NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
548700 | 2lh9 | 17835 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY -2 H1 GLY -2 6.384 1.458 -2.297 2 H2 GLY -2 H2 GLY -2 7.896 0.845 -2.069 3 H3 GLY -2 H3 GLY -2 7.019 0.399 -3.380 4 HA2 GLY -2 HA2 GLY -2 7.026 -1.373 -1.769 5 HA3 GLY -2 HA3 GLY -2 6.369 -0.245 -0.572 6 H HIS -1 H HIS -1 5.236 -2.775 -1.556 7 HA HIS -1 HA HIS -1 2.516 -1.837 -1.968 8 HB2 HIS -1 HB2 HIS -1 3.642 -2.291 -4.310 9 HB3 HIS -1 HB3 HIS -1 3.499 -3.992 -3.868 10 HD2 HIS -1 HD2 HIS -1 1.473 -0.911 -4.919 11 HE1 HIS -1 HE1 HIS -1 -1.344 -4.098 -4.674 12 HE2 HIS -1 HE2 HIS -1 -0.989 -1.680 -5.408 13 H MET 34 H MET 1 1.127 -4.100 -1.968 14 HA MET 34 HA MET 1 1.737 -5.301 0.586 15 HB2 MET 34 HB2 MET 1 -0.264 -6.013 -1.610 16 HB3 MET 34 HB3 MET 1 -0.157 -6.842 -0.060 17 HG2 MET 34 HG2 MET 1 -1.725 -5.419 0.606 18 HG3 MET 34 HG3 MET 1 -0.395 -4.305 0.837 19 HE1 MET 34 HE1 MET 1 -3.626 -5.250 -1.058 20 HE2 MET 34 HE2 MET 1 -3.717 -4.105 -2.403 21 HE3 MET 34 HE3 MET 1 -2.578 -5.455 -2.483 22 H LEU 35 H LEU 2 2.315 -7.481 1.015 23 HA LEU 35 HA LEU 2 4.035 -8.861 -0.956 24 HB2 LEU 35 HB2 LEU 2 3.010 -9.715 1.798 25 HB3 LEU 35 HB3 LEU 2 4.202 -10.582 0.835 26 HG LEU 35 HG LEU 2 4.554 -7.799 2.037 27 HD11 LEU 35 HD11 LEU 2 5.837 -10.459 2.784 28 HD12 LEU 35 HD12 LEU 2 6.171 -8.877 3.520 29 HD13 LEU 35 HD13 LEU 2 4.574 -9.612 3.700 30 HD21 LEU 35 HD21 LEU 2 5.841 -7.910 -0.028 31 HD22 LEU 35 HD22 LEU 2 6.939 -8.032 1.347 32 HD23 LEU 35 HD23 LEU 2 6.515 -9.496 0.433 33 H GLU 36 H GLU 3 3.407 -11.219 -1.558 34 HA GLU 36 HA GLU 3 1.024 -11.095 -2.965 35 HB2 GLU 36 HB2 GLU 3 2.856 -12.616 -3.531 36 HB3 GLU 36 HB3 GLU 3 2.472 -13.622 -2.117 37 HG2 GLU 36 HG2 GLU 3 0.285 -14.192 -3.051 38 HG3 GLU 36 HG3 GLU 3 0.540 -13.087 -4.408 39 H ALA 37 H ALA 4 1.429 -12.963 0.050 40 HA ALA 37 HA ALA 4 -1.283 -13.807 -0.003 41 HB1 ALA 37 HB1 ALA 4 0.539 -13.611 2.429 42 HB2 ALA 37 HB2 ALA 4 -0.966 -14.554 2.308 43 HB3 ALA 37 HB3 ALA 4 0.428 -14.992 1.304 44 H ASP 38 H ASP 5 0.192 -10.856 1.304 45 HA ASP 38 HA ASP 5 -2.189 -10.061 2.787 46 HB2 ASP 38 HB2 ASP 5 0.130 -9.330 3.378 47 HB3 ASP 38 HB3 ASP 5 0.162 -8.358 1.897 48 H LEU 39 H LEU 6 -0.833 -9.453 -0.450 49 HA LEU 39 HA LEU 6 -2.561 -7.369 -1.289 50 HB2 LEU 39 HB2 LEU 6 -0.506 -8.031 -2.485 51 HB3 LEU 39 HB3 LEU 6 -1.186 -9.582 -2.898 52 HG LEU 39 HG LEU 6 -2.661 -7.107 -3.798 53 HD11 LEU 39 HD11 LEU 6 -0.293 -6.704 -4.378 54 HD12 LEU 39 HD12 LEU 6 -0.214 -8.276 -5.196 55 HD13 LEU 39 HD13 LEU 6 -1.270 -6.986 -5.826 56 HD21 LEU 39 HD21 LEU 6 -3.756 -9.222 -4.339 57 HD22 LEU 39 HD22 LEU 6 -3.150 -8.492 -5.806 58 HD23 LEU 39 HD23 LEU 6 -2.267 -9.848 -5.076 59 H VAL 40 H VAL 7 -2.718 -10.914 -1.801 60 HA VAL 40 HA VAL 7 -5.233 -10.759 -3.097 61 HB VAL 40 HB VAL 7 -5.266 -13.175 -2.976 62 HG11 VAL 40 HG11 VAL 7 -3.744 -11.962 -4.575 63 HG12 VAL 40 HG12 VAL 7 -2.404 -12.259 -3.469 64 HG13 VAL 40 HG13 VAL 7 -3.264 -13.616 -4.206 65 HG21 VAL 40 HG21 VAL 7 -4.578 -13.642 -0.695 66 HG22 VAL 40 HG22 VAL 7 -3.479 -14.454 -1.799 67 HG23 VAL 40 HG23 VAL 7 -2.980 -12.953 -1.018 68 H SER 41 H SER 8 -4.405 -11.289 0.368 69 HA SER 41 HA SER 8 -7.076 -11.711 1.231 70 HB2 SER 41 HB2 SER 8 -4.740 -10.504 2.777 71 HB3 SER 41 HB3 SER 8 -6.243 -11.129 3.474 72 HG SER 41 HG SER 8 -4.125 -12.522 2.236 73 H LYS 42 H LYS 9 -5.216 -8.543 1.163 74 HA LYS 42 HA LYS 9 -7.476 -7.053 2.184 75 HB2 LYS 42 HB2 LYS 9 -4.939 -6.269 0.685 76 HB3 LYS 42 HB3 LYS 9 -6.220 -5.095 1.022 77 HG2 LYS 42 HG2 LYS 9 -6.076 -5.617 3.454 78 HG3 LYS 42 HG3 LYS 9 -4.697 -6.695 3.111 79 HD2 LYS 42 HD2 LYS 9 -3.433 -4.777 2.157 80 HD3 LYS 42 HD3 LYS 9 -4.827 -3.724 2.396 81 HE2 LYS 42 HE2 LYS 9 -3.272 -3.251 4.128 82 HE3 LYS 42 HE3 LYS 9 -4.665 -4.054 4.862 83 HZ1 LYS 42 HZ1 LYS 9 -2.450 -4.861 5.643 84 HZ2 LYS 42 HZ2 LYS 9 -3.374 -6.067 5.047 85 HZ3 LYS 42 HZ3 LYS 9 -2.150 -5.483 4.149 86 H MET 43 H MET 10 -6.431 -7.804 -1.227 87 HA MET 43 HA MET 10 -8.508 -6.084 -2.270 88 HB2 MET 43 HB2 MET 10 -6.834 -8.253 -3.582 89 HB3 MET 43 HB3 MET 10 -8.009 -7.236 -4.440 90 HG2 MET 43 HG2 MET 10 -6.775 -5.208 -3.430 91 HG3 MET 43 HG3 MET 10 -5.479 -6.332 -3.029 92 HE1 MET 43 HE1 MET 10 -3.631 -4.972 -4.520 93 HE2 MET 43 HE2 MET 10 -4.047 -4.308 -6.110 94 HE3 MET 43 HE3 MET 10 -4.932 -3.758 -4.666 95 H LEU 44 H LEU 11 -8.365 -9.645 -1.666 96 HA LEU 44 HA LEU 11 -10.953 -10.369 -2.511 97 HB2 LEU 44 HB2 LEU 11 -9.418 -12.042 -1.696 98 HB3 LEU 44 HB3 LEU 11 -9.178 -11.197 -0.174 99 HG LEU 44 HG LEU 11 -11.449 -11.758 0.560 100 HD11 LEU 44 HD11 LEU 11 -12.677 -13.529 -0.693 101 HD12 LEU 44 HD12 LEU 11 -12.588 -11.991 -1.565 102 HD13 LEU 44 HD13 LEU 11 -11.520 -13.341 -2.040 103 HD21 LEU 44 HD21 LEU 11 -9.564 -13.158 1.213 104 HD22 LEU 44 HD22 LEU 11 -11.003 -14.160 0.945 105 HD23 LEU 44 HD23 LEU 11 -9.722 -14.101 -0.281 106 H ARG 45 H ARG 12 -9.915 -9.193 0.690 107 HA ARG 45 HA ARG 12 -12.425 -8.869 1.909 108 HB2 ARG 45 HB2 ARG 12 -10.499 -8.859 3.189 109 HB3 ARG 45 HB3 ARG 12 -9.667 -7.677 2.218 110 HG2 ARG 45 HG2 ARG 12 -12.120 -6.766 3.679 111 HG3 ARG 45 HG3 ARG 12 -10.636 -7.110 4.576 112 HD2 ARG 45 HD2 ARG 12 -9.454 -5.545 2.821 113 HD3 ARG 45 HD3 ARG 12 -11.108 -4.942 2.526 114 HE ARG 45 HE ARG 12 -10.377 -5.243 5.320 115 HH11 ARG 45 HH11 ARG 12 -9.964 -2.881 2.681 116 HH12 ARG 45 HH12 ARG 12 -9.992 -1.522 3.748 117 HH21 ARG 45 HH21 ARG 12 -10.537 -3.576 6.635 118 HH22 ARG 45 HH22 ARG 12 -10.239 -1.919 6.134 119 H ALA 46 H ALA 13 -10.641 -6.448 -0.114 120 HA ALA 46 HA ALA 13 -12.572 -4.467 0.405 121 HB1 ALA 46 HB1 ALA 13 -10.680 -4.728 -1.987 122 HB2 ALA 46 HB2 ALA 13 -11.486 -3.237 -1.477 123 HB3 ALA 46 HB3 ALA 13 -10.272 -3.986 -0.422 124 H VAL 47 H VAL 14 -12.365 -6.835 -2.312 125 HA VAL 47 HA VAL 14 -14.618 -5.830 -3.763 126 HB VAL 47 HB VAL 14 -13.466 -8.649 -3.490 127 HG11 VAL 47 HG11 VAL 14 -15.488 -7.639 -5.545 128 HG12 VAL 47 HG12 VAL 14 -14.683 -9.228 -5.540 129 HG13 VAL 47 HG13 VAL 14 -15.818 -8.812 -4.257 130 HG21 VAL 47 HG21 VAL 14 -12.545 -8.163 -5.760 131 HG22 VAL 47 HG22 VAL 14 -13.207 -6.518 -5.665 132 HG23 VAL 47 HG23 VAL 14 -11.925 -7.044 -4.555 133 H LEU 48 H LEU 15 -14.351 -8.221 -1.073 134 HA LEU 48 HA LEU 15 -17.140 -8.802 -0.960 135 HB2 LEU 48 HB2 LEU 15 -15.005 -8.888 1.231 136 HB3 LEU 48 HB3 LEU 15 -16.594 -9.622 1.352 137 HG LEU 48 HG LEU 15 -14.722 -10.434 -0.902 138 HD11 LEU 48 HD11 LEU 15 -14.079 -12.317 0.673 139 HD12 LEU 48 HD12 LEU 15 -13.451 -10.711 1.126 140 HD13 LEU 48 HD13 LEU 15 -14.839 -11.402 1.981 141 HD21 LEU 48 HD21 LEU 15 -16.026 -12.471 -0.846 142 HD22 LEU 48 HD22 LEU 15 -16.934 -11.894 0.567 143 HD23 LEU 48 HD23 LEU 15 -17.139 -11.086 -0.993 144 H GLN 49 H GLN 16 -15.213 -6.230 0.664 145 HA GLN 49 HA GLN 16 -17.316 -5.375 2.399 146 HB2 GLN 49 HB2 GLN 16 -14.795 -4.026 1.350 147 HB3 GLN 49 HB3 GLN 16 -15.946 -3.149 2.343 148 HG2 GLN 49 HG2 GLN 16 -14.570 -5.732 3.207 149 HG3 GLN 49 HG3 GLN 16 -14.029 -4.112 3.620 150 HE21 GLN 49 HE22 GLN 16 -14.400 -5.648 5.765 151 HE22 GLN 49 HE21 GLN 16 -15.920 -5.292 6.573 152 H SER 50 H SER 17 -16.458 -4.338 -0.975 153 HA SER 50 HA SER 17 -18.578 -2.406 -1.137 154 HB2 SER 50 HB2 SER 17 -17.235 -4.076 -3.317 155 HB3 SER 50 HB3 SER 17 -18.210 -2.621 -3.570 156 HG SER 50 HG SER 17 -15.963 -2.115 -3.535 157 H HIS 51 H HIS 18 -18.366 -5.893 -1.907 158 HA HIS 51 HA HIS 18 -21.087 -5.940 -2.949 159 HB2 HIS 51 HB2 HIS 18 -18.929 -8.062 -2.746 160 HB3 HIS 51 HB3 HIS 18 -20.500 -8.270 -3.523 161 HD2 HIS 51 HD2 HIS 18 -18.875 -8.867 -5.670 162 HE1 HIS 51 HE1 HIS 18 -18.139 -4.825 -6.745 163 HE2 HIS 51 HE2 HIS 18 -18.054 -7.218 -7.574 164 H LYS 52 H LYS 19 -21.806 -5.301 -0.556 165 HA LYS 52 HA LYS 19 -21.672 -7.229 1.517 166 HB2 LYS 52 HB2 LYS 19 -23.740 -5.032 0.985 167 HB3 LYS 52 HB3 LYS 19 -23.704 -5.994 2.457 168 HG2 LYS 52 HG2 LYS 19 -21.562 -4.065 1.520 169 HG3 LYS 52 HG3 LYS 19 -22.674 -3.892 2.884 170 HD2 LYS 52 HD2 LYS 19 -21.580 -6.128 3.754 171 HD3 LYS 52 HD3 LYS 19 -20.293 -5.764 2.614 172 HE2 LYS 52 HE2 LYS 19 -21.198 -4.124 5.019 173 HE3 LYS 52 HE3 LYS 19 -19.649 -4.938 4.790 174 HZ1 LYS 52 HZ1 LYS 19 -19.307 -3.321 2.872 175 HZ2 LYS 52 HZ2 LYS 19 -20.592 -2.477 3.445 176 HZ3 LYS 52 HZ3 LYS 19 -19.271 -2.674 4.386 177 H ASN 53 H ASN 20 -23.805 -7.271 -1.266 178 HA ASN 53 HA ASN 20 -25.747 -9.103 -0.224 179 HB2 ASN 53 HB2 ASN 20 -25.989 -7.809 -2.354 180 HB3 ASN 53 HB3 ASN 20 -24.690 -8.770 -3.073 181 HD21 ASN 53 HD22 ASN 20 -27.932 -9.184 -1.466 182 HD22 ASN 53 HD21 ASN 20 -28.397 -10.554 -2.437 183 H GLY 54 H GLY 21 -22.382 -9.567 -0.807 184 HA2 GLY 54 HA2 GLY 21 -21.085 -11.379 -0.502 185 HA3 GLY 54 HA3 GLY 21 -22.491 -12.451 -0.382 186 H ILE 55 H ILE 22 -20.350 -13.265 -1.837 187 HA ILE 55 HA ILE 22 -21.431 -13.381 -4.592 188 HB ILE 55 HB ILE 22 -18.907 -13.332 -5.299 189 HG12 ILE 55 HG12 ILE 22 -18.683 -11.854 -2.631 190 HG13 ILE 55 HG13 ILE 22 -17.692 -13.182 -3.236 191 HG21 ILE 55 HG21 ILE 22 -20.773 -11.666 -5.853 192 HG22 ILE 55 HG22 ILE 22 -20.110 -10.662 -4.552 193 HG23 ILE 55 HG23 ILE 22 -19.111 -11.111 -5.977 194 HD11 ILE 55 HD11 ILE 22 -16.448 -11.103 -3.325 195 HD12 ILE 55 HD12 ILE 22 -16.831 -11.551 -5.008 196 HD13 ILE 55 HD13 ILE 22 -17.742 -10.276 -4.175 197 H VAL 56 H VAL 23 -21.672 -15.364 -5.205 198 HA VAL 56 HA VAL 23 -21.010 -17.598 -3.560 199 HB VAL 56 HB VAL 23 -21.674 -18.907 -5.576 200 HG11 VAL 56 HG11 VAL 23 -23.579 -16.675 -4.751 201 HG12 VAL 56 HG12 VAL 23 -24.037 -18.153 -5.615 202 HG13 VAL 56 HG13 VAL 23 -23.366 -18.260 -3.989 203 HG21 VAL 56 HG21 VAL 23 -22.167 -16.210 -6.920 204 HG22 VAL 56 HG22 VAL 23 -20.870 -17.341 -7.334 205 HG23 VAL 56 HG23 VAL 23 -22.550 -17.814 -7.564 206 H LEU 57 H LEU 24 -19.280 -19.134 -3.770 207 HA LEU 57 HA LEU 24 -16.869 -18.165 -4.211 208 HB2 LEU 57 HB2 LEU 24 -15.817 -20.200 -4.114 209 HB3 LEU 57 HB3 LEU 24 -17.199 -20.213 -3.065 210 HG LEU 57 HG LEU 24 -17.079 -21.533 -5.825 211 HD11 LEU 57 HD11 LEU 24 -16.887 -23.656 -4.590 212 HD12 LEU 57 HD12 LEU 24 -15.522 -22.574 -4.307 213 HD13 LEU 57 HD13 LEU 24 -16.760 -22.749 -3.059 214 HD21 LEU 57 HD21 LEU 24 -19.129 -21.932 -3.598 215 HD22 LEU 57 HD22 LEU 24 -19.444 -21.041 -5.074 216 HD23 LEU 57 HD23 LEU 24 -19.095 -22.764 -5.163 217 HA PRO 58 HA PRO 25 -16.112 -19.115 -8.789 218 HB2 PRO 58 HB2 PRO 25 -18.119 -19.304 -10.619 219 HB3 PRO 58 HB3 PRO 25 -17.516 -20.713 -9.698 220 HG2 PRO 58 HG2 PRO 25 -19.960 -19.014 -9.101 221 HG3 PRO 58 HG3 PRO 25 -19.833 -20.801 -9.174 222 HD2 PRO 58 HD2 PRO 25 -19.680 -19.478 -6.802 223 HD3 PRO 58 HD3 PRO 25 -18.686 -20.915 -7.157 224 H ARG 59 H ARG 26 -19.043 -17.178 -8.039 225 HA ARG 59 HA ARG 26 -18.427 -14.991 -9.837 226 HB2 ARG 59 HB2 ARG 26 -20.686 -15.467 -8.847 227 HB3 ARG 59 HB3 ARG 26 -20.061 -14.994 -7.249 228 HG2 ARG 59 HG2 ARG 26 -19.634 -12.716 -8.095 229 HG3 ARG 59 HG3 ARG 26 -20.175 -13.211 -9.715 230 HD2 ARG 59 HD2 ARG 26 -22.435 -13.660 -8.835 231 HD3 ARG 59 HD3 ARG 26 -21.908 -13.187 -7.200 232 HE ARG 59 HE ARG 26 -21.289 -11.073 -8.994 233 HH11 ARG 59 HH21 ARG 26 -24.219 -12.606 -7.650 234 HH12 ARG 59 HH22 ARG 26 -25.150 -11.155 -7.684 235 HH21 ARG 59 HH11 ARG 26 -22.558 -9.154 -9.060 236 HH22 ARG 59 HH12 ARG 26 -24.199 -9.171 -8.526 237 H LEU 60 H LEU 27 -17.496 -15.903 -6.507 238 HA LEU 60 HA LEU 27 -16.227 -13.530 -5.807 239 HB2 LEU 60 HB2 LEU 27 -16.512 -15.324 -4.127 240 HB3 LEU 60 HB3 LEU 27 -15.377 -16.380 -4.943 241 HG LEU 60 HG LEU 27 -13.504 -14.922 -4.625 242 HD11 LEU 60 HD11 LEU 27 -13.480 -12.856 -3.439 243 HD12 LEU 60 HD12 LEU 27 -14.616 -12.618 -4.726 244 HD13 LEU 60 HD13 LEU 27 -15.209 -12.942 -3.073 245 HD21 LEU 60 HD21 LEU 27 -13.320 -15.016 -2.271 246 HD22 LEU 60 HD22 LEU 27 -15.080 -15.086 -2.039 247 HD23 LEU 60 HD23 LEU 27 -14.229 -16.433 -2.836 248 H GLN 61 H GLN 28 -14.772 -16.483 -7.369 249 HA GLN 61 HA GLN 28 -12.214 -15.521 -7.926 250 HB2 GLN 61 HB2 GLN 28 -14.058 -17.496 -9.221 251 HB3 GLN 61 HB3 GLN 28 -12.699 -16.957 -10.187 252 HG2 GLN 61 HG2 GLN 28 -12.185 -17.949 -7.358 253 HG3 GLN 61 HG3 GLN 28 -12.516 -19.093 -8.648 254 HE21 GLN 61 HE22 GLN 28 -10.576 -19.923 -9.532 255 HE22 GLN 61 HE21 GLN 28 -9.145 -18.959 -9.783 256 H GLY 62 H GLY 29 -15.163 -14.981 -9.945 257 HA2 GLY 62 HA2 GLY 29 -13.938 -13.517 -12.004 258 HA3 GLY 62 HA3 GLY 29 -15.624 -13.353 -11.496 259 H GLU 63 H GLU 30 -15.731 -12.110 -9.158 260 HA GLU 63 HA GLU 30 -15.044 -9.433 -9.903 261 HB2 GLU 63 HB2 GLU 30 -16.021 -10.584 -7.253 262 HB3 GLU 63 HB3 GLU 30 -15.952 -8.858 -7.637 263 HG2 GLU 63 HG2 GLU 30 -17.639 -10.897 -9.133 264 HG3 GLU 63 HG3 GLU 30 -18.216 -9.807 -7.891 265 H TYR 64 H TYR 31 -13.570 -11.725 -7.631 266 HA TYR 64 HA TYR 31 -11.620 -10.084 -6.399 267 HB2 TYR 64 HB2 TYR 31 -12.012 -12.317 -5.616 268 HB3 TYR 64 HB3 TYR 31 -11.697 -13.001 -7.209 269 HD1 TYR 64 HD2 TYR 31 -9.495 -13.321 -8.109 270 HD2 TYR 64 HD1 TYR 31 -10.102 -11.656 -4.173 271 HE1 TYR 64 HE2 TYR 31 -7.121 -13.667 -7.593 272 HE2 TYR 64 HE1 TYR 31 -7.699 -12.053 -3.645 273 HH TYR 64 HH TYR 31 -5.431 -13.425 -6.116 274 H ARG 65 H ARG 32 -11.405 -12.054 -9.450 275 HA ARG 65 HA ARG 32 -8.807 -11.081 -10.030 276 HB2 ARG 65 HB2 ARG 32 -9.853 -13.202 -10.827 277 HB3 ARG 65 HB3 ARG 32 -10.823 -12.288 -11.976 278 HG2 ARG 65 HG2 ARG 32 -7.898 -11.723 -12.149 279 HG3 ARG 65 HG3 ARG 32 -8.295 -13.408 -12.372 280 HD2 ARG 65 HD2 ARG 32 -8.309 -12.600 -14.535 281 HD3 ARG 65 HD3 ARG 32 -10.035 -12.632 -14.121 282 HE ARG 65 HE ARG 32 -9.030 -10.138 -13.392 283 HH11 ARG 65 HH11 ARG 32 -9.704 -11.926 -16.402 284 HH12 ARG 65 HH12 ARG 32 -9.886 -10.510 -17.373 285 HH21 ARG 65 HH21 ARG 32 -9.220 -8.243 -14.703 286 HH22 ARG 65 HH22 ARG 32 -9.643 -8.360 -16.369 287 H SER 66 H SER 33 -12.018 -9.683 -10.793 288 HA SER 66 HA SER 33 -11.063 -7.803 -12.699 289 HB2 SER 66 HB2 SER 33 -13.246 -7.393 -10.629 290 HB3 SER 66 HB3 SER 33 -12.988 -6.455 -12.109 291 HG SER 66 HG SER 33 -14.568 -8.033 -12.497 292 H LEU 67 H LEU 34 -11.023 -7.736 -9.062 293 HA LEU 67 HA LEU 34 -9.802 -5.084 -9.128 294 HB2 LEU 67 HB2 LEU 34 -11.250 -5.766 -7.267 295 HB3 LEU 67 HB3 LEU 34 -10.075 -7.002 -6.790 296 HG LEU 67 HG LEU 34 -8.393 -5.254 -6.321 297 HD11 LEU 67 HD11 LEU 34 -8.986 -3.482 -7.900 298 HD12 LEU 67 HD12 LEU 34 -10.564 -3.261 -7.117 299 HD13 LEU 67 HD13 LEU 34 -9.065 -2.842 -6.263 300 HD21 LEU 67 HD21 LEU 34 -9.947 -5.925 -4.523 301 HD22 LEU 67 HD22 LEU 34 -9.445 -4.234 -4.361 302 HD23 LEU 67 HD23 LEU 34 -11.061 -4.621 -4.991 303 H THR 68 H THR 35 -8.467 -8.416 -8.332 304 HA THR 68 HA THR 35 -5.871 -7.297 -7.715 305 HB THR 68 HB THR 35 -5.249 -9.788 -7.765 306 HG1 THR 68 HG1 THR 35 -7.118 -11.184 -7.918 307 HG21 THR 68 HG21 THR 35 -7.636 -9.046 -6.023 308 HG22 THR 68 HG22 THR 35 -6.449 -10.335 -5.717 309 HG23 THR 68 HG23 THR 35 -5.919 -8.667 -5.679 310 H GLY 69 H GLY 36 -7.337 -8.710 -10.643 311 HA2 GLY 69 HA2 GLY 36 -6.477 -8.933 -12.777 312 HA3 GLY 69 HA3 GLY 36 -4.984 -8.114 -12.276 313 H ASP 70 H ASP 37 -6.205 -10.822 -10.297 314 HA ASP 70 HA ASP 37 -4.507 -12.803 -11.653 315 HB2 ASP 70 HB2 ASP 37 -3.170 -11.687 -9.744 316 HB3 ASP 70 HB3 ASP 37 -4.359 -12.379 -8.624 317 H TRP 71 H TRP 38 -5.113 -15.024 -10.817 318 HA TRP 71 HA TRP 38 -7.969 -15.130 -9.994 319 HB2 TRP 71 HB2 TRP 38 -6.073 -17.330 -10.907 320 HB3 TRP 71 HB3 TRP 38 -7.776 -17.528 -10.507 321 HD1 TRP 71 HD1 TRP 38 -5.579 -16.917 -13.370 322 HE1 TRP 71 HE1 TRP 38 -6.867 -16.192 -15.457 323 HE3 TRP 71 HE3 TRP 38 -10.080 -15.825 -11.194 324 HZ2 TRP 71 HZ2 TRP 38 -9.485 -15.070 -16.071 325 HZ3 TRP 71 HZ3 TRP 38 -11.927 -14.874 -12.541 326 HH2 TRP 71 HH2 TRP 38 -11.681 -14.598 -15.000 327 H ILE 72 H ILE 39 -8.490 -16.584 -8.213 328 HA ILE 72 HA ILE 39 -7.186 -15.930 -5.844 329 HB ILE 72 HB ILE 39 -9.046 -18.191 -6.605 330 HG12 ILE 72 HG12 ILE 39 -9.808 -15.714 -6.588 331 HG13 ILE 72 HG13 ILE 39 -10.809 -16.919 -5.805 332 HG21 ILE 72 HG21 ILE 39 -7.979 -17.600 -3.832 333 HG22 ILE 72 HG22 ILE 39 -9.450 -18.547 -4.135 334 HG23 ILE 72 HG23 ILE 39 -7.898 -19.108 -4.768 335 HD11 ILE 72 HD11 ILE 39 -10.193 -16.211 -3.634 336 HD12 ILE 72 HD12 ILE 39 -8.879 -15.159 -4.262 337 HD13 ILE 72 HD13 ILE 39 -10.592 -14.769 -4.562 338 HA PRO 73 HA PRO 40 -3.747 -18.753 -6.288 339 HB2 PRO 73 HB2 PRO 40 -2.163 -18.006 -4.264 340 HB3 PRO 73 HB3 PRO 40 -2.618 -16.835 -5.517 341 HG2 PRO 73 HG2 PRO 40 -4.014 -17.256 -2.847 342 HG3 PRO 73 HG3 PRO 40 -3.323 -15.741 -3.513 343 HD2 PRO 73 HD2 PRO 40 -5.962 -16.398 -3.815 344 HD3 PRO 73 HD3 PRO 40 -5.051 -15.547 -5.097 345 H PHE 74 H PHE 41 -6.099 -20.127 -5.303 346 HA PHE 74 HA PHE 41 -5.864 -20.942 -2.561 347 HB2 PHE 74 HB2 PHE 41 -7.635 -22.472 -2.957 348 HB3 PHE 74 HB3 PHE 41 -8.031 -20.982 -3.751 349 HD1 PHE 74 HD2 PHE 41 -7.698 -20.873 -6.366 350 HD2 PHE 74 HD1 PHE 41 -7.580 -24.525 -4.086 351 HE1 PHE 74 HE2 PHE 41 -8.166 -22.166 -8.420 352 HE2 PHE 74 HE1 PHE 41 -8.108 -25.817 -6.138 353 HZ PHE 74 HZ PHE 41 -8.387 -24.641 -8.317 354 H LYS 75 H LYS 42 -5.267 -22.872 -5.529 355 HA LYS 75 HA LYS 42 -4.080 -25.035 -4.057 356 HB2 LYS 75 HB2 LYS 42 -5.344 -25.018 -6.285 357 HB3 LYS 75 HB3 LYS 42 -3.880 -24.399 -7.038 358 HG2 LYS 75 HG2 LYS 42 -2.647 -26.443 -6.320 359 HG3 LYS 75 HG3 LYS 42 -4.096 -27.015 -5.452 360 HD2 LYS 75 HD2 LYS 42 -5.352 -27.141 -7.568 361 HD3 LYS 75 HD3 LYS 42 -3.939 -26.527 -8.463 362 HE2 LYS 75 HE2 LYS 42 -2.610 -28.493 -7.713 363 HE3 LYS 75 HE3 LYS 42 -4.014 -29.118 -6.837 364 HZ1 LYS 75 HZ1 LYS 42 -5.173 -29.320 -8.966 365 HZ2 LYS 75 HZ2 LYS 42 -3.871 -28.740 -9.781 366 HZ3 LYS 75 HZ3 LYS 42 -3.779 -30.166 -9.002 367 H GLN 76 H GLN 43 -2.902 -22.109 -5.497 368 HA GLN 76 HA GLN 43 -0.137 -22.778 -5.805 369 HB2 GLN 76 HB2 GLN 43 -1.474 -20.037 -5.561 370 HB3 GLN 76 HB3 GLN 43 0.118 -20.393 -6.211 371 HG2 GLN 76 HG2 GLN 43 -1.030 -20.152 -8.164 372 HG3 GLN 76 HG3 GLN 43 -1.205 -21.887 -7.969 373 HE21 GLN 76 HE22 GLN 43 -2.950 -19.466 -9.224 374 HE22 GLN 76 HE21 GLN 43 -4.540 -19.793 -8.544 375 H LEU 77 H LEU 44 -2.050 -21.126 -3.221 376 HA LEU 77 HA LEU 44 0.232 -20.930 -1.387 377 HB2 LEU 77 HB2 LEU 44 -2.731 -20.491 -1.039 378 HB3 LEU 77 HB3 LEU 44 -1.548 -20.328 0.260 379 HG LEU 77 HG LEU 44 -1.527 -18.692 -2.300 380 HD11 LEU 77 HD11 LEU 44 -2.351 -17.847 0.515 381 HD12 LEU 77 HD12 LEU 44 -2.339 -16.820 -0.937 382 HD13 LEU 77 HD13 LEU 44 -3.467 -18.181 -0.826 383 HD21 LEU 77 HD21 LEU 44 0.136 -18.399 0.235 384 HD22 LEU 77 HD22 LEU 44 0.732 -18.809 -1.398 385 HD23 LEU 77 HD23 LEU 44 0.067 -17.210 -1.085 386 H GLY 78 H GLY 45 -2.307 -23.308 -2.105 387 HA2 GLY 78 HA2 GLY 45 -1.537 -25.594 -1.783 388 HA3 GLY 78 HA3 GLY 45 -0.947 -25.159 -0.181 389 H TYR 79 H TYR 46 -4.002 -23.723 -0.996 390 HA TYR 79 HA TYR 46 -5.462 -25.415 0.914 391 HB2 TYR 79 HB2 TYR 46 -6.432 -23.142 -0.875 392 HB3 TYR 79 HB3 TYR 46 -7.287 -23.872 0.478 393 HD1 TYR 79 HD2 TYR 46 -6.303 -23.659 2.826 394 HD2 TYR 79 HD1 TYR 46 -4.872 -21.360 -0.530 395 HE1 TYR 79 HE2 TYR 46 -5.196 -22.117 4.372 396 HE2 TYR 79 HE1 TYR 46 -3.775 -19.778 1.000 397 HH TYR 79 HH TYR 46 -3.846 -20.184 4.585 398 HA PRO 80 HA PRO 47 -6.418 -28.026 -2.503 399 HB2 PRO 80 HB2 PRO 47 -8.671 -29.433 -1.675 400 HB3 PRO 80 HB3 PRO 47 -7.037 -29.679 -0.985 401 HG2 PRO 80 HG2 PRO 47 -9.250 -27.883 0.085 402 HG3 PRO 80 HG3 PRO 47 -8.311 -29.129 0.977 403 HD2 PRO 80 HD2 PRO 47 -7.546 -26.541 1.105 404 HD3 PRO 80 HD3 PRO 47 -6.309 -27.812 0.891 405 H THR 81 H THR 48 -9.068 -25.874 -1.396 406 HA THR 81 HA THR 48 -10.154 -25.799 -4.159 407 HB THR 81 HB THR 48 -12.415 -25.930 -2.951 408 HG1 THR 81 HG1 THR 48 -12.133 -27.025 -0.805 409 HG21 THR 81 HG21 THR 48 -10.758 -28.434 -2.472 410 HG22 THR 81 HG22 THR 48 -12.505 -28.305 -2.770 411 HG23 THR 81 HG23 THR 48 -11.363 -27.958 -4.076 412 H LEU 82 H LEU 49 -11.705 -23.971 -4.411 413 HA LEU 82 HA LEU 49 -10.708 -21.467 -3.408 414 HB2 LEU 82 HB2 LEU 49 -13.431 -22.232 -4.597 415 HB3 LEU 82 HB3 LEU 49 -13.021 -20.588 -4.167 416 HG LEU 82 HG LEU 49 -12.850 -20.857 -6.521 417 HD11 LEU 82 HD11 LEU 49 -11.230 -19.363 -5.464 418 HD12 LEU 82 HD12 LEU 49 -10.054 -20.701 -5.325 419 HD13 LEU 82 HD13 LEU 49 -10.537 -20.121 -6.918 420 HD21 LEU 82 HD21 LEU 49 -11.375 -22.340 -7.696 421 HD22 LEU 82 HD22 LEU 49 -10.703 -22.989 -6.201 422 HD23 LEU 82 HD23 LEU 49 -12.402 -23.313 -6.642 423 H GLU 83 H GLU 50 -13.441 -23.600 -2.346 424 HA GLU 83 HA GLU 50 -14.261 -21.838 -0.290 425 HB2 GLU 83 HB2 GLU 50 -15.498 -23.606 0.669 426 HB3 GLU 83 HB3 GLU 50 -15.604 -23.764 -1.083 427 HG2 GLU 83 HG2 GLU 50 -13.928 -25.589 -1.008 428 HG3 GLU 83 HG3 GLU 50 -13.835 -25.425 0.760 429 H ALA 84 H ALA 51 -11.745 -24.477 -0.155 430 HA ALA 84 HA ALA 51 -11.284 -24.204 2.627 431 HB1 ALA 84 HB1 ALA 51 -9.179 -25.364 2.180 432 HB2 ALA 84 HB2 ALA 51 -10.539 -26.129 1.346 433 HB3 ALA 84 HB3 ALA 51 -9.399 -25.116 0.429 434 H TYR 85 H TYR 52 -9.756 -22.496 -0.132 435 HA TYR 85 HA TYR 52 -7.896 -20.936 1.340 436 HB2 TYR 85 HB2 TYR 52 -7.763 -20.973 -1.016 437 HB3 TYR 85 HB3 TYR 52 -9.445 -20.511 -1.228 438 HD1 TYR 85 HD1 TYR 52 -6.137 -19.229 -0.007 439 HD2 TYR 85 HD2 TYR 52 -10.075 -18.247 -1.461 440 HE1 TYR 85 HE1 TYR 52 -5.459 -16.868 -0.190 441 HE2 TYR 85 HE2 TYR 52 -9.443 -15.879 -1.605 442 HH TYR 85 HH TYR 52 -7.677 -14.307 -1.441 443 H LEU 86 H LEU 53 -11.378 -20.230 0.541 444 HA LEU 86 HA LEU 53 -11.427 -17.823 2.056 445 HB2 LEU 86 HB2 LEU 53 -13.712 -19.635 1.194 446 HB3 LEU 86 HB3 LEU 53 -13.858 -17.931 1.655 447 HG LEU 86 HG LEU 53 -12.082 -18.790 -0.647 448 HD11 LEU 86 HD11 LEU 53 -14.938 -17.922 -0.941 449 HD12 LEU 86 HD12 LEU 53 -13.790 -18.458 -2.211 450 HD13 LEU 86 HD13 LEU 53 -14.391 -19.608 -1.031 451 HD21 LEU 86 HD21 LEU 53 -12.142 -16.566 -1.344 452 HD22 LEU 86 HD22 LEU 53 -13.347 -16.118 -0.086 453 HD23 LEU 86 HD23 LEU 53 -11.678 -16.553 0.337 454 H ARG 87 H ARG 54 -12.203 -21.152 3.023 455 HA ARG 87 HA ARG 54 -13.191 -20.616 5.688 456 HB2 ARG 87 HB2 ARG 54 -11.544 -22.949 4.595 457 HB3 ARG 87 HB3 ARG 54 -11.832 -22.769 6.298 458 HG2 ARG 87 HG2 ARG 54 -13.374 -24.337 5.635 459 HG3 ARG 87 HG3 ARG 54 -14.302 -22.859 5.916 460 HD2 ARG 87 HD2 ARG 54 -14.571 -22.528 3.506 461 HD3 ARG 87 HD3 ARG 54 -13.260 -23.670 3.209 462 HE ARG 87 HE ARG 54 -14.700 -25.258 2.902 463 HH11 ARG 87 HH11 ARG 54 -16.132 -23.462 5.659 464 HH12 ARG 87 HH12 ARG 54 -17.554 -24.431 5.680 465 HH21 ARG 87 HH21 ARG 54 -16.628 -26.346 2.828 466 HH22 ARG 87 HH22 ARG 54 -17.812 -26.184 4.101 467 H SER 88 H SER 55 -9.905 -20.619 4.349 468 HA SER 88 HA SER 55 -8.633 -20.529 6.920 469 HB2 SER 88 HB2 SER 55 -7.476 -20.252 4.135 470 HB3 SER 88 HB3 SER 55 -6.586 -20.545 5.639 471 HG SER 88 HG SER 55 -8.442 -22.241 4.309 472 H VAL 89 H VAL 56 -10.317 -18.000 5.768 473 HA VAL 89 HA VAL 56 -8.375 -16.042 6.882 474 HB VAL 89 HB VAL 56 -8.215 -15.863 4.534 475 HG11 VAL 89 HG11 VAL 56 -10.039 -16.844 3.550 476 HG12 VAL 89 HG12 VAL 56 -11.220 -15.873 4.435 477 HG13 VAL 89 HG13 VAL 56 -10.255 -15.145 3.126 478 HG21 VAL 89 HG21 VAL 56 -8.591 -13.587 4.090 479 HG22 VAL 89 HG22 VAL 56 -9.925 -13.480 5.244 480 HG23 VAL 89 HG23 VAL 56 -8.264 -13.714 5.826 481 HA PRO 90 HA PRO 57 -12.807 -16.072 8.531 482 HB2 PRO 90 HB2 PRO 57 -12.601 -17.080 11.056 483 HB3 PRO 90 HB3 PRO 57 -12.684 -18.121 9.604 484 HG2 PRO 90 HG2 PRO 57 -10.219 -17.243 11.137 485 HG3 PRO 90 HG3 PRO 57 -10.659 -18.894 10.573 486 HD2 PRO 90 HD2 PRO 57 -8.961 -17.246 9.169 487 HD3 PRO 90 HD3 PRO 57 -10.059 -18.421 8.401 488 H ALA 91 H ALA 58 -9.821 -14.712 9.737 489 HA ALA 91 HA ALA 58 -11.110 -12.948 11.686 490 HB1 ALA 91 HB1 ALA 58 -8.276 -12.976 10.564 491 HB2 ALA 91 HB2 ALA 58 -8.841 -12.046 11.970 492 HB3 ALA 91 HB3 ALA 58 -8.819 -13.817 12.039 493 H VAL 92 H VAL 59 -10.881 -12.881 8.287 494 HA VAL 92 HA VAL 59 -11.257 -9.914 8.248 495 HB VAL 92 HB VAL 59 -9.610 -11.453 6.221 496 HG11 VAL 92 HG11 VAL 59 -10.538 -9.304 5.438 497 HG12 VAL 92 HG12 VAL 59 -9.774 -8.467 6.806 498 HG13 VAL 92 HG13 VAL 59 -8.777 -9.249 5.555 499 HG21 VAL 92 HG21 VAL 59 -8.330 -11.604 8.301 500 HG22 VAL 92 HG22 VAL 59 -7.586 -10.418 7.236 501 HG23 VAL 92 HG23 VAL 59 -8.573 -9.862 8.609 502 H VAL 93 H VAL 60 -12.223 -13.074 7.098 503 HA VAL 93 HA VAL 60 -14.269 -11.920 5.280 504 HB VAL 93 HB VAL 60 -12.166 -14.043 4.831 505 HG11 VAL 93 HG11 VAL 60 -14.520 -13.600 2.971 506 HG12 VAL 93 HG12 VAL 60 -13.082 -14.570 2.618 507 HG13 VAL 93 HG13 VAL 60 -14.164 -15.078 3.898 508 HG21 VAL 93 HG21 VAL 60 -11.379 -11.830 4.278 509 HG22 VAL 93 HG22 VAL 60 -11.668 -12.691 2.777 510 HG23 VAL 93 HG23 VAL 60 -12.841 -11.479 3.355 511 H ARG 94 H ARG 61 -15.926 -13.631 4.850 512 HA ARG 94 HA ARG 61 -16.451 -15.484 7.097 513 HB2 ARG 94 HB2 ARG 61 -17.285 -13.301 7.848 514 HB3 ARG 94 HB3 ARG 61 -18.137 -13.041 6.333 515 HG2 ARG 94 HG2 ARG 61 -19.626 -15.032 6.912 516 HG3 ARG 94 HG3 ARG 61 -18.754 -15.147 8.454 517 HD2 ARG 94 HD2 ARG 61 -20.658 -13.911 8.995 518 HD3 ARG 94 HD3 ARG 61 -19.447 -12.661 8.786 519 HE ARG 94 HE ARG 61 -20.463 -11.952 6.791 520 HH11 ARG 94 HH11 ARG 61 -22.107 -14.870 8.021 521 HH12 ARG 94 HH12 ARG 61 -23.505 -14.666 7.004 522 HH21 ARG 94 HH21 ARG 61 -22.487 -11.584 5.634 523 HH22 ARG 94 HH22 ARG 61 -23.727 -12.780 5.713 524 H ILE 95 H ILE 62 -18.185 -17.027 6.424 525 HA ILE 95 HA ILE 62 -19.026 -16.856 3.602 526 HB ILE 95 HB ILE 62 -18.276 -19.158 3.157 527 HG12 ILE 95 HG12 ILE 62 -16.716 -18.936 5.749 528 HG13 ILE 95 HG13 ILE 62 -18.046 -20.053 5.399 529 HG21 ILE 95 HG21 ILE 62 -16.913 -17.095 2.487 530 HG22 ILE 95 HG22 ILE 62 -15.855 -17.447 3.866 531 HG23 ILE 95 HG23 ILE 62 -16.029 -18.612 2.535 532 HD11 ILE 95 HD11 ILE 62 -15.971 -21.241 5.272 533 HD12 ILE 95 HD12 ILE 62 -16.647 -21.128 3.632 534 HD13 ILE 95 HD13 ILE 62 -15.282 -20.085 4.133 535 H GLU 96 H GLU 63 -20.822 -18.122 3.106 536 HA GLU 96 HA GLU 63 -22.115 -19.676 5.308 537 HB2 GLU 96 HB2 GLU 63 -23.446 -17.757 3.349 538 HB3 GLU 96 HB3 GLU 63 -24.294 -18.967 4.328 539 HG2 GLU 96 HG2 GLU 63 -23.429 -17.876 6.399 540 HG3 GLU 96 HG3 GLU 63 -22.657 -16.642 5.401 541 H ALA 97 H ALA 64 -21.578 -21.693 4.548 542 HA ALA 97 HA ALA 64 -21.859 -22.448 1.731 543 HB1 ALA 97 HB1 ALA 64 -21.534 -24.120 4.257 544 HB2 ALA 97 HB2 ALA 64 -21.481 -24.729 2.595 545 HB3 ALA 97 HB3 ALA 64 -20.228 -23.608 3.157 546 H SER 98 H SER 65 -23.770 -22.883 0.790 547 HA SER 98 HA SER 65 -26.245 -22.792 2.356 548 HB2 SER 98 HB2 SER 65 -26.005 -21.529 0.238 549 HB3 SER 98 HB3 SER 65 -25.703 -23.045 -0.637 550 HG SER 98 HG SER 65 -27.933 -22.238 -0.673 551 H ARG 99 H ARG 66 -27.820 -24.460 2.137 552 HA ARG 99 HA ARG 66 -26.883 -27.156 2.361 553 HB2 ARG 99 HB2 ARG 66 -29.079 -27.858 2.596 554 HB3 ARG 99 HB3 ARG 66 -29.035 -26.274 3.342 555 HG2 ARG 99 HG2 ARG 66 -30.228 -26.967 0.612 556 HG3 ARG 99 HG3 ARG 66 -31.103 -26.717 2.114 557 HD2 ARG 99 HD2 ARG 66 -30.123 -24.337 2.139 558 HD3 ARG 99 HD3 ARG 66 -29.689 -24.605 0.447 559 HE ARG 99 HE ARG 66 -32.331 -24.229 1.644 560 HH11 ARG 99 HH11 ARG 66 -30.647 -25.141 -1.392 561 HH12 ARG 99 HH12 ARG 66 -32.102 -25.142 -2.319 562 HH21 ARG 99 HH21 ARG 66 -34.211 -24.171 0.357 563 HH22 ARG 99 HH22 ARG 66 -34.136 -24.499 -1.332 564 H SER 100 H SER 67 -27.701 -25.254 -0.465 565 HA SER 100 HA SER 67 -28.094 -27.398 -2.296 566 HB2 SER 100 HB2 SER 67 -26.985 -24.645 -2.917 567 HB3 SER 100 HB3 SER 67 -27.998 -25.682 -3.944 568 HG SER 100 HG SER 67 -29.165 -23.955 -2.924 569 H GLY 101 H GLY 68 -25.205 -26.372 -0.679 570 HA2 GLY 101 HA2 GLY 68 -23.151 -27.430 -0.834 571 HA3 GLY 101 HA3 GLY 68 -23.502 -27.982 -2.478 572 H GLU 102 H GLU 69 -24.414 -24.779 -2.491 573 HA GLU 102 HA GLU 69 -21.898 -23.800 -3.660 574 HB2 GLU 102 HB2 GLU 69 -24.621 -22.519 -3.082 575 HB3 GLU 102 HB3 GLU 69 -23.266 -21.634 -3.772 576 HG2 GLU 102 HG2 GLU 69 -24.617 -24.051 -5.053 577 HG3 GLU 102 HG3 GLU 69 -24.877 -22.369 -5.492 578 H ILE 103 H ILE 70 -21.067 -21.670 -2.712 579 HA ILE 103 HA ILE 70 -21.700 -21.236 0.087 580 HB ILE 103 HB ILE 70 -19.921 -22.547 0.580 581 HG12 ILE 103 HG12 ILE 70 -19.757 -20.173 1.491 582 HG13 ILE 103 HG13 ILE 70 -18.401 -21.267 1.709 583 HG21 ILE 103 HG21 ILE 70 -18.179 -21.534 -1.631 584 HG22 ILE 103 HG22 ILE 70 -17.714 -22.672 -0.354 585 HG23 ILE 103 HG23 ILE 70 -18.959 -23.142 -1.509 586 HD11 ILE 103 HD11 ILE 70 -18.364 -19.354 -0.645 587 HD12 ILE 103 HD12 ILE 70 -17.914 -18.806 0.960 588 HD13 ILE 103 HD13 ILE 70 -17.017 -20.135 0.193 589 H VAL 104 H VAL 71 -21.786 -19.191 0.583 590 HA VAL 104 HA VAL 71 -21.260 -17.199 -1.560 591 HB VAL 104 HB VAL 71 -23.097 -16.882 0.855 592 HG11 VAL 104 HG11 VAL 71 -22.469 -14.835 -0.373 593 HG12 VAL 104 HG12 VAL 71 -23.041 -15.556 -1.903 594 HG13 VAL 104 HG13 VAL 71 -24.180 -15.195 -0.589 595 HG21 VAL 104 HG21 VAL 71 -25.029 -17.449 -0.610 596 HG22 VAL 104 HG22 VAL 71 -23.899 -18.074 -1.832 597 HG23 VAL 104 HG23 VAL 71 -24.027 -18.850 -0.244 598 H CYS 105 H CYS 72 -19.887 -15.522 -1.051 599 HA CYS 105 HA CYS 72 -18.365 -15.816 1.478 600 HB2 CYS 105 HB2 CYS 72 -17.472 -14.403 -1.057 601 HB3 CYS 105 HB3 CYS 72 -16.467 -15.116 0.223 602 HG CYS 105 HG CYS 72 -18.319 -16.495 -2.158 603 H TYR 106 H TYR 73 -17.843 -13.982 2.707 604 HA TYR 106 HA TYR 73 -19.065 -11.355 2.008 605 HB2 TYR 106 HB2 TYR 73 -19.430 -13.009 4.542 606 HB3 TYR 106 HB3 TYR 73 -19.916 -11.325 4.392 607 HD1 TYR 106 HD1 TYR 73 -21.566 -10.703 2.515 608 HD2 TYR 106 HD2 TYR 73 -20.924 -14.739 3.947 609 HE1 TYR 106 HE1 TYR 73 -23.846 -11.316 1.782 610 HE2 TYR 106 HE2 TYR 73 -23.138 -15.412 3.062 611 HH TYR 106 HH TYR 73 -25.175 -14.655 2.111 612 H ALA 107 H ALA 74 -18.302 -9.674 3.635 613 HA ALA 107 HA ALA 74 -15.401 -10.064 4.188 614 HB1 ALA 107 HB1 ALA 74 -17.123 -7.556 4.474 615 HB2 ALA 107 HB2 ALA 74 -15.343 -7.676 4.509 616 HB3 ALA 107 HB3 ALA 74 -16.215 -7.982 3.011 617 H VAL 108 H VAL 75 -14.594 -9.268 6.273 618 HA VAL 108 HA VAL 75 -16.578 -8.944 8.445 619 HB VAL 108 HB VAL 75 -15.001 -11.325 8.089 620 HG11 VAL 108 HG11 VAL 75 -13.997 -11.695 10.240 621 HG12 VAL 108 HG12 VAL 75 -13.237 -10.285 9.492 622 HG13 VAL 108 HG13 VAL 75 -14.427 -10.064 10.784 623 HG21 VAL 108 HG21 VAL 75 -16.841 -10.518 10.375 624 HG22 VAL 108 HG22 VAL 75 -17.379 -11.165 8.816 625 HG23 VAL 108 HG23 VAL 75 -16.392 -12.168 9.896 626 H ALA 109 H ALA 76 -13.345 -8.193 7.174 627 HA ALA 109 HA ALA 76 -13.274 -5.858 8.930 628 HB1 ALA 109 HB1 ALA 76 -10.908 -7.783 8.826 629 HB2 ALA 109 HB2 ALA 76 -11.003 -6.253 9.711 630 HB3 ALA 109 HB3 ALA 76 -12.007 -7.626 10.216 Start of MODEL 2 1 H1 GLY -2 H1 GLY -2 5.598 1.901 -1.620 2 H2 GLY -2 H2 GLY -2 7.029 1.726 -0.838 3 H3 GLY -2 H3 GLY -2 6.789 0.995 -2.289 4 HA2 GLY -2 HA2 GLY -2 6.642 -0.622 -0.523 5 HA3 GLY -2 HA3 GLY -2 5.373 0.365 0.224 6 H HIS -1 H HIS -1 5.225 -2.443 -0.688 7 HA HIS -1 HA HIS -1 2.766 -2.268 -2.286 8 HB2 HIS -1 HB2 HIS -1 4.630 -2.488 -3.953 9 HB3 HIS -1 HB3 HIS -1 5.092 -4.006 -3.171 10 HD2 HIS -1 HD2 HIS -1 4.224 -5.981 -4.543 11 HE1 HIS -1 HE1 HIS -1 0.486 -4.440 -5.896 12 HE2 HIS -1 HE2 HIS -1 2.062 -6.444 -5.968 13 H MET 34 H MET 1 1.536 -4.300 -2.072 14 HA MET 34 HA MET 1 1.769 -5.453 0.557 15 HB2 MET 34 HB2 MET 1 0.101 -6.260 -1.859 16 HB3 MET 34 HB3 MET 1 -0.079 -6.911 -0.225 17 HG2 MET 34 HG2 MET 1 -1.626 -5.347 0.103 18 HG3 MET 34 HG3 MET 1 -0.299 -4.203 0.205 19 HE1 MET 34 HE1 MET 1 -3.096 -5.779 -2.319 20 HE2 MET 34 HE2 MET 1 -3.714 -4.595 -1.149 21 HE3 MET 34 HE3 MET 1 -3.675 -4.215 -2.886 22 H LEU 35 H LEU 2 2.221 -7.630 1.113 23 HA LEU 35 HA LEU 2 4.158 -9.113 -0.553 24 HB2 LEU 35 HB2 LEU 2 2.729 -9.913 2.030 25 HB3 LEU 35 HB3 LEU 2 4.079 -10.761 1.276 26 HG LEU 35 HG LEU 2 4.170 -7.975 2.522 27 HD11 LEU 35 HD11 LEU 2 4.019 -9.815 4.138 28 HD12 LEU 35 HD12 LEU 2 5.423 -10.608 3.391 29 HD13 LEU 35 HD13 LEU 2 5.602 -9.031 4.208 30 HD21 LEU 35 HD21 LEU 2 6.631 -8.111 2.169 31 HD22 LEU 35 HD22 LEU 2 6.398 -9.573 1.186 32 HD23 LEU 35 HD23 LEU 2 5.736 -8.004 0.657 33 H GLU 36 H GLU 3 3.561 -11.533 -1.075 34 HA GLU 36 HA GLU 3 1.396 -11.388 -2.828 35 HB2 GLU 36 HB2 GLU 3 3.272 -12.940 -3.119 36 HB3 GLU 36 HB3 GLU 3 2.718 -13.897 -1.736 37 HG2 GLU 36 HG2 GLU 3 0.662 -14.498 -2.918 38 HG3 GLU 36 HG3 GLU 3 1.084 -13.435 -4.260 39 H ALA 37 H ALA 4 1.422 -13.233 0.224 40 HA ALA 37 HA ALA 4 -1.312 -13.993 -0.102 41 HB1 ALA 37 HB1 ALA 4 0.231 -15.268 1.331 42 HB2 ALA 37 HB2 ALA 4 0.311 -13.910 2.483 43 HB3 ALA 37 HB3 ALA 4 -1.226 -14.780 2.216 44 H ASP 38 H ASP 5 0.232 -11.227 1.491 45 HA ASP 38 HA ASP 5 -2.072 -10.207 2.872 46 HB2 ASP 38 HB2 ASP 5 0.289 -9.600 3.367 47 HB3 ASP 38 HB3 ASP 5 0.388 -8.744 1.831 48 H LEU 39 H LEU 6 -0.704 -9.624 -0.369 49 HA LEU 39 HA LEU 6 -2.363 -7.527 -1.235 50 HB2 LEU 39 HB2 LEU 6 -0.289 -8.338 -2.369 51 HB3 LEU 39 HB3 LEU 6 -1.082 -9.802 -2.850 52 HG LEU 39 HG LEU 6 -2.305 -7.171 -3.694 53 HD11 LEU 39 HD11 LEU 6 0.066 -8.515 -5.057 54 HD12 LEU 39 HD12 LEU 6 -0.857 -7.120 -5.681 55 HD13 LEU 39 HD13 LEU 6 0.091 -6.952 -4.197 56 HD21 LEU 39 HD21 LEU 6 -3.547 -9.219 -4.328 57 HD22 LEU 39 HD22 LEU 6 -2.858 -8.453 -5.754 58 HD23 LEU 39 HD23 LEU 6 -2.078 -9.882 -5.073 59 H VAL 40 H VAL 7 -2.627 -11.062 -1.884 60 HA VAL 40 HA VAL 7 -5.089 -10.697 -3.220 61 HB VAL 40 HB VAL 7 -5.220 -13.110 -3.304 62 HG11 VAL 40 HG11 VAL 7 -2.302 -12.261 -3.589 63 HG12 VAL 40 HG12 VAL 7 -3.146 -13.531 -4.473 64 HG13 VAL 40 HG13 VAL 7 -3.580 -11.837 -4.734 65 HG21 VAL 40 HG21 VAL 7 -3.590 -14.579 -2.177 66 HG22 VAL 40 HG22 VAL 7 -2.911 -13.186 -1.335 67 HG23 VAL 40 HG23 VAL 7 -4.559 -13.718 -0.988 68 H SER 41 H SER 8 -4.409 -11.464 0.215 69 HA SER 41 HA SER 8 -7.128 -11.929 0.941 70 HB2 SER 41 HB2 SER 8 -4.837 -10.903 2.672 71 HB3 SER 41 HB3 SER 8 -6.363 -11.602 3.248 72 HG SER 41 HG SER 8 -4.174 -12.832 1.962 73 H LYS 42 H LYS 9 -5.211 -8.805 1.061 74 HA LYS 42 HA LYS 9 -7.465 -7.304 2.127 75 HB2 LYS 42 HB2 LYS 9 -4.901 -6.548 0.667 76 HB3 LYS 42 HB3 LYS 9 -6.122 -5.336 1.092 77 HG2 LYS 42 HG2 LYS 9 -5.971 -5.849 3.454 78 HG3 LYS 42 HG3 LYS 9 -4.894 -7.227 3.136 79 HD2 LYS 42 HD2 LYS 9 -3.189 -5.724 2.207 80 HD3 LYS 42 HD3 LYS 9 -4.217 -4.306 2.516 81 HE2 LYS 42 HE2 LYS 9 -4.074 -4.591 4.893 82 HE3 LYS 42 HE3 LYS 9 -3.437 -6.235 4.725 83 HZ1 LYS 42 HZ1 LYS 9 -1.667 -4.722 5.277 84 HZ2 LYS 42 HZ2 LYS 9 -1.415 -5.356 3.788 85 HZ3 LYS 42 HZ3 LYS 9 -1.943 -3.795 3.956 86 H MET 43 H MET 10 -6.337 -7.997 -1.237 87 HA MET 43 HA MET 10 -8.244 -6.266 -2.498 88 HB2 MET 43 HB2 MET 10 -6.880 -8.808 -3.484 89 HB3 MET 43 HB3 MET 10 -7.797 -7.695 -4.503 90 HG2 MET 43 HG2 MET 10 -5.484 -6.616 -2.872 91 HG3 MET 43 HG3 MET 10 -5.168 -7.571 -4.302 92 HE1 MET 43 HE1 MET 10 -4.294 -4.460 -6.132 93 HE2 MET 43 HE2 MET 10 -3.680 -5.397 -4.751 94 HE3 MET 43 HE3 MET 10 -4.243 -6.240 -6.206 95 H LEU 44 H LEU 11 -8.340 -9.808 -1.824 96 HA LEU 44 HA LEU 11 -10.938 -10.473 -2.615 97 HB2 LEU 44 HB2 LEU 11 -9.328 -12.131 -1.798 98 HB3 LEU 44 HB3 LEU 11 -9.170 -11.297 -0.264 99 HG LEU 44 HG LEU 11 -11.599 -11.876 0.227 100 HD11 LEU 44 HD11 LEU 11 -11.089 -13.787 -2.089 101 HD12 LEU 44 HD12 LEU 11 -12.494 -13.806 -0.989 102 HD13 LEU 44 HD13 LEU 11 -12.247 -12.432 -2.095 103 HD21 LEU 44 HD21 LEU 11 -11.021 -14.179 0.919 104 HD22 LEU 44 HD22 LEU 11 -9.544 -14.070 -0.051 105 HD23 LEU 44 HD23 LEU 11 -9.763 -12.995 1.338 106 H ARG 45 H ARG 12 -9.899 -9.369 0.613 107 HA ARG 45 HA ARG 12 -12.411 -9.016 1.814 108 HB2 ARG 45 HB2 ARG 12 -10.500 -9.052 3.116 