261 -19.775 489 HG1 THR 62 HG1 THR 62 -2.248 -1.403 -20.363 490 HG21 THR 62 HG21 THR 62 -1.654 -2.037 -16.997 491 HG22 THR 62 HG22 THR 62 -1.809 -3.763 -17.391 492 HG23 THR 62 HG23 THR 62 -3.091 -2.633 -17.860 493 H LYS 63 H LYS 63 1.756 -3.094 -16.983 494 HA LYS 63 HA LYS 63 2.027 -5.952 -17.754 495 HB2 LYS 63 HB2 LYS 63 3.671 -4.194 -15.920 496 HB3 LYS 63 HB3 LYS 63 3.834 -5.943 -16.047 497 HG2 LYS 63 HG2 LYS 63 4.019 -5.419 -18.667 498 HG3 LYS 63 HG3 LYS 63 4.368 -3.798 -18.139 499 HD2 LYS 63 HD2 LYS 63 6.442 -5.025 -18.542 500 HD3 LYS 63 HD3 LYS 63 6.307 -4.635 -16.827 501 HE2 LYS 63 HE2 LYS 63 7.104 -6.931 -17.095 502 HE3 LYS 63 HE3 LYS 63 5.533 -6.891 -16.312 503 HZ1 LYS 63 HZ1 LYS 63 6.145 -7.733 -19.045 504 HZ2 LYS 63 HZ2 LYS 63 4.604 -7.324 -18.630 505 HZ3 LYS 63 HZ3 LYS 63 5.314 -8.538 -17.828 Start of MODEL 19 1 H1 GLY 1 H GLY 1 0.968 1.168 0.592 2 HA2 GLY 1 HA2 GLY 1 3.385 -0.095 -0.576 3 HA3 GLY 1 HA3 GLY 1 1.827 0.088 -1.414 4 H ILE 2 H ILE 2 2.601 1.384 -3.095 5 HA ILE 2 HA ILE 2 3.105 4.214 -2.492 6 HB ILE 2 HB ILE 2 5.371 3.053 -2.717 7 HG12 ILE 2 HG12 ILE 2 6.463 4.436 -4.166 8 HG13 ILE 2 HG13 ILE 2 5.037 4.760 -5.166 9 HG21 ILE 2 HG21 ILE 2 4.187 2.168 -5.374 10 HG22 ILE 2 HG22 ILE 2 5.895 2.290 -5.174 11 HG23 ILE 2 HG23 ILE 2 4.977 1.183 -4.140 12 HD11 ILE 2 HD11 ILE 2 5.639 6.683 -3.792 13 HD12 ILE 2 HD12 ILE 2 4.043 6.105 -3.372 14 HD13 ILE 2 HD13 ILE 2 5.427 5.725 -2.306 15 H ASP 3 H ASP 3 2.938 5.472 -4.633 16 HA ASP 3 HA ASP 3 1.087 4.145 -6.509 17 HB2 ASP 3 HB2 ASP 3 0.756 6.860 -5.257 18 HB3 ASP 3 HB3 ASP 3 -0.241 6.179 -6.494 19 H ALA 4 H ALA 4 2.081 4.457 -8.360 20 HA ALA 4 HA ALA 4 4.377 6.087 -8.747 21 HB1 ALA 4 HB1 ALA 4 2.372 5.009 -10.792 22 HB2 ALA 4 HB2 ALA 4 3.926 5.734 -11.209 23 HB3 ALA 4 HB3 ALA 4 3.878 4.216 -10.278 24 H ALA 5 H ALA 5 0.925 6.714 -9.357 25 HA ALA 5 HA ALA 5 1.161 9.231 -10.636 26 HB1 ALA 5 HB1 ALA 5 -1.175 9.559 -9.964 27 HB2 ALA 5 HB2 ALA 5 -0.948 7.878 -10.489 28 HB3 ALA 5 HB3 ALA 5 -1.043 8.279 -8.747 29 H GLN 6 H GLN 6 1.233 8.367 -7.168 30 HA GLN 6 HA GLN 6 0.969 11.086 -6.226 31 HB2 GLN 6 HB2 GLN 6 2.001 8.523 -4.951 32 HB3 GLN 6 HB3 GLN 6 2.018 10.015 -4.085 33 HG2 GLN 6 HG2 GLN 6 -0.556 8.898 -5.288 34 HG3 GLN 6 HG3 GLN 6 0.020 8.521 -3.662 35 HE21 GLN 6 HE21 GLN 6 -1.338 11.147 -5.717 36 HE22 GLN 6 HE22 GLN 6 -1.505 12.246 -4.361 37 H ILE 7 H ILE 7 3.693 8.944 -7.128 38 HA ILE 7 HA ILE 7 5.716 10.703 -6.150 39 HB ILE 7 HB ILE 7 5.867 8.518 -8.233 40 HG12 ILE 7 HG12 ILE 7 6.660 8.304 -5.314 41 HG13 ILE 7 HG13 ILE 7 5.097 7.772 -5.897 42 HG21 ILE 7 HG21 ILE 7 7.826 10.038 -8.303 43 HG22 ILE 7 HG22 ILE 7 7.937 9.968 -6.524 44 HG23 ILE 7 HG23 ILE 7 8.340 8.553 -7.497 45 HD11 ILE 7 HD11 ILE 7 5.977 5.993 -7.156 46 HD12 ILE 7 HD12 ILE 7 7.625 6.631 -7.159 47 HD13 ILE 7 HD13 ILE 7 6.962 5.999 -5.680 48 H VAL 8 H VAL 8 3.983 10.357 -9.264 49 HA VAL 8 HA VAL 8 5.669 12.200 -10.706 50 HB VAL 8 HB VAL 8 2.865 11.100 -11.181 51 HG11 VAL 8 HG11 VAL 8 3.057 11.970 -13.510 52 HG12 VAL 8 HG12 VAL 8 2.957 13.280 -12.338 53 HG13 VAL 8 HG13 VAL 8 4.530 12.856 -13.051 54 HG21 VAL 8 HG21 VAL 8 3.980 9.812 -12.934 55 HG22 VAL 8 HG22 VAL 8 5.503 10.612 -12.598 56 HG23 VAL 8 HG23 VAL 8 4.779 9.514 -11.386 57 H ASP 9 H ASP 9 2.640 12.538 -8.798 58 HA ASP 9 HA ASP 9 2.112 15.259 -9.374 59 HB2 ASP 9 HB2 ASP 9 0.408 13.916 -8.367 60 HB3 ASP 9 HB3 ASP 9 1.487 13.453 -7.044 61 H GLU 10 H GLU 10 3.910 13.801 -6.591 62 HA GLU 10 HA GLU 10 4.567 16.364 -5.495 63 HB2 GLU 10 HB2 GLU 10 6.084 15.179 -4.012 64 HB3 GLU 10 HB3 GLU 10 4.527 14.342 -4.120 65 HG2 GLU 10 HG2 GLU 10 5.533 12.771 -5.745 66 HG3 GLU 10 HG3 GLU 10 7.069 13.561 -5.592 67 H ALA 11 H ALA 11 6.241 14.241 -7.853 68 HA ALA 11 HA ALA 11 8.670 15.774 -7.825 69 HB1 ALA 11 HB1 ALA 11 8.514 13.485 -8.854 70 HB2 ALA 11 HB2 ALA 11 7.404 14.115 -10.092 71 HB3 ALA 11 HB3 ALA 11 9.081 14.664 -10.052 72 H LEU 12 H LEU 12 5.635 15.984 -9.757 73 HA LEU 12 HA LEU 12 6.510 18.219 -11.312 74 HB2 LEU 12 HB2 LEU 12 3.755 17.179 -10.547 75 HB3 LEU 12 HB3 LEU 12 3.951 18.636 -11.518 76 HG LEU 12 HG LEU 12 5.116 15.937 -12.326 77 HD11 LEU 12 HD11 LEU 12 2.656 15.858 -12.265 78 HD12 LEU 12 HD12 LEU 12 3.247 15.828 -13.933 79 HD13 LEU 12 HD13 LEU 12 2.571 17.325 -13.263 80 HD21 LEU 12 HD21 LEU 12 6.340 17.722 -13.351 81 HD22 LEU 12 HD22 LEU 12 4.860 18.621 -13.735 82 HD23 LEU 12 HD23 LEU 12 5.230 17.107 -14.581 83 H GLU 13 H GLU 13 5.110 18.053 -8.054 84 HA GLU 13 HA GLU 13 4.574 20.881 -7.783 85 HB2 GLU 13 HB2 GLU 13 5.011 18.566 -5.872 86 HB3 GLU 13 HB3 GLU 13 5.058 20.198 -5.238 87 HG2 GLU 13 HG2 GLU 13 2.743 19.116 -6.879 88 HG3 GLU 13 HG3 GLU 13 2.844 19.049 -5.117 89 H GLN 14 H GLN 14 7.405 18.846 -7.395 90 HA GLN 14 HA GLN 14 9.119 20.961 -6.306 91 HB2 GLN 14 HB2 GLN 14 9.512 18.100 -7.200 92 HB3 GLN 14 HB3 GLN 14 10.851 19.105 -6.590 93 HG2 GLN 14 HG2 GLN 14 9.749 19.268 -4.443 94 HG3 GLN 14 HG3 GLN 14 8.329 18.404 -5.032 95 HE21 GLN 14 HE21 GLN 14 8.693 16.991 -3.238 96 HE22 GLN 14 HE22 GLN 14 9.909 15.742 -3.276 97 H GLY 15 H GLY 15 7.913 20.247 -9.395 98 HA2 GLY 15 HA2 GLY 15 8.370 21.421 -11.369 99 HA3 GLY 15 HA3 GLY 15 9.873 22.035 -10.643 100 H ILE 16 H ILE 16 9.042 18.605 -10.696 101 HA ILE 16 HA ILE 16 11.185 18.150 -12.686 102 HB ILE 16 HB ILE 16 10.454 16.403 -10.333 103 HG12 ILE 16 HG12 ILE 16 13.181 17.577 -10.314 104 HG13 ILE 16 HG13 ILE 16 11.908 18.742 -10.004 105 HG21 ILE 16 HG21 ILE 16 11.286 15.031 -12.078 106 HG22 ILE 16 HG22 ILE 16 12.528 16.205 -12.549 107 HG23 ILE 16 HG23 ILE 16 12.692 15.305 -11.048 108 HD11 ILE 16 HD11 ILE 16 12.629 17.764 -7.856 109 HD12 ILE 16 HD12 ILE 16 10.996 17.195 -8.262 110 HD13 ILE 16 HD13 ILE 16 12.359 16.138 -8.571 111 H THR 17 H THR 17 10.501 17.285 -14.408 112 HA THR 17 HA THR 17 7.847 15.992 -14.565 113 HB THR 17 HB THR 17 9.839 17.325 -16.375 114 HG1 THR 17 HG1 THR 17 7.078 17.272 -16.721 115 HG21 THR 17 HG21 THR 17 8.726 16.362 -18.402 116 HG22 THR 17 HG22 THR 17 8.060 15.076 -17.347 117 HG23 THR 17 HG23 THR 17 9.809 15.284 -17.510 118 H LEU 18 H LEU 18 7.595 13.818 -15.027 119 HA LEU 18 HA LEU 18 10.044 12.098 -15.090 120 HB2 LEU 18 HB2 LEU 18 7.202 11.521 -14.137 121 HB3 LEU 18 HB3 LEU 18 8.475 10.325 -14.355 122 HG LEU 18 HG LEU 18 8.117 12.363 -12.165 123 HD11 LEU 18 HD11 LEU 18 7.409 10.120 -11.766 124 HD12 LEU 18 HD12 LEU 18 8.900 10.331 -10.866 125 HD13 LEU 18 HD13 LEU 18 8.893 9.449 -12.431 126 HD21 LEU 18 HD21 LEU 18 10.366 12.913 -13.035 127 HD22 LEU 18 HD22 LEU 18 10.834 11.188 -12.858 128 HD23 LEU 18 HD23 LEU 18 10.421 12.178 -11.435 129 H PHE 19 H PHE 19 9.943 10.278 -16.474 130 HA PHE 19 HA PHE 19 7.851 9.802 -18.361 131 HB2 PHE 19 HB2 PHE 19 8.917 10.646 -20.417 132 HB3 PHE 19 HB3 PHE 19 8.425 11.917 -19.370 133 HD1 PHE 19 HD1 PHE 19 11.275 10.303 -21.005 134 HD2 PHE 19 HD2 PHE 19 10.111 13.263 -18.096 135 HE1 PHE 19 HE1 PHE 19 13.529 11.344 -21.130 136 HE2 PHE 19 HE2 PHE 19 12.320 14.322 -18.278 137 HZ PHE 19 HZ PHE 19 14.066 13.334 -19.733 138 H VAL 20 H VAL 20 8.615 8.308 -20.157 139 HA VAL 20 HA VAL 20 11.012 6.713 -19.345 140 HB VAL 20 HB VAL 20 8.310 5.683 -20.301 141 HG11 VAL 20 HG11 VAL 20 10.877 4.254 -19.482 142 HG12 VAL 20 HG12 VAL 20 9.328 3.458 -19.894 143 HG13 VAL 20 HG13 VAL 20 10.217 4.339 -21.127 144 HG21 VAL 20 HG21 VAL 20 8.014 4.725 -18.148 145 HG22 VAL 20 HG22 VAL 20 9.625 5.282 -17.585 146 HG23 VAL 20 HG23 VAL 20 8.326 6.435 -17.899 147 H VAL 21 H VAL 21 12.462 7.220 -20.916 148 HA VAL 21 HA VAL 21 11.519 7.434 -23.717 149 HB VAL 21 HB VAL 21 12.649 9.356 -23.217 150 HG11 VAL 21 HG11 VAL 21 14.897 9.524 -22.211 151 HG12 VAL 21 HG12 VAL 21 13.692 8.856 -21.112 152 HG13 VAL 21 HG13 VAL 21 14.873 7.775 -21.900 153 HG21 VAL 21 HG21 VAL 21 13.416 8.339 -25.338 154 HG22 VAL 21 HG22 VAL 21 14.673 9.337 -24.594 155 HG23 VAL 21 HG23 VAL 21 14.789 7.584 -24.480 156 H ASN 22 H ASN 22 11.806 5.774 -25.007 157 HA ASN 22 HA ASN 22 12.268 3.602 -25.660 158 HB2 ASN 22 HB2 ASN 22 15.085 4.645 -25.241 159 HB3 ASN 22 HB3 ASN 22 14.680 3.148 -26.084 160 HD21 ASN 22 HD21 ASN 22 14.632 6.633 -26.285 161 HD22 ASN 22 HD22 ASN 22 13.901 6.752 -27.863 162 H ASN 23 H ASN 23 11.292 3.368 -23.327 163 HA ASN 23 HA ASN 23 11.069 2.149 -21.433 164 HB2 ASN 23 HB2 ASN 23 11.372 0.382 -23.245 165 HB3 ASN 23 HB3 ASN 23 13.038 0.217 -22.648 166 HD21 ASN 23 HD21 ASN 23 9.687 0.424 -21.380 167 HD22 ASN 23 HD22 ASN 23 9.813 -0.950 -20.282 168 H ARG 24 H ARG 24 12.973 4.226 -21.100 169 HA ARG 24 HA ARG 24 14.585 3.119 -18.880 170 HB2 ARG 24 HB2 ARG 24 15.665 4.947 -21.086 171 HB3 ARG 24 HB3 ARG 24 16.464 4.657 -19.531 172 HG2 ARG 24 HG2 ARG 24 16.377 2.200 -19.970 173 HG3 ARG 24 HG3 ARG 24 15.695 2.520 -21.557 174 HD2 ARG 24 HD2 ARG 24 17.740 3.661 -22.261 175 HD3 ARG 24 HD3 ARG 24 18.444 3.388 -20.660 176 HE ARG 24 HE ARG 24 18.808 1.208 -21.130 177 HH11 ARG 24 HH11 ARG 24 16.512 2.359 -23.655 178 HH12 ARG 24 HH12 ARG 24 16.623 0.863 -24.523 179 HH21 ARG 24 HH21 ARG 24 18.685 -0.863 -22.341 180 HH22 ARG 24 HH22 ARG 24 17.788 -0.824 -23.839 181 H LEU 25 H LEU 25 13.970 4.102 -17.069 182 HA LEU 25 HA LEU 25 12.107 6.313 -17.147 183 HB2 LEU 25 HB2 LEU 25 11.866 4.615 -15.469 184 HB3 LEU 25 HB3 LEU 25 13.496 4.882 -14.853 185 HG LEU 25 HG LEU 25 12.912 7.008 -13.918 186 HD11 LEU 25 HD11 LEU 25 10.284 6.844 -15.404 187 HD12 LEU 25 HD12 LEU 25 11.559 8.108 -15.454 188 HD13 LEU 25 HD13 LEU 25 10.585 7.947 -14.041 189 HD21 LEU 25 HD21 LEU 25 12.285 5.455 -12.347 190 HD22 LEU 25 HD22 LEU 25 10.970 4.771 -13.353 191 HD23 LEU 25 HD23 LEU 25 10.783 6.315 -12.541 192 H GLN 26 H GLN 26 12.661 8.341 -17.461 193 HA GLN 26 HA GLN 26 15.165 9.387 -16.289 194 HB2 GLN 26 HB2 GLN 26 14.057 10.002 -19.048 195 HB3 GLN 26 HB3 GLN 26 15.456 10.778 -18.302 196 HG2 GLN 26 HG2 GLN 26 16.059 8.037 -18.142 197 HG3 GLN 26 HG3 GLN 26 15.235 8.145 -19.653 198 HE21 GLN 26 HE21 GLN 26 17.884 9.565 -17.715 199 HE22 GLN 26 HE22 GLN 26 18.885 10.032 -19.091 200 H TYR 27 H TYR 27 14.894 12.049 -16.635 201 HA TYR 27 HA TYR 27 12.272 12.971 -16.004 202 HB2 TYR 27 HB2 TYR 27 12.748 13.683 -13.717 203 HB3 TYR 27 HB3 TYR 27 12.759 11.976 -13.839 204 HD1 TYR 27 HD1 TYR 27 14.981 10.680 -13.749 205 HD2 TYR 27 HD2 TYR 27 14.671 14.932 -13.012 206 HE1 TYR 27 HE1 TYR 27 17.106 10.629 -12.388 207 HE2 TYR 27 HE2 TYR 27 16.784 14.875 -11.717 208 HH TYR 27 HH TYR 27 18.870 12.082 -11.367 209 H GLU 28 H GLU 28 12.457 15.371 -15.482 210 HA GLU 28 HA GLU 28 14.977 16.639 -16.341 211 HB2 GLU 28 HB2 GLU 28 13.923 16.282 -18.439 212 HB3 GLU 28 HB3 GLU 28 12.327 16.760 -17.831 213 HG2 GLU 28 HG2 GLU 28 12.880 19.032 -17.747 214 HG3 GLU 28 HG3 GLU 28 14.625 18.716 -17.755 215 H THR 29 H THR 29 15.307 18.581 -15.247 216 HA THR 29 HA THR 29 13.200 20.197 -14.241 217 HB THR 29 HB THR 29 13.226 18.304 -12.636 218 HG1 THR 29 HG1 THR 29 12.681 20.309 -11.901 219 HG21 THR 29 HG21 THR 29 15.070 17.672 -11.335 220 HG22 THR 29 HG22 THR 29 16.021 19.110 -11.786 221 HG23 THR 29 HG23 THR 29 15.743 17.790 -12.936 222 H SER 30 H SER 30 14.315 22.033 -12.946 223 HA SER 30 HA SER 30 17.177 22.451 -13.571 224 HB2 SER 30 HB2 SER 30 14.899 24.357 -14.203 225 HB3 SER 30 HB3 SER 30 16.622 24.759 -14.303 226 HG SER 30 HG SER 30 14.971 23.371 -16.005 227 H ARG 31 H ARG 31 16.959 21.778 -11.227 228 HA ARG 31 HA ARG 31 16.781 24.166 -9.514 229 HB2 ARG 31 HB2 ARG 31 15.412 22.917 -7.863 230 HB3 ARG 31 HB3 ARG 31 14.547 23.143 -9.390 231 HG2 ARG 31 HG2 ARG 31 15.262 20.829 -10.049 232 HG3 ARG 31 HG3 ARG 31 15.961 20.617 -8.464 233 HD2 ARG 31 HD2 ARG 31 13.030 21.105 -9.135 234 HD3 ARG 31 HD3 ARG 31 13.744 19.571 -8.680 235 HE ARG 31 HE ARG 31 13.703 20.120 -6.466 236 HH11 ARG 31 HH11 ARG 31 12.685 22.919 -8.321 237 HH12 ARG 31 HH12 ARG 31 12.014 23.769 -6.978 238 HH21 ARG 31 HH21 ARG 31 12.672 21.202 -4.661 239 HH22 ARG 31 HH22 ARG 31 12.340 22.889 -4.834 240 H ASP 32 H ASP 32 17.789 23.600 -7.338 241 HA ASP 32 HA ASP 32 19.898 21.501 -7.656 242 