109 HB3 ARG 45 HB3 ARG 12 -9.642 -7.872 2.158 110 HG2 ARG 45 HG2 ARG 12 -12.096 -6.969 3.645 111 HG3 ARG 45 HG3 ARG 12 -10.586 -7.274 4.502 112 HD2 ARG 45 HD2 ARG 12 -9.478 -5.705 2.691 113 HD3 ARG 45 HD3 ARG 12 -11.151 -5.130 2.468 114 HE ARG 45 HE ARG 12 -10.324 -5.417 5.233 115 HH11 ARG 45 HH21 ARG 12 -9.978 -3.048 2.595 116 HH12 ARG 45 HH22 ARG 12 -9.988 -1.692 3.673 117 HH21 ARG 45 HH12 ARG 12 -10.487 -3.777 6.547 118 HH22 ARG 45 HH11 ARG 12 -10.192 -2.112 6.069 119 H ALA 46 H ALA 13 -10.569 -6.606 -0.181 120 HA ALA 46 HA ALA 13 -12.462 -4.584 0.391 121 HB1 ALA 46 HB1 ALA 13 -10.160 -4.107 -0.449 122 HB2 ALA 46 HB2 ALA 13 -10.569 -4.855 -2.006 123 HB3 ALA 46 HB3 ALA 13 -11.383 -3.365 -1.499 124 H VAL 47 H VAL 14 -12.295 -6.946 -2.323 125 HA VAL 47 HA VAL 14 -14.544 -5.870 -3.756 126 HB VAL 47 HB VAL 14 -13.443 -8.714 -3.579 127 HG11 VAL 47 HG11 VAL 14 -14.636 -9.182 -5.642 128 HG12 VAL 47 HG12 VAL 14 -15.790 -8.745 -4.386 129 HG13 VAL 47 HG13 VAL 14 -15.370 -7.554 -5.630 130 HG21 VAL 47 HG21 VAL 14 -13.067 -6.434 -5.582 131 HG22 VAL 47 HG22 VAL 14 -11.823 -7.150 -4.533 132 HG23 VAL 47 HG23 VAL 14 -12.507 -8.094 -5.847 133 H LEU 48 H LEU 15 -14.267 -8.297 -1.124 134 HA LEU 48 HA LEU 15 -17.058 -8.881 -0.991 135 HB2 LEU 48 HB2 LEU 15 -14.862 -8.972 1.144 136 HB3 LEU 48 HB3 LEU 15 -16.455 -9.669 1.348 137 HG LEU 48 HG LEU 15 -14.725 -10.532 -0.999 138 HD11 LEU 48 HD11 LEU 15 -14.748 -11.591 1.863 139 HD12 LEU 48 HD12 LEU 15 -13.975 -12.402 0.477 140 HD13 LEU 48 HD13 LEU 15 -13.393 -10.813 1.028 141 HD21 LEU 48 HD21 LEU 15 -16.868 -11.939 0.626 142 HD22 LEU 48 HD22 LEU 15 -17.175 -11.145 -0.919 143 HD23 LEU 48 HD23 LEU 15 -16.077 -12.544 -0.833 144 H GLN 49 H GLN 16 -15.134 -6.286 0.599 145 HA GLN 49 HA GLN 16 -17.274 -5.418 2.298 146 HB2 GLN 49 HB2 GLN 16 -14.723 -4.085 1.305 147 HB3 GLN 49 HB3 GLN 16 -15.871 -3.219 2.306 148 HG2 GLN 49 HG2 GLN 16 -14.513 -5.808 3.144 149 HG3 GLN 49 HG3 GLN 16 -13.978 -4.194 3.586 150 HE21 GLN 49 HE22 GLN 16 -14.356 -5.676 5.736 151 HE22 GLN 49 HE21 GLN 16 -15.888 -5.328 6.527 152 H SER 50 H SER 17 -16.289 -4.420 -1.038 153 HA SER 50 HA SER 17 -18.328 -2.430 -1.325 154 HB2 SER 50 HB2 SER 17 -17.004 -4.222 -3.408 155 HB3 SER 50 HB3 SER 17 -17.920 -2.741 -3.738 156 HG SER 50 HG SER 17 -15.651 -2.319 -3.659 157 H HIS 51 H HIS 18 -18.279 -5.965 -1.856 158 HA HIS 51 HA HIS 18 -21.009 -5.917 -2.938 159 HB2 HIS 51 HB2 HIS 18 -18.869 -8.065 -2.823 160 HB3 HIS 51 HB3 HIS 18 -20.453 -8.251 -3.557 161 HD2 HIS 51 HD2 HIS 18 -18.877 -8.820 -5.755 162 HE1 HIS 51 HE1 HIS 18 -18.188 -4.772 -6.806 163 HE2 HIS 51 HE2 HIS 18 -18.100 -7.159 -7.652 164 H LYS 52 H LYS 19 -21.596 -5.241 -0.545 165 HA LYS 52 HA LYS 19 -21.522 -7.106 1.568 166 HB2 LYS 52 HB2 LYS 19 -23.460 -4.849 0.880 167 HB3 LYS 52 HB3 LYS 19 -23.624 -5.773 2.359 168 HG2 LYS 52 HG2 LYS 19 -21.177 -4.127 1.612 169 HG3 LYS 52 HG3 LYS 19 -22.468 -3.670 2.731 170 HD2 LYS 52 HD2 LYS 19 -21.872 -5.908 3.971 171 HD3 LYS 52 HD3 LYS 19 -20.338 -5.812 3.108 172 HE2 LYS 52 HE2 LYS 19 -21.532 -3.586 4.835 173 HE3 LYS 52 HE3 LYS 19 -20.375 -4.768 5.441 174 HZ1 LYS 52 HZ1 LYS 19 -18.673 -3.851 4.096 175 HZ2 LYS 52 HZ2 LYS 19 -19.722 -2.961 3.175 176 HZ3 LYS 52 HZ3 LYS 19 -19.441 -2.567 4.736 177 H ASN 53 H ASN 20 -23.717 -7.113 -1.200 178 HA ASN 53 HA ASN 20 -25.694 -8.865 -0.125 179 HB2 ASN 53 HB2 ASN 20 -25.917 -7.594 -2.270 180 HB3 ASN 53 HB3 ASN 20 -24.660 -8.608 -2.977 181 HD21 ASN 53 HD22 ASN 20 -27.908 -8.887 -1.333 182 HD22 ASN 53 HD21 ASN 20 -28.425 -10.245 -2.291 183 H GLY 54 H GLY 21 -22.358 -9.499 -0.765 184 HA2 GLY 54 HA2 GLY 21 -21.173 -11.387 -0.426 185 HA3 GLY 54 HA3 GLY 21 -22.636 -12.387 -0.370 186 H ILE 55 H ILE 22 -20.504 -13.279 -1.795 187 HA ILE 55 HA ILE 22 -21.494 -13.279 -4.587 188 HB ILE 55 HB ILE 22 -18.886 -13.226 -5.158 189 HG12 ILE 55 HG12 ILE 22 -18.952 -11.457 -2.661 190 HG13 ILE 55 HG13 ILE 22 -17.991 -12.909 -2.909 191 HG21 ILE 55 HG21 ILE 22 -19.098 -11.071 -5.966 192 HG22 ILE 55 HG22 ILE 22 -20.765 -11.659 -5.947 193 HG23 ILE 55 HG23 ILE 22 -20.218 -10.565 -4.661 194 HD11 ILE 55 HD11 ILE 22 -16.858 -11.576 -4.851 195 HD12 ILE 55 HD12 ILE 22 -17.723 -10.164 -4.217 196 HD13 ILE 55 HD13 ILE 22 -16.540 -11.000 -3.208 197 H VAL 56 H VAL 23 -21.677 -15.255 -5.283 198 HA VAL 56 HA VAL 23 -21.069 -17.529 -3.669 199 HB VAL 56 HB VAL 23 -21.758 -18.782 -5.716 200 HG11 VAL 56 HG11 VAL 23 -24.094 -18.014 -5.704 201 HG12 VAL 56 HG12 VAL 23 -23.409 -18.122 -4.079 202 HG13 VAL 56 HG13 VAL 23 -23.622 -16.532 -4.850 203 HG21 VAL 56 HG21 VAL 23 -22.197 -16.032 -7.001 204 HG22 VAL 56 HG22 VAL 23 -20.959 -17.211 -7.479 205 HG23 VAL 56 HG23 VAL 23 -22.669 -17.611 -7.656 206 H LEU 57 H LEU 24 -19.370 -19.127 -3.891 207 HA LEU 57 HA LEU 24 -16.930 -18.147 -4.269 208 HB2 LEU 57 HB2 LEU 24 -15.863 -20.142 -4.150 209 HB3 LEU 57 HB3 LEU 24 -17.276 -20.234 -3.166 210 HG LEU 57 HG LEU 24 -16.996 -21.471 -5.958 211 HD11 LEU 57 HD11 LEU 24 -15.447 -22.513 -4.364 212 HD12 LEU 57 HD12 LEU 24 -16.777 -22.804 -3.227 213 HD13 LEU 57 HD13 LEU 24 -16.740 -23.631 -4.795 214 HD21 LEU 57 HD21 LEU 24 -18.979 -22.789 -5.484 215 HD22 LEU 57 HD22 LEU 24 -19.099 -22.149 -3.847 216 HD23 LEU 57 HD23 LEU 24 -19.425 -21.099 -5.221 217 HA PRO 58 HA PRO 25 -16.092 -19.060 -8.863 218 HB2 PRO 58 HB2 PRO 25 -18.120 -19.004 -10.704 219 HB3 PRO 58 HB3 PRO 25 -17.565 -20.496 -9.887 220 HG2 PRO 58 HG2 PRO 25 -19.940 -18.756 -9.135 221 HG3 PRO 58 HG3 PRO 25 -19.884 -20.534 -9.341 222 HD2 PRO 58 HD2 PRO 25 -19.666 -19.438 -6.890 223 HD3 PRO 58 HD3 PRO 25 -18.678 -20.841 -7.369 224 H ARG 59 H ARG 26 -18.923 -17.030 -8.089 225 HA ARG 59 HA ARG 26 -18.180 -14.781 -9.761 226 HB2 ARG 59 HB2 ARG 26 -20.484 -15.346 -8.958 227 HB3 ARG 59 HB3 ARG 26 -19.997 -14.911 -7.308 228 HG2 ARG 59 HG2 ARG 26 -19.607 -12.611 -7.989 229 HG3 ARG 59 HG3 ARG 26 -19.895 -13.007 -9.687 230 HD2 ARG 59 HD2 ARG 26 -21.983 -13.322 -7.487 231 HD3 ARG 59 HD3 ARG 26 -21.814 -11.873 -8.495 232 HE ARG 59 HE ARG 26 -21.996 -14.066 -10.247 233 HH11 ARG 59 HH11 ARG 26 -24.100 -12.334 -7.963 234 HH12 ARG 59 HH12 ARG 26 -25.567 -12.806 -8.750 235 HH21 ARG 59 HH21 ARG 26 -23.947 -14.691 -11.288 236 HH22 ARG 59 HH22 ARG 26 -25.472 -14.168 -10.675 237 H LEU 60 H LEU 27 -17.454 -15.838 -6.440 238 HA LEU 60 HA LEU 27 -16.227 -13.512 -5.504 239 HB2 LEU 60 HB2 LEU 27 -16.707 -15.530 -4.121 240 HB3 LEU 60 HB3 LEU 27 -15.448 -16.433 -4.931 241 HG LEU 60 HG LEU 27 -14.891 -15.603 -2.677 242 HD11 LEU 60 HD11 LEU 27 -13.199 -16.307 -4.406 243 HD12 LEU 60 HD12 LEU 27 -12.913 -14.572 -4.722 244 HD13 LEU 60 HD13 LEU 27 -12.622 -15.254 -3.122 245 HD21 LEU 60 HD21 LEU 27 -15.907 -13.335 -2.993 246 HD22 LEU 60 HD22 LEU 27 -14.322 -13.332 -2.252 247 HD23 LEU 60 HD23 LEU 27 -14.481 -12.873 -3.955 248 H GLN 61 H GLN 28 -14.734 -16.314 -7.261 249 HA GLN 61 HA GLN 28 -12.172 -15.175 -7.665 250 HB2 GLN 61 HB2 GLN 28 -13.828 -17.290 -9.027 251 HB3 GLN 61 HB3 GLN 28 -12.441 -16.684 -9.906 252 HG2 GLN 61 HG2 GLN 28 -12.087 -17.582 -7.038 253 HG3 GLN 61 HG3 GLN 28 -12.235 -18.765 -8.333 254 HE21 GLN 61 HE22 GLN 28 -10.202 -19.485 -9.075 255 HE22 GLN 61 HE21 GLN 28 -8.780 -18.490 -9.166 256 H GLY 62 H GLY 29 -15.120 -14.924 -9.754 257 HA2 GLY 62 HA2 GLY 29 -13.940 -13.501 -11.860 258 HA3 GLY 62 HA3 GLY 29 -15.640 -13.391 -11.385 259 H GLU 63 H GLU 30 -15.707 -12.097 -9.000 260 HA GLU 63 HA GLU 30 -15.141 -9.400 -9.822 261 HB2 GLU 63 HB2 GLU 30 -16.120 -10.554 -7.175 262 HB3 GLU 63 HB3 GLU 30 -16.069 -8.835 -7.565 263 HG2 GLU 63 HG2 GLU 30 -17.706 -10.907 -9.081 264 HG3 GLU 63 HG3 GLU 30 -18.313 -9.787 -7.872 265 H TYR 64 H TYR 31 -13.582 -11.635 -7.510 266 HA TYR 64 HA TYR 31 -11.620 -9.939 -6.369 267 HB2 TYR 64 HB2 TYR 31 -11.837 -12.180 -5.572 268 HB3 TYR 64 HB3 TYR 31 -11.646 -12.854 -7.180 269 HD1 TYR 64 HD2 TYR 31 -9.468 -12.990 -8.317 270 HD2 TYR 64 HD1 TYR 31 -9.841 -11.566 -4.260 271 HE1 TYR 64 HE2 TYR 31 -7.053 -13.249 -8.007 272 HE2 TYR 64 HE1 TYR 31 -7.409 -11.922 -3.920 273 HH TYR 64 HH TYR 31 -5.259 -13.110 -6.574 274 H ARG 65 H ARG 32 -11.542 -11.858 -9.422 275 HA ARG 65 HA ARG 32 -8.984 -10.965 -10.181 276 HB2 ARG 65 HB2 ARG 32 -9.989 -12.992 -11.001 277 HB3 ARG 65 HB3 ARG 32 -11.274 -12.106 -11.843 278 HG2 ARG 65 HG2 ARG 32 -9.763 -11.150 -13.436 279 HG3 ARG 65 HG3 ARG 32 -8.356 -11.503 -12.430 280 HD2 ARG 65 HD2 ARG 32 -8.965 -13.971 -12.728 281 HD3 ARG 65 HD3 ARG 32 -10.001 -13.456 -14.063 282 HE ARG 65 HE ARG 32 -7.053 -13.173 -13.731 283 HH11 ARG 65 HH11 ARG 32 -9.807 -13.058 -15.968 284 HH12 ARG 65 HH12 ARG 32 -8.841 -12.973 -17.398 285 HH21 ARG 65 HH21 ARG 32 -5.747 -13.067 -15.649 286 HH22 ARG 65 HH22 ARG 32 -6.488 -12.984 -17.205 287 H SER 66 H SER 33 -12.252 -9.591 -10.956 288 HA SER 66 HA SER 33 -11.333 -7.668 -12.778 289 HB2 SER 66 HB2 SER 33 -13.554 -7.347 -10.711 290 HB3 SER 66 HB3 SER 33 -13.335 -6.374 -12.171 291 HG SER 66 HG SER 33 -14.851 -8.015 -12.576 292 H LEU 67 H LEU 34 -11.191 -7.628 -9.160 293 HA LEU 67 HA LEU 34 -10.085 -4.923 -9.197 294 HB2 LEU 67 HB2 LEU 34 -11.356 -5.727 -7.261 295 HB3 LEU 67 HB3 LEU 34 -10.143 -6.978 -6.961 296 HG LEU 67 HG LEU 34 -8.423 -5.222 -6.570 297 HD11 LEU 67 HD11 LEU 34 -9.149 -2.854 -6.207 298 HD12 LEU 67 HD12 LEU 34 -9.269 -3.342 -7.896 299 HD13 LEU 67 HD13 LEU 34 -10.733 -3.253 -6.893 300 HD21 LEU 67 HD21 LEU 34 -9.718 -6.141 -4.688 301 HD22 LEU 67 HD22 LEU 34 -9.242 -4.464 -4.397 302 HD23 LEU 67 HD23 LEU 34 -10.914 -4.837 -4.867 303 H THR 68 H THR 35 -8.592 -8.228 -8.629 304 HA THR 68 HA THR 35 -6.003 -7.041 -8.094 305 HB THR 68 HB THR 35 -5.321 -9.506 -8.219 306 HG1 THR 68 HG1 THR 35 -7.305 -10.897 -8.230 307 HG21 THR 68 HG21 THR 35 -6.340 -10.070 -6.162 308 HG22 THR 68 HG22 THR 35 -6.157 -8.316 -6.160 309 HG23 THR 68 HG23 THR 35 -7.763 -9.047 -6.480 310 H GLY 69 H GLY 36 -7.521 -8.519 -10.968 311 HA2 GLY 69 HA2 GLY 36 -6.776 -8.685 -13.151 312 HA3 GLY 69 HA3 GLY 36 -5.248 -7.881 -12.716 313 H ASP 70 H ASP 37 -6.465 -10.597 -10.735 314 HA ASP 70 HA ASP 37 -4.554 -12.514 -11.942 315 HB2 ASP 70 HB2 ASP 37 -3.507 -11.103 -10.019 316 HB3 ASP 70 HB3 ASP 37 -4.621 -11.962 -8.943 317 H TRP 71 H TRP 38 -4.833 -14.661 -10.673 318 HA TRP 71 HA TRP 38 -7.708 -15.185 -10.027 319 HB2 TRP 71 HB2 TRP 38 -5.447 -17.081 -10.789 320 HB3 TRP 71 HB3 TRP 38 -7.073 -17.564 -10.329 321 HD1 TRP 71 HD1 TRP 38 -5.074 -16.842 -13.292 322 HE1 TRP 71 HE1 TRP 38 -6.515 -16.703 -15.402 323 HE3 TRP 71 HE3 TRP 38 -9.661 -16.389 -11.080 324 HZ2 TRP 71 HZ2 TRP 38 -9.331 -16.375 -16.053 325 HZ3 TRP 71 HZ3 TRP 38 -11.680 -16.046 -12.453 326 HH2 TRP 71 HH2 TRP 38 -11.553 -16.084 -14.932 327 H ILE 72 H ILE 39 -8.103 -16.272 -8.004 328 HA ILE 72 HA ILE 39 -6.429 -15.608 -5.860 329 HB ILE 72 HB ILE 39 -8.768 -17.442 -6.253 330 HG12 ILE 72 HG12 ILE 39 -8.140 -15.150 -4.329 331 HG13 ILE 72 HG13 ILE 39 -8.851 -14.956 -5.933 332 HG21 ILE 72 HG21 ILE 39 -8.802 -18.156 -3.908 333 HG22 ILE 72 HG22 ILE 39 -7.446 -18.826 -4.780 334 HG23 ILE 72 HG23 ILE 39 -7.179 -17.464 -3.659 335 HD11 ILE 72 HD11 ILE 39 -10.802 -16.258 -5.295 336 HD12 ILE 72 HD12 ILE 39 -10.154 -16.415 -3.630 337 HD13 ILE 72 HD13 ILE 39 -10.546 -14.815 -4.288 338 HA PRO 73 HA PRO 40 -3.429 -18.860 -6.310 339 HB2 PRO 73 HB2 PRO 40 -1.682 -18.215 -4.323 340 HB3 PRO 73 HB3 PRO 40 -1.931 -17.166 -5.732 341 HG2 PRO 73 HG2 PRO 40 -3.273 -16.961 -3.026 342 HG3 PRO 73 HG3 PRO 40 -2.395 -15.687 -3.923 343 HD2 PRO 73 HD2 PRO 40 -5.131 -16.004 -4.001 344 HD3 PRO 73 HD3 PRO 40 -4.196 -15.426 -5.422 345 H PHE 74 H PHE 41 -5.818 -20.029 -5.330 346 HA PHE 74 HA PHE 41 -5.699 -20.711 -2.524 347 HB2 PHE 74 HB2 PHE 41 -7.502 -22.220 -2.926 348 HB3 PHE 74 HB3 PHE 41 -7.843 -20.691 -3.666 349 HD1 PHE 74 HD2 PHE 41 -7.564 -20.522 -6.287 350 HD2 PHE 74 HD1 PHE 41 -7.542 -24.241 -4.110 351 HE1 PHE 74 HE2 PHE 41 -8.053 -21.749 -8.380 352 HE2 PHE 74 HE1 PHE 41 -8.110 -25.460 -6.193 353 HZ PHE 74 HZ PHE 41 -8.345 -24.216 -8.340 354 H LYS 75 H LYS 42 -5.151 -22.814 -5.378 355 HA LYS 75 HA LYS 42 -4.075 -24.948 -3.768 356 HB2 LYS 75 HB2 LYS 42 -5.275 -25.042 -5.995 357 HB3 LYS 75 HB3 LYS 42 -3.797 -24.441 -6.764 358 HG2 LYS 75 HG2 LYS 42 -2.561 -26.431 -5.922 359 HG3 LYS 75 HG3 LYS 42 -4.001 -27.001 -5.075 360 HD2 LYS 75 HD2 LYS 42 -3.736 -26.703 -8.100 361 HD3 LYS 75 HD3 LYS 42 -3.550 -28.211 -7.185 362 HE2 LYS 75 HE2 LYS 42 -5.901 -27.982 -6.356 363 HE3 LYS 75 HE3 LYS 42 -6.102 -26.540 -7.358 364 HZ1 LYS 75 HZ1 LYS 42 -5.510 -29.263 -8.389 365 HZ2 LYS 75 HZ2 LYS 42 -6.957 -28.516 -8.457 366 HZ3 LYS 75 HZ3 LYS 42 -5.699 -27.932 -9.319 367 H GLN 76 H GLN 43 -2.754 -22.133 -5.264 368 HA GLN 76 HA GLN 43 0.006 -22.909 -5.373 369 HB2 GLN 76 HB2 GLN 43 -1.252 -20.135 -5.397 370 HB3 GLN 76 HB3 GLN 43 0.350 -20.579 -5.949 371 HG2 GLN 76 HG2 GLN 43 -0.699 -20.443 -7.969 372 HG3 GLN 76 HG3 GLN 43 -0.952 -22.148 -7.655 373 HE21 GLN 76 HE22 GLN 43 -2.559 -19.771 -9.174 374 HE22 GLN 76 HE21 GLN 43 -4.185 -19.986 -8.535 375 H LEU 77 H LEU 44 -2.037 -21.092 -3.013 376 HA LEU 77 HA LEU 44 0.050 -20.782 -0.999 377 HB2 LEU 77 HB2 LEU 44 -2.958 -20.549 -0.921 378 HB3 LEU 77 HB3 LEU 44 -1.921 -20.314 0.482 379 HG LEU 77 HG LEU 44 -1.677 -18.642 -2.046 380 HD11 LEU 77 HD11 LEU 44 -2.888 -16.863 -0.839 381 HD12 LEU 77 HD12 LEU 44 -3.915 -18.296 -1.030 382 HD13 LEU 77 HD13 LEU 44 -3.143 -17.927 0.538 383 HD21 LEU 77 HD21 LEU 44 0.359 -18.608 -0.682 384 HD22 LEU 77 HD22 LEU 44 -0.477 -17.058 -0.593 385 HD23 LEU 77 HD23 LEU 44 -0.595 -18.205 0.762 386 H GLY 78 H GLY 45 -2.360 -23.239 -1.864 387 HA2 GLY 78 HA2 GLY 45 -1.568 -25.523 -1.483 388 HA3 GLY 78 HA3 GLY 45 -1.141 -25.079 0.164 389 H TYR 79 H TYR 46 -4.121 -23.633 -0.803 390 HA TYR 79 HA TYR 46 -5.671 -25.419 0.930 391 HB2 TYR 79 HB2 TYR 46 -6.575 -23.058 -0.765 392 HB3 TYR 79 HB3 TYR 46 -7.462 -23.835 0.540 393 HD1 TYR 79 HD2 TYR 46 -6.461 -23.791 2.916 394 HD2 TYR 79 HD1 TYR 46 -5.081 -21.272 -0.303 395 HE1 TYR 79 HE2 TYR 46 -5.347 -22.336 4.542 396 HE2 TYR 79 HE1 TYR 46 -3.969 -19.795 1.321 397 HH TYR 79 HH TYR 46 -4.014 -20.399 4.877 398 HA PRO 80 HA PRO 47 -6.492 -27.801 -2.686 399 HB2 PRO 80 