HB2 ASP 32 HB2 ASP 32 20.782 23.770 -8.034 243 HB3 ASP 32 HB3 ASP 32 20.177 24.260 -6.447 244 H SER 33 H SER 33 20.863 20.912 -5.450 245 HA SER 33 HA SER 33 20.563 19.842 -3.497 246 HB2 SER 33 HB2 SER 33 20.373 22.413 -2.961 247 HB3 SER 33 HB3 SER 33 18.685 22.030 -2.588 248 HG SER 33 HG SER 33 19.820 21.765 -0.746 249 H ILE 34 H ILE 34 19.102 18.739 -5.475 250 HA ILE 34 HA ILE 34 16.344 18.637 -5.074 251 HB ILE 34 HB ILE 34 18.295 17.134 -6.660 252 HG12 ILE 34 HG12 ILE 34 15.329 17.708 -7.094 253 HG13 ILE 34 HG13 ILE 34 16.615 18.884 -7.321 254 HG21 ILE 34 HG21 ILE 34 15.862 15.510 -5.742 255 HG22 ILE 34 HG22 ILE 34 16.927 15.117 -7.108 256 HG23 ILE 34 HG23 ILE 34 17.563 15.129 -5.464 257 HD11 ILE 34 HD11 ILE 34 17.586 17.432 -9.106 258 HD12 ILE 34 HD12 ILE 34 16.170 16.359 -8.947 259 HD13 ILE 34 HD13 ILE 34 15.962 18.046 -9.438 260 HA PRO 35 HA PRO 35 15.789 16.434 -1.298 261 HB2 PRO 35 HB2 PRO 35 13.350 15.234 -1.828 262 HB3 PRO 35 HB3 PRO 35 13.531 16.962 -1.344 263 HG2 PRO 35 HG2 PRO 35 13.121 15.699 -4.016 264 HG3 PRO 35 HG3 PRO 35 12.443 17.260 -3.476 265 HD2 PRO 35 HD2 PRO 35 14.609 17.157 -5.105 266 HD3 PRO 35 HD3 PRO 35 14.360 18.424 -3.973 267 H THR 36 H THR 36 17.309 14.801 -1.200 268 HA THR 36 HA THR 36 17.679 12.746 -3.064 269 HB THR 36 HB THR 36 18.460 12.552 -0.157 270 HG1 THR 36 HG1 THR 36 19.647 14.259 -2.124 271 HG21 THR 36 HG21 THR 36 20.636 11.804 -1.218 272 HG22 THR 36 HG22 THR 36 19.796 11.773 -2.785 273 HG23 THR 36 HG23 THR 36 19.266 10.719 -1.451 274 H GLU 37 H GLU 37 15.290 12.946 -0.482 275 HA GLU 37 HA GLU 37 14.724 10.175 -0.163 276 HB2 GLU 37 HB2 GLU 37 12.551 10.978 0.726 277 HB3 GLU 37 HB3 GLU 37 13.958 11.719 1.480 278 HG2 GLU 37 HG2 GLU 37 13.569 13.789 0.126 279 HG3 GLU 37 HG3 GLU 37 12.112 13.060 -0.554 280 H LEU 38 H LEU 38 13.024 12.665 -2.143 281 HA LEU 38 HA LEU 38 11.388 10.812 -3.552 282 HB2 LEU 38 HB2 LEU 38 11.153 13.446 -3.278 283 HB3 LEU 38 HB3 LEU 38 12.136 13.518 -4.682 284 HG LEU 38 HG LEU 38 9.348 12.431 -4.274 285 HD11 LEU 38 HD11 LEU 38 9.345 14.638 -5.090 286 HD12 LEU 38 HD12 LEU 38 9.028 13.706 -6.514 287 HD13 LEU 38 HD13 LEU 38 10.658 14.336 -6.261 288 HD21 LEU 38 HD21 LEU 38 11.115 11.670 -6.542 289 HD22 LEU 38 HD22 LEU 38 9.333 11.580 -6.606 290 HD23 LEU 38 HD23 LEU 38 10.217 10.572 -5.472 291 H LEU 39 H LEU 39 14.604 12.221 -4.231 292 HA LEU 39 HA LEU 39 15.001 11.278 -6.860 293 HB2 LEU 39 HB2 LEU 39 16.445 12.838 -5.603 294 HB3 LEU 39 HB3 LEU 39 17.000 11.521 -4.587 295 HG LEU 39 HG LEU 39 18.583 12.312 -6.323 296 HD11 LEU 39 HD11 LEU 39 17.946 9.366 -6.644 297 HD12 LEU 39 HD12 LEU 39 18.752 10.099 -5.218 298 HD13 LEU 39 HD13 LEU 39 19.489 10.184 -6.830 299 HD21 LEU 39 HD21 LEU 39 18.360 11.620 -8.631 300 HD22 LEU 39 HD22 LEU 39 16.992 12.635 -8.173 301 HD23 LEU 39 HD23 LEU 39 16.782 10.867 -8.304 302 H ASN 40 H ASN 40 15.725 9.623 -3.748 303 HA ASN 40 HA ASN 40 16.511 7.164 -5.036 304 HB2 ASN 40 HB2 ASN 40 15.913 7.862 -2.166 305 HB3 ASN 40 HB3 ASN 40 16.130 6.188 -2.689 306 HD21 ASN 40 HD21 ASN 40 17.756 9.235 -2.195 307 HD22 ASN 40 HD22 ASN 40 19.395 8.602 -2.428 308 H LYS 41 H LYS 41 13.397 8.383 -3.769 309 HA LYS 41 HA LYS 41 11.961 5.957 -3.803 310 HB2 LYS 41 HB2 LYS 41 11.168 8.013 -2.804 311 HB3 LYS 41 HB3 LYS 41 11.056 8.793 -4.381 312 HG2 LYS 41 HG2 LYS 41 9.186 7.524 -5.051 313 HG3 LYS 41 HG3 LYS 41 9.470 6.314 -3.791 314 HD2 LYS 41 HD2 LYS 41 7.592 7.678 -3.134 315 HD3 LYS 41 HD3 LYS 41 8.950 7.954 -2.045 316 HE2 LYS 41 HE2 LYS 41 9.458 9.997 -3.636 317 HE3 LYS 41 HE3 LYS 41 7.762 9.764 -4.113 318 HZ1 LYS 41 HZ1 LYS 41 7.187 10.013 -1.755 319 HZ2 LYS 41 HZ2 LYS 41 7.802 11.318 -2.416 320 HZ3 LYS 41 HZ3 LYS 41 8.750 10.465 -1.387 321 H TRP 42 H TRP 42 12.725 8.203 -6.497 322 HA TRP 42 HA TRP 42 11.174 6.918 -8.475 323 HB2 TRP 42 HB2 TRP 42 13.869 8.268 -8.808 324 HB3 TRP 42 HB3 TRP 42 12.757 7.830 -10.117 325 HD1 TRP 42 HD1 TRP 42 10.151 8.975 -8.433 326 HE1 TRP 42 HE1 TRP 42 9.789 11.494 -8.493 327 HE3 TRP 42 HE3 TRP 42 14.846 10.412 -9.803 328 HZ2 TRP 42 HZ2 TRP 42 11.381 13.856 -8.829 329 HZ3 TRP 42 HZ3 TRP 42 15.410 12.849 -9.905 330 HH2 TRP 42 HH2 TRP 42 13.768 14.510 -9.333 331 H LYS 43 H LYS 43 14.547 6.187 -7.448 332 HA LYS 43 HA LYS 43 14.723 4.027 -9.425 333 HB2 LYS 43 HB2 LYS 43 16.884 3.474 -8.297 334 HB3 LYS 43 HB3 LYS 43 16.770 5.088 -8.990 335 HG2 LYS 43 HG2 LYS 43 16.406 6.081 -6.849 336 HG3 LYS 43 HG3 LYS 43 16.368 4.501 -6.039 337 HD2 LYS 43 HD2 LYS 43 18.861 5.194 -7.560 338 HD3 LYS 43 HD3 LYS 43 18.497 6.149 -6.124 339 HE2 LYS 43 HE2 LYS 43 18.043 3.721 -5.065 340 HE3 LYS 43 HE3 LYS 43 19.172 3.224 -6.339 341 HZ1 LYS 43 HZ1 LYS 43 20.270 3.789 -4.247 342 HZ2 LYS 43 HZ2 LYS 43 19.623 5.285 -4.264 343 HZ3 LYS 43 HZ3 LYS 43 20.738 4.877 -5.406 344 H GLN 44 H GLN 44 13.770 4.292 -6.017 345 HA GLN 44 HA GLN 44 13.868 1.552 -5.320 346 HB2 GLN 44 HB2 GLN 44 13.504 3.469 -3.723 347 HB3 GLN 44 HB3 GLN 44 11.915 3.711 -4.419 348 HG2 GLN 44 HG2 GLN 44 11.409 2.502 -2.507 349 HG3 GLN 44 HG3 GLN 44 11.360 1.288 -3.750 350 HE21 GLN 44 HE21 GLN 44 11.791 -0.440 -2.349 351 HE22 GLN 44 HE22 GLN 44 13.331 -0.680 -1.551 352 H HIS 45 H HIS 45 11.211 3.509 -6.786 353 HA HIS 45 HA HIS 45 9.752 0.990 -7.427 354 HB2 HIS 45 HB2 HIS 45 8.676 3.810 -7.111 355 HB3 HIS 45 HB3 HIS 45 7.744 2.330 -7.332 356 HD1 HIS 45 HD1 HIS 45 7.615 0.667 -5.176 357 HD2 HIS 45 HD2 HIS 45 9.512 4.378 -4.671 358 HE1 HIS 45 HE1 HIS 45 8.125 0.907 -2.662 359 H LYS 46 H LYS 46 11.942 1.856 -9.065 360 HA LYS 46 HA LYS 46 11.325 3.437 -11.261 361 HB2 LYS 46 HB2 LYS 46 13.549 2.184 -10.646 362 HB3 LYS 46 HB3 LYS 46 12.906 0.870 -11.626 363 HG2 LYS 46 HG2 LYS 46 12.574 2.683 -13.481 364 HG3 LYS 46 HG3 LYS 46 13.506 3.724 -12.413 365 HD2 LYS 46 HD2 LYS 46 15.106 3.097 -13.843 366 HD3 LYS 46 HD3 LYS 46 15.374 1.936 -12.563 367 HE2 LYS 46 HE2 LYS 46 13.722 1.371 -15.069 368 HE3 LYS 46 HE3 LYS 46 15.463 1.127 -15.009 369 HZ1 LYS 46 HZ1 LYS 46 13.631 -0.290 -13.153 370 HZ2 LYS 46 HZ2 LYS 46 15.218 -0.594 -13.469 371 HZ3 LYS 46 HZ3 LYS 46 14.060 -0.862 -14.592 372 H GLN 47 H GLN 47 10.769 -0.147 -11.167 373 HA GLN 47 HA GLN 47 9.550 -0.257 -13.700 374 HB2 GLN 47 HB2 GLN 47 10.322 -2.052 -11.809 375 HB3 GLN 47 HB3 GLN 47 8.574 -2.190 -11.660 376 HG2 GLN 47 HG2 GLN 47 10.245 -2.499 -14.194 377 HG3 GLN 47 HG3 GLN 47 9.621 -3.829 -13.209 378 HE21 GLN 47 HE21 GLN 47 8.946 -1.974 -15.944 379 HE22 GLN 47 HE22 GLN 47 7.206 -2.326 -15.966 380 H GLU 48 H GLU 48 8.083 0.271 -10.506 381 HA GLU 48 HA GLU 48 5.371 0.159 -11.386 382 HB2 GLU 48 HB2 GLU 48 6.285 1.989 -9.137 383 HB3 GLU 48 HB3 GLU 48 4.719 1.218 -9.388 384 HG2 GLU 48 HG2 GLU 48 5.940 -1.036 -9.086 385 HG3 GLU 48 HG3 GLU 48 7.340 -0.058 -8.566 386 H LEU 49 H LEU 49 7.561 2.955 -11.021 387 HA LEU 49 HA LEU 49 5.771 4.973 -11.958 388 HB2 LEU 49 HB2 LEU 49 8.792 4.712 -12.130 389 HB3 LEU 49 HB3 LEU 49 7.944 6.169 -12.610 390 HG LEU 49 HG LEU 49 7.393 5.067 -9.841 391 HD11 LEU 49 HD11 LEU 49 9.892 5.067 -10.271 392 HD12 LEU 49 HD12 LEU 49 9.305 6.064 -8.922 393 HD13 LEU 49 HD13 LEU 49 9.768 6.831 -10.472 394 HD21 LEU 49 HD21 LEU 49 7.619 7.855 -11.067 395 HD22 LEU 49 HD22 LEU 49 7.337 7.521 -9.368 396 HD23 LEU 49 HD23 LEU 49 6.115 7.046 -10.558 397 H ILE 50 H ILE 50 8.093 2.880 -13.631 398 HA ILE 50 HA ILE 50 7.718 4.037 -16.202 399 HB ILE 50 HB ILE 50 8.432 1.187 -15.362 400 HG12 ILE 50 HG12 ILE 50 10.273 3.193 -16.706 401 HG13 ILE 50 HG13 ILE 50 10.019 3.276 -14.981 402 HG21 ILE 50 HG21 ILE 50 7.459 0.998 -17.618 403 HG22 ILE 50 HG22 ILE 50 8.551 2.247 -18.214 404 HG23 ILE 50 HG23 ILE 50 9.166 0.661 -17.664 405 HD11 ILE 50 HD11 ILE 50 10.937 0.683 -16.284 406 HD12 ILE 50 HD12 ILE 50 12.041 1.964 -15.753 407 HD13 ILE 50 HD13 ILE 50 10.993 1.130 -14.585 408 H ASP 51 H ASP 51 6.098 1.229 -14.782 409 HA ASP 51 HA ASP 51 4.395 0.600 -16.864 410 HB2 ASP 51 HB2 ASP 51 4.885 -0.331 -14.444 411 HB3 ASP 51 HB3 ASP 51 3.469 0.587 -13.986 412 H PHE 52 H PHE 52 4.050 3.113 -14.384 413 HA PHE 52 HA PHE 52 1.412 3.931 -15.122 414 HB2 PHE 52 HB2 PHE 52 2.258 4.287 -12.905 415 HB3 PHE 52 HB3 PHE 52 3.573 5.281 -13.497 416 HD1 PHE 52 HD1 PHE 52 3.343 7.578 -13.163 417 HD2 PHE 52 HD2 PHE 52 -0.214 5.224 -13.821 418 HE1 PHE 52 HE1 PHE 52 1.902 9.632 -12.994 419 HE2 PHE 52 HE2 PHE 52 -1.594 7.277 -13.621 420 HZ PHE 52 HZ PHE 52 -0.461 9.499 -13.186 421 H LEU 53 H LEU 53 4.609 5.577 -15.609 422 HA LEU 53 HA LEU 53 3.621 7.660 -17.256 423 HB2 LEU 53 HB2 LEU 53 6.331 6.354 -16.896 424 HB3 LEU 53 HB3 LEU 53 6.095 7.544 -18.156 425 HG LEU 53 HG LEU 53 7.097 8.683 -16.418 426 HD11 LEU 53 HD11 LEU 53 5.614 10.474 -15.887 427 HD12 LEU 53 HD12 LEU 53 4.183 9.448 -16.086 428 HD13 LEU 53 HD13 LEU 53 5.183 9.888 -17.494 429 HD21 LEU 53 HD21 LEU 53 6.830 7.240 -14.563 430 HD22 LEU 53 HD22 LEU 53 5.082 7.526 -14.498 431 HD23 LEU 53 HD23 LEU 53 6.221 8.835 -14.104 432 H ASN 54 H ASN 54 4.289 4.322 -18.028 433 HA ASN 54 HA ASN 54 4.427 4.742 -20.913 434 HB2 ASN 54 HB2 ASN 54 5.281 2.736 -19.350 435 HB3 ASN 54 HB3 ASN 54 3.728 2.040 -19.730 436 HD21 ASN 54 HD21 ASN 54 6.893 2.274 -20.582 437 HD22 ASN 54 HD22 ASN 54 6.813 1.949 -22.287 438 H GLN 55 H GLN 55 1.935 3.318 -18.688 439 HA GLN 55 HA GLN 55 -0.030 3.150 -20.758 440 HB2 GLN 55 HB2 GLN 55 -1.527 2.395 -19.085 441 HB3 GLN 55 HB3 GLN 55 0.066 1.721 -18.750 442 HG2 GLN 55 HG2 GLN 55 -0.697 2.299 -16.643 443 HG3 GLN 55 HG3 GLN 55 0.380 3.593 -17.077 444 HE21 GLN 55 HE21 GLN 55 -0.392 5.579 -16.441 445 HE22 GLN 55 HE22 GLN 55 -2.097 6.023 -16.406 446 H LEU 56 H LEU 56 0.979 5.801 -18.763 447 HA LEU 56 HA LEU 56 -1.382 7.385 -18.776 448 HB2 LEU 56 HB2 LEU 56 0.515 7.589 -17.208 449 HB3 LEU 56 HB3 LEU 56 1.591 8.015 -18.545 450 HG LEU 56 HG LEU 56 0.289 10.145 -18.830 451 HD11 LEU 56 HD11 LEU 56 -1.857 9.441 -17.906 452 HD12 LEU 56 HD12 LEU 56 -1.224 10.758 -16.936 453 HD13 LEU 56 HD13 LEU 56 -1.107 9.111 -16.310 454 HD21 LEU 56 HD21 LEU 56 1.180 11.182 -16.759 455 HD22 LEU 56 HD22 LEU 56 2.342 10.097 -17.527 456 HD23 LEU 56 HD23 LEU 56 1.454 9.567 -16.074 457 H ASP 57 H ASP 57 1.115 6.877 -21.169 458 HA ASP 57 HA ASP 57 0.124 9.194 -22.807 459 HB2 ASP 57 HB2 ASP 57 2.516 8.830 -21.799 460 HB3 ASP 57 HB3 ASP 57 2.755 7.733 -23.126 461 H SER 58 H SER 58 0.316 5.797 -22.752 462 HA SER 58 HA SER 58 -0.348 5.668 -25.672 463 HB2 SER 58 HB2 SER 58 1.649 3.849 -24.282 464 HB3 SER 58 HB3 SER 58 1.141 3.745 -25.979 465 HG SER 58 HG SER 58 2.107 6.149 -24.913 466 H GLU 59 H GLU 59 -1.111 4.659 -22.539 467 HA GLU 59 HA GLU 59 -2.282 2.847 -21.657 468 HB2 GLU 59 HB2 GLU 59 -4.617 3.285 -22.035 469 HB3 GLU 59 HB3 GLU 59 -3.689 4.770 -21.915 470 HG2 GLU 59 HG2 GLU 59 -3.682 4.863 -24.480 471 HG3 GLU 59 HG3 GLU 59 -4.859 3.557 -24.434 472 H GLU 60 H GLU 60 -0.723 1.613 -23.501 473 HA GLU 60 HA GLU 60 -2.485 -0.493 -24.703 474 HB2 GLU 60 HB2 GLU 60 0.027 0.888 -25.626 475 HB3 GLU 60 HB3 GLU 60 -0.097 -0.831 -25.935 476 HG2 GLU 60 HG2 GLU 60 -2.294 -0.476 -27.071 477 HG3 GLU 60 HG3 GLU 60 -2.087 1.261 -26.867 478 H GLN 61 H GLN 61 0.525 0.088 -22.854 479 HA GLN 61 HA GLN 61 1.251 -2.665 -22.735 480 HB2 GLN 61 HB2 GLN 61 2.037 -0.197 -21.156 481 HB3 GLN 61 HB3 GLN 61 2.670 -1.791 -20.738 482 HG2 GLN 61 HG2 GLN 61 2.934 -0.678 -23.560 483 HG3 GLN 61 HG3 GLN 61 4.086 -0.314 -22.273 484 HE21 GLN 61 HE21 GLN 61 5.887 -1.390 -23.217 485 HE22 GLN 61 HE22 GLN 61 5.923 -3.128 -23.341 486 H THR 62 H THR 62 1.138 -4.110 -21.202 487 HA THR 62 HA THR 62 0.139 -5.563 -19.960 488 HB THR 62 HB THR 62 1.659 -4.183 -18.533 489 HG1 THR 62 HG1 THR 62 1.429 -5.620 -17.049 490 HG21 THR 62 HG21 THR 62 -0.930 -3.326 -17.182 491 HG22 THR 62 HG22 THR 62 0.235 -2.267 -18.016 492 HG23 THR 62 HG23 THR 62 0.713 -3.115 -16.546 493 H LYS 63 H LYS 63 -1.946 -3.344 -21.062 494 HA LYS 63 HA LYS 63 -4.226 -3.493 -19.494 495 HB2 LYS 63 HB2 LYS 63 -5.466 -2.823 -21.357 496 HB3 LYS 63 HB3 LYS 63 -3.866 -2.121 -21.618 497 HG2 LYS 63 HG2 LYS 63 -3.342 -4.032 -23.182 498 HG3 LYS 63 HG3 LYS 63 -4.992 -4.628 -22.973 499 HD2 LYS 63 HD2 LYS 63 -4.235 -1.939 -24.149 500 HD3 LYS 63 HD3 LYS 63 -4.750 -3.388 -25.042 501 HE2 LYS 63 HE2 LYS 63 -6.940 -3.331 -23.883 502 HE3 LYS 63 HE3 LYS 63 -6.430 -1.879 -23.012 503 HZ1 LYS 63 HZ1 LYS 63 -7.621 -1.069 -24.777 504 HZ2 LYS 63 HZ2 LYS 63 -6.953 -2.102 -25.907 505 HZ3 LYS 63 HZ3 LYS 63 -6.099 -0.857 -25.250 Start of MODEL 20 1 H1 GLY 1 H GLY 1 2.171 0.572 1.233 2 HA2 GLY 1 HA2 GLY 1 3.293 -0.558 -0.638 3 HA3 GLY 1 HA3 GLY 1 1.734 -0.541 -1.489 4 H ILE 2 H ILE 2 2.932 0.724 -3.219 5 HA ILE 2 HA ILE 2 3.072 3.621 -2.539 6 HB ILE 2 HB ILE 2 5.361 2.597 -2.741 7 HG12 ILE 2 HG12 ILE 2 6.445 3.980 -4.209 8 HG13 ILE 2 HG13 ILE 2 4.961 4.225 -5.195 9 HG21 ILE 2 HG21 ILE 2 5.955 1.914 -5.234 10 HG22 ILE 2 HG22 ILE 2 5.237 0.741 -4.132 11 HG23 ILE 2 HG23 ILE 2 4.260 1.581 -5.363 12 HD11 ILE 2 HD11 ILE 2 5.652 6.164 -3.713 13 HD12 ILE 2 HD12 ILE 2 3.993 5.625 -3.503 14 HD13 ILE 2 HD13 ILE 2 5.241 5.150 -2.319 15 H ASP 3 H ASP 3 2.746 5.005 -4.581 16 HA ASP 3 HA ASP 3 0.997 3.670 -6.514 17 HB2 ASP 3 HB2 ASP 3 0.455 6.314 -5.230 18 HB3 ASP 3 HB3 ASP 3 -0.538 5.458 -6.364 19 H ALA 4 H ALA 4 1.956 4.088 -8.371 20 HA ALA 4 HA ALA 4 4.243 5.718 -8.741 21 HB1 ALA 4 HB1 ALA 4 3.673 3.891 -10.253 22 HB2 ALA 4 HB2 ALA 4 2.169 4.711 -10.722 23 HB3 ALA 4 HB3 ALA 4 3.733 5.420 -11.171 24 H ALA 5 H ALA 5 0.794 6.448 -9.357 25 HA ALA 5 HA ALA 5 1.145 8.972 -10.585 26 HB1 ALA 5 HB1 ALA 5 -0.983 7.660 -10.531 27 HB2 ALA 5 HB2 ALA 5 -1.133 8.014 -8.795 28 HB3 ALA 5 HB3 ALA 5 -1.194 9.339 -9.971 29 H GLN 6 H GLN 6 1.046 8.049 -7.156 30 HA GLN 6 HA GLN 6 0.741 10.716 -6.095 31 HB2 GLN 6 HB2 GLN 6 1.790 8.082 -4.945 32 HB3 GLN 6 HB3 GLN 6 1.733 9.525 -3.986 33 HG2 GLN 6 HG2 GLN 6 -0.700 8.258 -5.334 34 HG3 GLN 6 HG3 GLN 6 -0.220 8.018 -3.653 35 HE21 GLN 6 HE21 GLN 6 -1.548 10.417 -5.979 36 HE22 GLN 6 HE22 GLN 6 -2.103 11.500 -4.738 37 H ILE 7 H ILE 7 3.515 8.645 -6.942 38 HA ILE 7 HA ILE 7 5.504 10.415 -5.953 39 HB ILE 7 HB ILE 7 5.705 8.270 -8.074 40 HG12 ILE 7 HG12 ILE 7 6.417 7.800 -5.176 41 HG13 ILE 7 HG13 ILE 7 4.771 7.548 -5.690 42 HG21 ILE 7 HG21 ILE 7 7.719 9.559 -8.011 43 HG22 ILE 7 HG22 ILE 7 7.748 9.601 -6.241 44 HG23 ILE 7 HG23 ILE 7 8.087 8.095 -7.116 45 HD11 ILE 7 HD11 ILE 7 6.638 6.267 -7.564 46 HD12 ILE 7 HD12 ILE 7 6.784 5.651 -5.897 47 HD13 ILE 7 HD13 ILE 7 5.228 5.629 -6.756 48 H VAL 8 H VAL 8 3.911 10.048 -9.171 49 HA VAL 8 HA VAL 8 5.691 11.836 -10.551 50 HB VAL 8 HB VAL 8 2.817 10.974 -11.142 51 HG11 VAL 8 HG11 VAL 8 3.255 13.136 -12.307 52 HG12 VAL 8 HG12 VAL 8 4.767 12.476 -12.960 53 HG13 VAL 8 HG13 VAL 8 3.207 11.798 -13.448 54 HG21 VAL 8 HG21 VAL 8 4.571 9.186 -11.207 55 HG22 VAL 8 HG22 VAL 8 3.913 9.542 -12.805 56 HG23 VAL 8 HG23 VAL 8 5.508 10.161 -12.366 57 H ASP 9 H ASP 9 2.650 12.345 -8.773 58 HA ASP 9 HA ASP 9 2.300 15.063 -9.463 59 HB2 ASP 9 HB2 ASP 9 0.680 13.353 -8.356 60 HB3 ASP 9 HB3 ASP 9 1.346 13.904 -6.827 61 H GLU 10 H GLU 10 3.762 13.698 -6.444 62 HA GLU 10 HA GLU 10 4.503 16.181 -5.338 63 HB2 GLU 10 HB2 GLU 10 6.165 14.903 -4.002 64 HB3 GLU 10 HB3 GLU 10 4.576 14.150 -3.989 65 HG2 GLU 10 HG2 GLU 10 5.264 12.582 -5.729 66 HG3 GLU 10 HG3 GLU 10 6.889 13.265 -5.735 67 H ALA 11 H ALA 11 6.270 14.104 -7.702 68 HA ALA 11 HA ALA 11 8.642 15.717 -7.524 69 HB1 ALA 11 HB1 ALA 11 7.494 13.941 -9.771 70 HB2 ALA 11 HB2 ALA 11 9.059 14.693 -9.926 71 HB3 ALA 11 HB3 ALA 11 8.799 13.554 -8.606 72 H LEU 12 H LEU 12 5.691 16.008 -9.560 73 HA LEU 12 HA LEU 12 6.691 18.206 -11.100 74 HB2 LEU 12 HB2 LEU 12 3.844 17.428 -10.359 75 HB3 LEU 12 HB3 LEU 12 4.210 18.726 -11.480 76 HG LEU 12 HG LEU 12 5.209 15.911 -11.894 77 HD11 LEU 12 HD11 LEU 12 2.705 17.130 -13.077 78 HD12 LEU 12 HD12 LEU 12 2.785 15.833 -11.856 79 HD13 LEU 12 HD13 LEU 12 3.401 15.552 -13.484 80 HD21 LEU 12 HD21 LEU 12 5.503 16.619 -14.248 81 HD22 LEU 12 HD22 LEU 12 6.468 17.614 -13.164 82 HD23 LEU 12 HD23 LEU 12 4.937 18.240 -13.815 83 H GLU 13 H GLU 13 5.235 18.019 -7.862 84 HA GLU 13 HA GLU 13 4.859 20.860 -7.498 85 HB2 GLU 13 HB2 GLU 13 5.128 18.471 -5.635 86 HB3 GLU 13 HB3 GLU 13 5.188 20.085 -4.971 87 HG2 GLU 13 HG2 GLU 13 2.944 19.026 -6.717 88 HG3 GLU 13 HG3 GLU 13 2.961 18.994 -4.957 89 H GLN 14 H GLN 14 7.586 18.714 -7.301 90 HA GLN 14 HA GLN 14 9.435 20.728 -6.257 91 HB2 GLN 14 HB2 GLN 14 9.479 17.690 -6.623 92 HB3 GLN 14 HB3 GLN 14 10.928 18.639 -6.235 93 HG2 GLN 14 HG2 GLN 14 10.348 18.497 -4.095 94 HG3 GLN 14 HG3 GLN 14 9.097 19.669 -4.517 95 HE21 GLN 14 HE21 GLN 14 9.493 16.094 -4.127 96 HE22 GLN 14 HE22 GLN 14 7.854 15.949 -3.529 97 H GLY 15 H GLY 15 8.123 20.460 -9.017 98 HA2 GLY 15 HA2 GLY 15 8.552 21.268 -11.102 99 HA3 GLY 15 HA3 GLY 15 10.115 21.827 -10.516 100 H ILE 16 H ILE 16 9.447 18.434 -10.202 101 HA ILE 16 HA ILE 16 11.321 17.869 -12.406 102 HB ILE 16 HB ILE 16 10.516 16.179 -10.060 103 HG12 ILE 16 HG12 ILE 16 13.372 16.917 -10.172 104 HG13 ILE 16 HG13 ILE 16 12.337 18.332 -10.052 105 HG21 ILE 16 HG21 ILE 16 12.459 14.731 -10.794 106 HG22 ILE 16 HG22 ILE 16 11.182 14.802 -11.992 107 HG23 ILE 16 HG23 ILE 16 12.648 15.769 -12.218 108 HD11 ILE 16 HD11 ILE 16 12.939 17.429 -7.807 109 HD12 ILE 16 HD12 ILE 16 11.177 17.390 -8.125 110 HD13 ILE 16 HD13 ILE 16 12.164 15.920 -8.220 111 H THR 17 H THR 17 10.568 17.165 -14.140 112 HA THR 17 HA THR 17 7.861 16.084 -14.529 113 HB THR 17 HB THR 17 10.272 16.913 -16.185 114 HG1 THR 17 HG1 THR 17 7.736 18.136 -16.227 115 HG21 THR 17 HG21 THR 17 9.237 15.114 -17.360 116 HG22 THR 17 HG22 THR 17 8.951 16.657 -18.191 117 HG23 THR 17 HG23 THR 17 7.638 15.875 -17.227 118 H LEU 18 H LEU 18 7.562 13.839 -14.815 119 HA LEU 18 HA LEU 18 10.008 12.132 -15.041 120 HB2 LEU 18 HB2 LEU 18 7.183 11.582 -13.998 121 HB3 LEU 18 HB3 LEU 18 8.336 10.326 -14.417 122 HG LEU 18 HG LEU 18 8.178 12.005 -11.987 123 HD11 LEU 18 HD11 LEU 18 7.892 9.634 -11.876 124 HD12 LEU 18 HD12 LEU 18 9.449 9.957 -11.111 125 HD13 LEU 18 HD13 LEU 18 9.390 9.311 -12.760 126 HD21 LEU 18 HD21 LEU 18 10.560 12.059 -11.486 127 HD22 LEU 18 HD22 LEU 18 10.153 13.067 -12.892 128 HD23 LEU 18 HD23 LEU 18 10.900 11.479 -13.151 129 H PHE 19 H PHE 19 10.119 10.527 -16.645 130 HA PHE 19 HA PHE 19 7.928 10.097 -18.450 131 HB2 PHE 19 HB2 PHE 19 8.995 10.997 -20.459 132 HB3 PHE 19 HB3 PHE 19 8.518 12.230 -19.343 133 HD1 PHE 19 HD1 PHE 19 11.148 11.080 -21.413 134 HD2 PHE 19 HD2 PHE 19 10.364 13.268 -17.794 135 HE1 PHE 19 HE1 PHE 19 13.256 12.346 -21.706 136 HE2 PHE 19 HE2 PHE 19 12.466 14.498 -18.076 137 HZ PHE 19 HZ PHE 19 13.947 14.054 -19.996 138 H VAL 20 H VAL 20 8.822 8.711 -20.360 139 HA VAL 20 HA VAL 20 11.111 7.063 -19.454 140 HB VAL 20 HB VAL 20 8.347 6.109 -20.322 141 HG11 VAL 20 HG11 VAL 20 10.845 4.460 -19.683 142 HG12 VAL 20 HG12 VAL 20 9.222 3.830 -20.083 143 HG13 VAL 20 HG13 VAL 20 10.139 4.693 -21.304 144 HG21 VAL 20 HG21 VAL 20 8.586 6.740 -17.880 145 HG22 VAL 20 HG22 VAL 20 8.189 5.051 -18.166 146 HG23 VAL 20 HG23 VAL 20 9.854 5.524 -17.727 147 H VAL 21 H VAL 21 12.532 6.767 -21.082 148 HA VAL 21 HA VAL 21 11.649 7.224 -23.898 149 HB VAL 21 HB VAL 21 14.325 8.101 -22.714 150 HG11 VAL 21 HG11 VAL 21 14.304 7.528 -25.147 151 HG12 VAL 21 HG12 VAL 21 12.996 8.698 -25.403 152 HG13 VAL 21 HG13 VAL 21 14.603 9.247 -24.879 153 HG21 VAL 21 HG21 VAL 21 11.888 9.787 -23.276 154 HG22 VAL 21 HG22 VAL 21 12.767 9.576 -21.739 155 HG23 VAL 21 HG23 VAL 21 13.532 10.436 -23.085 156 H ASN 22 H ASN 22 12.217 5.437 -25.142 157 HA ASN 22 HA ASN 22 12.893 3.331 -25.614 158 HB2 ASN 22 HB2 ASN 22 15.515 4.180 -24.345 159 HB3 ASN 22 HB3 ASN 22 15.260 2.926 -25.580 160 HD21 ASN 22 HD21 ASN 22 16.533 5.900 -25.227 161 HD22 ASN 22 HD22 ASN 22 16.158 6.591 -26.778 162 H ASN 23 H ASN 23 11.574 3.592 -23.042 163 HA ASN 23 HA ASN 23 10.980 2.422 -21.282 164 HB2 ASN 23 HB2 ASN 23 11.277 0.494 -22.925 165 HB3 ASN 23 HB3 ASN 23 12.740 0.094 -22.015 166 HD21 ASN 23 HD21 ASN 23 9.299 0.959 -21.588 167 HD22 ASN 23 HD22 ASN 23 8.974 -0.150 -20.259 168 H ARG 24 H ARG 24 13.360 4.197 -21.141 169 HA ARG 24 HA ARG 24 14.598 3.184 -18.629 170 HB2 ARG 24 HB2 ARG 24 15.645 5.343 -20.510 171 HB3 ARG 24 HB3 ARG 24 16.459 4.676 -19.098 172 HG2 ARG 24 HG2 ARG 24 15.821 3.194 -21.692 173 HG3 ARG 24 HG3 ARG 24 17.391 3.792 -21.190 174 HD2 ARG 24 HD2 ARG 24 17.397 2.237 -19.245 175 HD3 ARG 24 HD3 ARG 24 15.789 1.671 -19.701 176 HE ARG 24 HE ARG 24 16.627 0.383 -21.350 177 HH11 ARG 24 HH11 ARG 24 19.257 2.585 -20.266 178 HH12 ARG 24 HH12 ARG 24 20.434 1.796 -21.285 179 HH21 ARG 24 HH21 ARG 24 18.216 -0.452 -22.784 180 HH22 ARG 24 HH22 ARG 24 19.781 0.303 -22.875 181 H LEU 25 H LEU 25 14.024 4.322 -16.822 182 HA LEU 25 HA LEU 25 11.996 6.389 -17.104 183 HB2 LEU 25 HB2 LEU 25 12.228 4.521 -15.335 184 HB3 LEU 25 HB3 LEU 25 13.456 5.509 -14.587 185 HG LEU 25 HG LEU 25 10.517 6.193 -15.022 186 HD11 LEU 25 HD11 LEU 25 11.104 4.594 -13.204 187 HD12 LEU 25 HD12 LEU 25 10.424 6.094 -12.629 188 HD13 LEU 25 HD13 LEU 25 12.168 5.831 -12.476 189 HD21 LEU 25 HD21 LEU 25 12.766 7.941 -13.951 190 HD22 LEU 25 HD22 LEU 25 11.078 8.173 -13.479 191 HD23 LEU 25 HD23 LEU 25 11.522 8.331 -15.170 192 H GLN 26 H GLN 26 12.498 8.493 -17.490 193 HA GLN 26 HA GLN 26 15.134 9.583 -16.626 194 HB2 GLN 26 HB2 GLN 26 13.445 10.114 -19.106 195 HB3 GLN 26 HB3 GLN 26 14.887 11.033 -18.677 196 HG2 GLN 26 HG2 GLN 26 14.929 8.015 -19.172 197 HG3 GLN 26 HG3 GLN 26 15.183 9.201 -20.426 198 HE21 GLN 26 HE21 GLN 26 17.077 10.588 -20.320 199 HE22 GLN 26 HE22 GLN 26 18.494 10.088 -19.407 200 H TYR 27 H TYR 27 14.993 12.090 -16.447 201 HA TYR 27 HA TYR 27 12.376 13.106 -15.812 202 HB2 TYR 27 HB2 TYR 27 12.873 13.739 -13.517 203 HB3 TYR 27 HB3 TYR 27 12.854 12.008 -13.729 204 HD1 TYR 27 HD1 TYR 27 14.788 10.652 -13.312 205 HD2 TYR 27 HD2 TYR 27 15.024 14.949 -13.065 206 HE1 TYR 27 HE1 TYR 27 16.933 10.475 -11.980 207 HE2 TYR 27 HE2 TYR 27 17.133 14.769 -11.793 208 HH TYR 27 HH TYR 27 18.720 13.347 -10.855 209 H GLU 28 H GLU 28 12.390 15.399 -15.412 210 HA GLU 28 HA GLU 28 14.896 16.805 -16.131 211 HB2 GLU 28 HB2 GLU 28 13.901 16.443 -18.218 212 HB3 GLU 28 HB3 GLU 28 12.280 16.904 -17.660 213 HG2 GLU 28 HG2 GLU 28 12.794 19.151 -17.509 214 HG3 GLU 28 HG3 GLU 28 14.552 18.882 -17.428 215 H THR 29 H THR 29 15.093 18.761 -15.140 216 HA THR 29 HA THR 29 12.947 20.275 -13.965 217 HB THR 29 HB THR 29 13.310 18.567 -12.216 218 HG1 THR 29 HG1 THR 29 13.870 19.940 -10.504 219 HG21 THR 29 HG21 THR 29 16.226 19.325 -12.482 220 HG22 THR 29 HG22 THR 29 15.448 17.723 -12.417 221 HG23 THR 29 HG23 THR 29 15.568 18.743 -10.961 222 H SER 30 H SER 30 14.359 22.210 -12.731 223 HA SER 30 HA SER 30 16.925 22.674 -14.053 224 HB2 SER 30 HB2 SER 30 14.919 23.421 -15.603 225 HB3 SER 30 HB3 SER 30 14.793 24.784 -14.489 226 HG SER 30 HG SER 30 16.672 24.112 -16.375 227 H ARG 31 H ARG 31 17.107 22.216 -11.631 228 HA ARG 31 HA ARG 31 17.621 24.696 -10.264 229 HB2 ARG 31 HB2 ARG 31 16.156 24.118 -8.264 230 HB3 ARG 31 HB3 ARG 31 15.306 24.686 -9.696 231 HG2 ARG 31 HG2 ARG 31 14.818 22.287 -10.278 232 HG3 ARG 31 HG3 ARG 31 15.544 21.809 -8.748 233 HD2 ARG 31 HD2 ARG 31 13.081 21.935 -8.595 234 HD3 ARG 31 HD3 ARG 31 13.835 23.125 -7.535 235 HE ARG 31 HE ARG 31 12.632 24.682 -8.605 236 HH11 ARG 31 HH11 ARG 31 12.885 21.995 -11.017 237 HH12 ARG 31 HH12 ARG 31 12.011 22.918 -12.200 238 HH21 ARG 31 HH21 ARG 31 11.251 25.610 -10.068 239 HH22 ARG 31 HH22 ARG 31 10.765 24.763 -11.501 240 H ASP 32 H ASP 32 18.694 24.318 -8.209 241 HA ASP 32 HA ASP 32 20.289 21.839 -8.241 242 HB2 ASP 32 HB2 ASP 32 20.580 24.642 -7.164 243 HB3 ASP 32 HB3 ASP 32 21.363 23.332 -6.279 244 H SER 33 H SER 33 20.839 20.909 -6.090 245 HA SER 33 HA SER 33 20.307 19.727 -4.260 246 HB2 SER 33 HB2 SER 33 18.614 22.129 -3.515 247 HB3 SER 33 HB3 SER 33 19.147 20.840 -2.429 248 HG SER 33 HG SER 33 20.394 22.764 -2.372 249 H ILE 34 H ILE 34 19.157 18.207 -5.832 250 HA ILE 34 HA ILE 34 16.266 18.416 -5.778 251 HB ILE 34 HB ILE 34 18.242 16.880 -7.238 252 HG12 ILE 34 HG12 ILE 34 15.253 16.884 -7.712 253 HG13 ILE 34 HG13 ILE 34 16.215 18.348 -7.943 254 HG21 ILE 34 HG21 ILE 34 17.717 14.934 -5.791 255 HG22 ILE 34 HG22 ILE 34 15.980 15.104 -6.156 256 HG23 ILE 34 HG23 ILE 34 17.142 14.677 -7.433 257 HD11 ILE 34 HD11 ILE 34 17.436 17.446 -9.697 258 HD12 ILE 34 HD12 ILE 34 16.939 15.764 -9.335 259 HD13 ILE 34 HD13 ILE 34 15.741 16.899 -9.946 260 HA PRO 35 HA PRO 35 15.603 16.424 -1.902 261 HB2 PRO 35 HB2 PRO 35 13.234 15.062 -2.417 262 HB3 PRO 35 HB3 PRO 35 13.356 16.806 -2.069 263 HG2 PRO 35 HG2 PRO 35 13.105 15.405 -4.739 264 HG3 PRO 35 HG3 PRO 35 12.298 16.902 -4.196 265 HD2 PRO 35 HD2 PRO 35 14.486 16.825 -5.794 266 HD3 PRO 35 HD3 PRO 35 14.236 18.152 -4.636 267 H THR 36 H THR 36 17.176 14.871 -1.586 268 HA THR 36 HA THR 36 17.757 12.630 -3.181 269 HB THR 36 HB THR 36 18.184 12.930 -0.169 270 HG1 THR 36 HG1 THR 36 19.079 14.706 -0.886 271 HG21 THR 36 HG21 THR 36 18.870 10.731 -0.983 272 HG22 THR 36 HG22 THR 36 20.295 11.711 -0.615 273 HG23 THR 36 HG23 THR 36 19.801 11.472 -2.310 274 H GLU 37 H GLU 37 15.331 13.057 -0.688 275 HA GLU 37 HA GLU 37 14.601 10.350 -0.201 276 HB2 GLU 37 HB2 GLU 37 12.528 11.383 0.712 277 HB3 GLU 37 HB3 GLU 37 14.017 12.107 1.301 278 HG2 GLU 37 HG2 GLU 37 13.633 13.930 -0.537 279 HG3 GLU 37 HG3 GLU 37 11.980 13.307 -0.598 280 H LEU 38 H LEU 38 13.083 12.794 -2.375 281 HA LEU 38 HA LEU 38 11.261 10.991 -3.617 282 HB2 LEU 38 HB2 LEU 38 12.048 13.756 -3.903 283 HB3 LEU 38 HB3 LEU 38 12.085 13.023 -5.493 284 HG LEU 38 HG LEU 38 9.683 12.157 -4.964 285 HD11 LEU 38 HD11 LEU 38 8.509 13.646 -3.323 286 HD12 LEU 38 HD12 LEU 38 10.077 14.247 -2.762 287 HD13 LEU 38 HD13 LEU 38 9.650 12.516 -2.579 288 HD21 LEU 38 HD21 LEU 38 8.768 14.448 -5.528 289 HD22 LEU 38 HD22 LEU 38 9.996 13.811 -6.590 290 HD23 LEU 38 HD23 LEU 38 10.443 15.066 -5.415 291 H LEU 39 H LEU 39 14.547 12.102 -4.535 292 HA LEU 39 HA LEU 39 14.795 10.781 -6.992 293 HB2 LEU 39 HB2 LEU 39 16.342 12.437 -6.176 294 HB3 LEU 39 HB3 LEU 39 16.854 11.415 -4.855 295 HG LEU 39 HG LEU 39 18.427 11.701 -6.753 296 HD11 LEU 39 HD11 LEU 39 18.623 9.841 -5.117 297 HD12 LEU 39 HD12 LEU 39 19.332 9.503 -6.709 298 HD13 LEU 39 HD13 LEU 39 17.787 8.775 -6.286 299 HD21 LEU 39 HD21 LEU 39 18.228 10.391 -8.784 300 HD22 LEU 39 HD22 LEU 39 16.904 11.542 -8.645 301 HD23 LEU 39 HD23 LEU 39 16.620 9.814 -8.301 302 H ASN 40 H ASN 40 15.548 9.634 -3.727 303 HA ASN 40 HA ASN 40 16.282 6.954 -4.445 304 HB2 ASN 40 HB2 ASN 40 15.532 8.279 -1.837 305 HB3 ASN 40 HB3 ASN 40 15.438 6.535 -1.952 306 HD21 ASN 40 HD21 ASN 40 17.704 9.232 -2.422 307 HD22 ASN 40 HD22 ASN 40 19.167 8.234 -2.257 308 H LYS 41 H LYS 41 13.109 8.439 -3.648 309 HA LYS 41 HA LYS 41 11.702 5.957 -3.517 310 HB2 LYS 41 HB2 LYS 41 10.860 8.142 -2.646 311 HB3 LYS 41 HB3 LYS 41 10.576 8.706 -4.287 312 HG2 LYS 41 HG2 LYS 41 8.797 7.217 -4.648 313 HG3 LYS 41 HG3 LYS 41 9.390 6.053 -3.474 314 HD2 LYS 41 HD2 LYS 41 7.391 7.057 -2.601 315 HD3 LYS 41 HD3 LYS 41 8.770 7.549 -1.601 316 HE2 LYS 41 HE2 LYS 41 8.848 9.710 -2.846 317 HE3 LYS 41 HE3 LYS 41 7.500 9.186 -3.838 318 HZ1 LYS 41 HZ1 LYS 41 6.091 9.244 -1.856 319 HZ2 LYS 41 HZ2 LYS 41 6.799 10.654 -2.170 320 HZ3 LYS 41 HZ3 LYS 41 7.367 9.732 -0.927 321 H TRP 42 H TRP 42 12.337 8.198 -6.266 322 HA TRP 42 HA TRP 42 10.944 6.820 -8.206 323 HB2 TRP 42 HB2 TRP 42 13.599 8.159 -8.729 324 HB3 TRP 42 HB3 TRP 42 12.228 7.905 -9.863 325 HD1 TRP 42 HD1 TRP 42 10.035 9.093 -7.713 326 HE1 TRP 42 HE1 TRP 42 9.802 11.599 -7.632 327 HE3 TRP 42 HE3 TRP 42 14.591 10.335 -9.664 328 HZ2 TRP 42 HZ2 TRP 42 11.562 13.907 -8.024 329 HZ3 TRP 42 HZ3 TRP 42 15.310 12.722 -9.737 330 HH2 TRP 42 HH2 TRP 42 13.869 14.483 -8.827 331 H LYS 43 H LYS 43 14.421 6.301 -7.398 332 HA LYS 43 HA LYS 43 14.638 4.107 -9.274 333 HB2 LYS 43 HB2 LYS 43 16.740 3.523 -8.029 334 HB3 LYS 43 HB3 LYS 43 16.684 5.143 -8.705 335 HG2 LYS 43 HG2 LYS 43 16.358 6.161 -6.602 336 HG3 LYS 43 HG3 LYS 43 15.958 4.637 -5.807 337 HD2 LYS 43 HD2 LYS 43 18.720 5.127 -6.959 338 HD3 LYS 43 HD3 LYS 43 18.252 5.686 -5.335 339 HE2 LYS 43 HE2 LYS 43 17.490 3.372 -4.767 340 HE3 LYS 43 HE3 LYS 43 18.091 2.821 -6.339 341 HZ1 LYS 43 HZ1 LYS 43 19.740 3.943 -4.154 342 HZ2 LYS 43 HZ2 LYS 43 20.299 3.486 -5.655 343 HZ3 LYS 43 HZ3 LYS 43 19.655 2.384 -4.633 344 H GLN 44 H GLN 44 13.525 4.284 -5.930 345 HA GLN 44 HA GLN 44 13.751 1.537 -5.290 346 HB2 GLN 44 HB2 GLN 44 13.322 3.401 -3.661 347 HB3 GLN 44 HB3 GLN 44 11.692 3.554 -4.285 348 HG2 GLN 44 HG2 GLN 44 11.430 2.300 -2.353 349 HG3 GLN 44 HG3 GLN 44 11.278 1.152 -3.650 350 HE21 GLN 44 HE21 GLN 44 11.868 -0.567 -2.112 351 HE22 GLN 44 HE22 GLN 44 13.577 -0.876 -1.889 352 H HIS 45 H HIS 45 11.081 3.391 -6.828 353 HA HIS 45 HA HIS 45 9.773 0.793 -7.493 354 HB2 HIS 45 HB2 HIS 45 8.286 3.373 -7.012 355 HB3 HIS 45 HB3 HIS 45 7.670 1.755 -7.130 356 HD1 HIS 45 HD1 HIS 45 7.834 0.257 -4.997 357 HD2 HIS 45 HD2 HIS 45 9.281 4.169 -4.648 358 HE1 HIS 45 HE1 HIS 45 8.203 0.660 -2.471 359 H LYS 46 H LYS 46 11.737 1.606 -9.046 360 HA LYS 46 HA LYS 46 11.197 3.466 -11.112 361 HB2 LYS 46 HB2 LYS 46 13.413 2.289 -10.533 362 HB3 LYS 46 HB3 LYS 46 12.823 0.929 -11.478 363 HG2 LYS 46 HG2 LYS 46 12.486 2.642 -13.402 364 HG3 LYS 46 HG3 LYS 46 13.326 3.783 -12.358 365 HD2 LYS 46 HD2 LYS 46 15.021 3.098 -13.692 366 HD3 LYS 46 HD3 LYS 46 15.253 2.038 -12.321 367 HE2 LYS 46 HE2 LYS 46 13.792 1.278 -14.895 368 HE3 LYS 46 HE3 LYS 46 15.508 1.018 -14.631 369 HZ1 LYS 46 HZ1 LYS 46 15.016 -0.562 -12.933 370 HZ2 LYS 46 HZ2 LYS 46 14.195 -0.919 -14.288 371 HZ3 LYS 46 HZ3 LYS 46 13.404 -0.303 -12.984 372 H GLN 47 H GLN 47 10.588 -0.149 -11.248 373 HA GLN 47 HA GLN 47 9.401 0.064 -13.832 374 HB2 GLN 47 HB2 GLN 47 10.045 -2.048 -12.062 375 HB3 GLN 47 HB3 GLN 47 8.319 -2.172 -12.307 376 HG2 GLN 47 HG2 GLN 47 10.469 -2.028 -14.470 377 HG3 GLN 47 HG3 GLN 47 9.654 -3.500 -13.941 378 HE21 GLN 47 HE21 GLN 47 9.538 -0.996 -16.258 379 HE22 GLN 47 HE22 GLN 47 7.841 -1.213 -16.695 380 H GLU 48 H GLU 48 8.112 0.334 -10.600 381 HA GLU 48 HA GLU 48 5.334 0.221 -11.297 382 HB2 GLU 48 HB2 GLU 48 6.406 1.865 -8.982 383 HB3 GLU 48 HB3 GLU 48 4.816 1.121 -9.156 384 HG2 GLU 48 HG2 GLU 48 6.070 -1.157 -9.216 385 HG3 GLU 48 HG3 GLU 48 7.489 -0.251 -8.681 386 H LEU 49 H LEU 49 7.574 3.019 -10.980 387 HA LEU 49 HA LEU 49 5.732 5.033 -11.867 388 HB2 LEU 49 HB2 LEU 49 8.734 4.714 -11.883 389 HB3 LEU 49 HB3 LEU 49 7.996 6.101 -12.668 390 HG LEU 49 HG LEU 49 7.569 5.430 -9.731 391 HD11 LEU 49 HD11 LEU 49 9.469 7.323 -11.167 392 HD12 LEU 49 HD12 LEU 49 9.901 5.805 -10.330 393 HD13 LEU 49 HD13 LEU 49 9.263 7.231 -9.426 394 HD21 LEU 49 HD21 LEU 49 7.098 8.024 -9.833 395 HD22 LEU 49 HD22 LEU 49 5.811 6.903 -10.328 396 HD23 LEU 49 HD23 LEU 49 6.782 7.737 -11.546 397 H ILE 50 H ILE 50 8.195 3.119 -13.547 398 HA ILE 50 HA ILE 50 7.809 4.250 -16.121 399 HB ILE 50 HB ILE 50 8.584 1.379 -15.396 400 HG12 ILE 50 HG12 ILE 50 10.407 3.438 -16.664 401 HG13 ILE 50 HG13 ILE 50 10.155 3.452 -14.926 402 HG21 ILE 50 HG21 ILE 50 8.600 2.669 -18.166 403 HG22 ILE 50 HG22 ILE 50 9.383 1.122 -17.790 404 HG23 ILE 50 HG23 ILE 50 7.640 1.283 -17.660 405 HD11 ILE 50 HD11 ILE 50 11.025 1.213 -14.668 406 HD12 ILE 50 HD12 ILE 50 11.137 0.987 -16.430 407 HD13 ILE 50 HD13 ILE 50 12.173 2.172 -15.631 408 H ASP 51 H ASP 51 6.101 1.385 -14.794 409 HA ASP 51 HA ASP 51 4.435 0.920 -17.017 410 HB2 ASP 51 HB2 ASP 51 4.647 -0.479 -14.925 411 HB3 ASP 51 HB3 ASP 51 3.650 0.714 -14.077 412 H PHE 52 H PHE 52 4.092 3.315 -14.416 413 HA PHE 52 HA PHE 52 1.500 4.217 -15.218 414 HB2 PHE 52 HB2 PHE 52 2.286 4.604 -12.998 415 HB3 PHE 52 HB3 PHE 52 3.612 5.618 -13.593 416 HD1 PHE 52 HD1 PHE 52 3.244 7.898 -14.371 417 HD2 PHE 52 HD2 PHE 52 -0.065 5.477 -13.024 418 HE1 PHE 52 HE1 PHE 52 1.838 9.928 -14.185 419 HE2 PHE 52 HE2 PHE 52 -1.479 7.502 -12.888 420 HZ PHE 52 HZ PHE 52 -0.490 9.760 -13.410 421 H LEU 53 H LEU 53 4.761 5.667 -15.781 422 HA LEU 53 HA LEU 53 3.797 7.795 -17.467 423 HB2 LEU 53 HB2 LEU 53 6.487 6.399 -17.255 424 HB3 LEU 53 HB3 LEU 53 6.215 7.710 -18.394 425 HG LEU 53 HG LEU 53 7.321 8.706 -16.647 426 HD11 LEU 53 HD11 LEU 53 5.397 10.015 -17.505 427 HD12 LEU 53 HD12 LEU 53 5.836 10.439 -15.851 428 HD13 LEU 53 HD13 LEU 53 4.408 9.439 -16.142 429 HD21 LEU 53 HD21 LEU 53 7.111 7.099 -14.882 430 HD22 LEU 53 HD22 LEU 53 5.403 7.513 -14.631 431 HD23 LEU 53 HD23 LEU 53 6.661 8.700 -14.284 432 H ASN 54 H ASN 54 4.499 4.416 -18.115 433 HA ASN 54 HA ASN 54 4.575 4.689 -21.001 434 HB2 ASN 54 HB2 ASN 54 5.362 2.740 -19.317 435 HB3 ASN 54 HB3 ASN 54 3.822 2.060 -19.739 436 HD21 ASN 54 HD21 ASN 54 6.904 1.801 -20.368 437 HD22 ASN 54 HD22 ASN 54 6.867 1.374 -22.082 438 H GLN 55 H GLN 55 2.044 3.350 -18.719 439 HA GLN 55 HA GLN 55 0.078 3.348 -20.741 440 HB2 GLN 55 HB2 GLN 55 -1.515 2.802 -19.002 441 HB3 GLN 55 HB3 GLN 55 0.018 1.947 -18.782 442 HG2 GLN 55 HG2 GLN 55 -0.458 2.499 -16.631 443 HG3 GLN 55 HG3 GLN 55 0.609 3.786 -17.099 444 HE21 GLN 55 HE21 GLN 55 -0.038 5.908 -16.786 445 HE22 GLN 55 HE22 GLN 55 -1.676 6.325 -16.284 446 H LEU 56 H LEU 56 1.206 6.024 -18.837 447 HA LEU 56 HA LEU 56 -1.104 7.670 -18.823 448 HB2 LEU 56 HB2 LEU 56 0.847 8.010 -17.367 449 HB3 LEU 56 HB3 LEU 56 1.881 8.268 -18.771 450 HG LEU 56 HG LEU 56 0.548 10.358 -19.268 451 HD11 LEU 56 HD11 LEU 56 -0.808 11.263 -17.411 452 HD12 LEU 56 HD12 LEU 56 -0.604 9.741 -16.496 453 HD13 LEU 56 HD13 LEU 56 -1.514 9.774 -18.029 454 HD21 LEU 56 HD21 LEU 56 1.926 10.171 -16.559 455 HD22 LEU 56 HD22 LEU 56 1.620 11.665 -17.479 456 HD23 LEU 56 HD23 LEU 56 2.710 10.443 -18.134 457 H ASP 57 H ASP 57 1.486 7.231 -21.220 458 HA ASP 57 HA ASP 57 0.068 9.168 -23.023 459 HB2 ASP 57 HB2 ASP 57 2.498 9.529 -21.828 460 HB3 ASP 57 HB3 ASP 57 3.011 8.736 -23.301 461 H SER 58 H SER 58 2.137 6.183 -22.949 462 HA SER 58 HA SER 58 1.698 5.694 -25.774 463 HB2 SER 58 HB2 SER 58 2.872 3.823 -23.690 464 HB3 SER 58 HB3 SER 58 3.112 3.804 -25.438 465 HG SER 58 HG SER 58 4.874 4.686 -24.468 466 H GLU 59 H GLU 59 0.111 4.773 -22.754 467 HA GLU 59 HA GLU 59 -1.312 3.165 -22.165 468 HB2 GLU 59 HB2 GLU 59 -2.361 5.313 -23.264 469 HB3 GLU 59 HB3 GLU 59 -2.985 4.144 -24.434 470 HG2 GLU 59 HG2 GLU 59 -3.732 2.769 -22.400 471 HG3 GLU 59 HG3 GLU 59 -3.365 4.180 -21.427 472 H GLU 60 H GLU 60 0.532 1.702 -23.421 473 HA GLU 60 HA GLU 60 -1.099 -0.475 -24.583 474 HB2 GLU 60 HB2 GLU 60 0.420 -0.846 -26.417 475 HB3 GLU 60 HB3 GLU 60 -0.192 0.796 -26.490 476 HG2 GLU 60 HG2 GLU 60 1.961 1.634 -25.512 477 HG3 GLU 60 HG3 GLU 60 2.555 -0.027 -25.442 478 H GLN 61 H GLN 61 0.755 0.298 -22.053 479 HA GLN 61 HA GLN 61 1.917 -2.390 -21.785 480 HB2 GLN 61 HB2 GLN 61 3.364 0.227 -21.258 481 HB3 GLN 61 HB3 GLN 61 3.886 -1.326 -20.637 482 HG2 GLN 61 HG2 GLN 61 3.834 -2.094 -23.144 483 HG3 GLN 61 HG3 GLN 61 3.860 -0.368 -23.503 484 HE21 GLN 61 HE21 GLN 61 5.566 -2.750 -21.357 485 HE22 GLN 61 HE22 GLN 61 7.186 -2.235 -21.793 486 H THR 62 H THR 62 0.785 -3.245 -20.205 487 HA THR 62 HA THR 62 0.611 -1.913 -17.592 488 HB THR 62 HB THR 62 -1.925 -2.949 -17.727 489 HG1 THR 62 HG1 THR 62 -1.615 -1.591 -20.182 490 HG21 THR 62 HG21 THR 62 -2.707 -0.620 -17.978 491 HG22 THR 62 HG22 THR 62 -1.031 -0.130 -18.333 492 HG23 THR 62 HG23 THR 62 -1.432 -0.854 -16.771 493 H LYS 63 H LYS 63 2.423 -3.798 -18.019 494 HA LYS 63 HA LYS 63 1.611 -5.963 -16.325 495 HB2 LYS 63 HB2 LYS 63 2.323 -7.793 -17.824 496 HB3 LYS 63 HB3 LYS 63 0.853 -7.005 -18.391 497 HG2 LYS 63 HG2 LYS 63 2.029 -5.817 -20.110 498 HG3 LYS 63 HG3 LYS 63 3.601 -6.366 -19.507 499 HD2 LYS 63 HD2 LYS 63 3.067 -8.681 -20.048 500 HD3 LYS 63 HD3 LYS 63 1.433 -8.203 -20.582 501 HE2 LYS 63 HE2 LYS 63 2.347 -6.847 -22.373 502 HE3 LYS 63 HE3 LYS 63 3.999 -7.058 -21.768 503 HZ1 LYS 63 HZ1 LYS 63 2.299 -9.136 -23.033 504 HZ2 LYS 63 HZ2 LYS 63 3.737 -9.437 -22.318 505 HZ3 LYS 63 HZ3 LYS 63 3.659 -8.443 -23.622
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