HB2 PRO 47 -8.753 -29.288 -2.013 400 HB3 PRO 80 HB3 PRO 47 -7.139 -29.574 -1.307 401 HG2 PRO 80 HG2 PRO 47 -9.389 -27.873 -0.164 402 HG3 PRO 80 HG3 PRO 47 -8.461 -29.172 0.658 403 HD2 PRO 80 HD2 PRO 47 -7.719 -26.605 1.003 404 HD3 PRO 80 HD3 PRO 47 -6.465 -27.837 0.709 405 H THR 81 H THR 48 -9.170 -25.744 -1.512 406 HA THR 81 HA THR 48 -10.189 -25.492 -4.295 407 HB THR 81 HB THR 48 -12.484 -25.667 -3.123 408 HG1 THR 81 HG1 THR 48 -12.242 -26.879 -1.038 409 HG21 THR 81 HG21 THR 48 -12.609 -28.055 -3.062 410 HG22 THR 81 HG22 THR 48 -11.470 -27.644 -4.353 411 HG23 THR 81 HG23 THR 48 -10.872 -28.224 -2.786 412 H LEU 82 H LEU 49 -11.705 -23.622 -4.478 413 HA LEU 82 HA LEU 49 -10.723 -21.223 -3.235 414 HB2 LEU 82 HB2 LEU 49 -13.337 -21.883 -4.688 415 HB3 LEU 82 HB3 LEU 49 -13.044 -20.316 -3.985 416 HG LEU 82 HG LEU 49 -12.621 -20.146 -6.296 417 HD11 LEU 82 HD11 LEU 49 -11.072 -18.888 -4.819 418 HD12 LEU 82 HD12 LEU 49 -9.896 -20.224 -4.913 419 HD13 LEU 82 HD13 LEU 49 -10.309 -19.333 -6.362 420 HD21 LEU 82 HD21 LEU 49 -12.170 -22.539 -6.800 421 HD22 LEU 82 HD22 LEU 49 -10.997 -21.445 -7.546 422 HD23 LEU 82 HD23 LEU 49 -10.538 -22.366 -6.108 423 H GLU 83 H GLU 50 -13.451 -23.441 -2.407 424 HA GLU 83 HA GLU 50 -14.363 -21.765 -0.306 425 HB2 GLU 83 HB2 GLU 50 -15.640 -23.544 0.511 426 HB3 GLU 83 HB3 GLU 50 -15.669 -23.661 -1.246 427 HG2 GLU 83 HG2 GLU 50 -14.040 -25.522 -1.139 428 HG3 GLU 83 HG3 GLU 50 -13.982 -25.375 0.628 429 H ALA 84 H ALA 51 -11.868 -24.420 -0.231 430 HA ALA 84 HA ALA 51 -11.433 -24.244 2.564 431 HB1 ALA 84 HB1 ALA 51 -10.655 -26.114 1.211 432 HB2 ALA 84 HB2 ALA 51 -9.512 -25.049 0.360 433 HB3 ALA 84 HB3 ALA 51 -9.309 -25.379 2.100 434 H TYR 85 H TYR 52 -9.858 -22.454 -0.126 435 HA TYR 85 HA TYR 52 -8.066 -20.910 1.444 436 HB2 TYR 85 HB2 TYR 52 -7.846 -20.904 -0.908 437 HB3 TYR 85 HB3 TYR 52 -9.525 -20.446 -1.170 438 HD1 TYR 85 HD1 TYR 52 -6.321 -19.187 0.315 439 HD2 TYR 85 HD2 TYR 52 -10.127 -18.189 -1.459 440 HE1 TYR 85 HE1 TYR 52 -5.653 -16.822 0.292 441 HE2 TYR 85 HE2 TYR 52 -9.464 -15.799 -1.505 442 HH TYR 85 HH TYR 52 -6.320 -14.642 -0.177 443 H LEU 86 H LEU 53 -11.514 -20.193 0.506 444 HA LEU 86 HA LEU 53 -11.674 -17.783 2.001 445 HB2 LEU 86 HB2 LEU 53 -13.801 -19.742 1.060 446 HB3 LEU 86 HB3 LEU 53 -14.155 -18.166 1.765 447 HG LEU 86 HG LEU 53 -12.322 -18.320 -0.645 448 HD11 LEU 86 HD11 LEU 53 -14.259 -19.570 -1.371 449 HD12 LEU 86 HD12 LEU 53 -15.355 -18.390 -0.661 450 HD13 LEU 86 HD13 LEU 53 -14.348 -17.958 -2.083 451 HD21 LEU 86 HD21 LEU 53 -12.511 -16.189 0.601 452 HD22 LEU 86 HD22 LEU 53 -13.161 -16.079 -1.036 453 HD23 LEU 86 HD23 LEU 53 -14.276 -16.201 0.344 454 H ARG 87 H ARG 54 -12.377 -21.148 3.009 455 HA ARG 87 HA ARG 54 -13.356 -20.555 5.664 456 HB2 ARG 87 HB2 ARG 54 -11.719 -22.931 4.622 457 HB3 ARG 87 HB3 ARG 54 -12.057 -22.729 6.316 458 HG2 ARG 87 HG2 ARG 54 -13.585 -24.285 5.630 459 HG3 ARG 87 HG3 ARG 54 -14.518 -22.802 5.840 460 HD2 ARG 87 HD2 ARG 54 -14.685 -22.517 3.417 461 HD3 ARG 87 HD3 ARG 54 -13.375 -23.668 3.188 462 HE ARG 87 HE ARG 54 -14.827 -25.224 2.806 463 HH11 ARG 87 HH11 ARG 54 -16.321 -23.476 5.563 464 HH12 ARG 87 HH12 ARG 54 -17.755 -24.433 5.517 465 HH21 ARG 87 HH21 ARG 54 -16.779 -26.285 2.648 466 HH22 ARG 87 HH22 ARG 54 -17.977 -26.154 3.907 467 H SER 88 H SER 55 -10.077 -20.621 4.338 468 HA SER 88 HA SER 55 -8.810 -20.536 6.923 469 HB2 SER 88 HB2 SER 55 -7.655 -20.351 4.124 470 HB3 SER 88 HB3 SER 55 -6.764 -20.639 5.629 471 HG SER 88 HG SER 55 -8.654 -22.309 4.326 472 H VAL 89 H VAL 56 -10.417 -18.001 5.686 473 HA VAL 89 HA VAL 56 -8.452 -16.074 6.803 474 HB VAL 89 HB VAL 56 -8.315 -15.893 4.447 475 HG11 VAL 89 HG11 VAL 56 -10.382 -15.134 3.082 476 HG12 VAL 89 HG12 VAL 56 -10.162 -16.840 3.472 477 HG13 VAL 89 HG13 VAL 56 -11.325 -15.883 4.399 478 HG21 VAL 89 HG21 VAL 56 -8.677 -13.627 4.011 479 HG22 VAL 89 HG22 VAL 56 -9.979 -13.499 5.192 480 HG23 VAL 89 HG23 VAL 56 -8.300 -13.752 5.738 481 HA PRO 90 HA PRO 57 -12.892 -16.095 8.471 482 HB2 PRO 90 HB2 PRO 57 -12.688 -17.100 10.997 483 HB3 PRO 90 HB3 PRO 57 -12.751 -18.144 9.544 484 HG2 PRO 90 HG2 PRO 57 -10.290 -17.238 11.075 485 HG3 PRO 90 HG3 PRO 57 -10.721 -18.893 10.528 486 HD2 PRO 90 HD2 PRO 57 -9.036 -17.267 9.102 487 HD3 PRO 90 HD3 PRO 57 -10.142 -18.441 8.348 488 H ALA 91 H ALA 58 -9.878 -14.778 9.722 489 HA ALA 91 HA ALA 58 -11.165 -13.015 11.660 490 HB1 ALA 91 HB1 ALA 58 -8.889 -12.127 11.954 491 HB2 ALA 91 HB2 ALA 58 -8.865 -13.897 11.981 492 HB3 ALA 91 HB3 ALA 58 -8.333 -13.007 10.525 493 H VAL 92 H VAL 59 -10.948 -12.926 8.260 494 HA VAL 92 HA VAL 59 -11.315 -9.959 8.244 495 HB VAL 92 HB VAL 59 -9.665 -11.524 6.230 496 HG11 VAL 92 HG11 VAL 59 -8.833 -9.316 5.533 497 HG12 VAL 92 HG12 VAL 59 -10.596 -9.394 5.401 498 HG13 VAL 92 HG13 VAL 59 -9.848 -8.528 6.756 499 HG21 VAL 92 HG21 VAL 59 -8.387 -11.637 8.304 500 HG22 VAL 92 HG22 VAL 59 -7.642 -10.439 7.258 501 HG23 VAL 92 HG23 VAL 59 -8.662 -9.902 8.608 502 H VAL 93 H VAL 60 -12.279 -13.115 7.047 503 HA VAL 93 HA VAL 60 -14.336 -11.922 5.265 504 HB VAL 93 HB VAL 60 -12.205 -14.004 4.761 505 HG11 VAL 93 HG11 VAL 60 -13.144 -14.541 2.565 506 HG12 VAL 93 HG12 VAL 60 -14.183 -15.091 3.866 507 HG13 VAL 93 HG13 VAL 60 -14.609 -13.620 2.950 508 HG21 VAL 93 HG21 VAL 60 -11.454 -11.811 4.196 509 HG22 VAL 93 HG22 VAL 60 -11.854 -12.597 2.677 510 HG23 VAL 93 HG23 VAL 60 -12.973 -11.411 3.387 511 H ARG 94 H ARG 61 -16.012 -13.608 4.808 512 HA ARG 94 HA ARG 61 -16.542 -15.493 7.028 513 HB2 ARG 94 HB2 ARG 61 -17.409 -13.524 7.961 514 HB3 ARG 94 HB3 ARG 61 -17.992 -12.902 6.419 515 HG2 ARG 94 HG2 ARG 61 -19.874 -14.475 6.439 516 HG3 ARG 94 HG3 ARG 61 -19.214 -15.303 7.861 517 HD2 ARG 94 HD2 ARG 61 -21.099 -13.769 8.400 518 HD3 ARG 94 HD3 ARG 61 -19.592 -13.401 9.264 519 HE ARG 94 HE ARG 61 -19.945 -11.887 6.790 520 HH11 ARG 94 HH11 ARG 61 -21.192 -11.928 10.095 521 HH12 ARG 94 HH12 ARG 61 -21.143 -10.213 10.294 522 HH21 ARG 94 HH21 ARG 61 -19.512 -9.626 7.187 523 HH22 ARG 94 HH22 ARG 61 -20.331 -8.860 8.509 524 H ILE 95 H ILE 62 -18.280 -17.013 6.357 525 HA ILE 95 HA ILE 62 -19.123 -16.821 3.541 526 HB ILE 95 HB ILE 62 -18.407 -19.139 3.091 527 HG12 ILE 95 HG12 ILE 62 -16.802 -18.926 5.661 528 HG13 ILE 95 HG13 ILE 62 -18.160 -20.015 5.355 529 HG21 ILE 95 HG21 ILE 62 -17.028 -17.107 2.403 530 HG22 ILE 95 HG22 ILE 62 -15.946 -17.477 3.758 531 HG23 ILE 95 HG23 ILE 62 -16.192 -18.643 2.437 532 HD11 ILE 95 HD11 ILE 62 -16.844 -21.127 3.551 533 HD12 ILE 95 HD12 ILE 62 -15.442 -20.123 4.000 534 HD13 ILE 95 HD13 ILE 62 -16.123 -21.247 5.176 535 H GLU 96 H GLU 63 -20.923 -18.103 3.041 536 HA GLU 96 HA GLU 63 -22.196 -19.648 5.255 537 HB2 GLU 96 HB2 GLU 63 -23.587 -17.774 3.290 538 HB3 GLU 96 HB3 GLU 63 -24.385 -18.924 4.376 539 HG2 GLU 96 HG2 GLU 63 -23.234 -17.747 6.316 540 HG3 GLU 96 HG3 GLU 63 -22.752 -16.481 5.179 541 H ALA 97 H ALA 64 -21.607 -21.645 4.516 542 HA ALA 97 HA ALA 64 -21.916 -22.434 1.702 543 HB1 ALA 97 HB1 ALA 64 -20.166 -23.480 3.075 544 HB2 ALA 97 HB2 ALA 64 -21.404 -24.076 4.213 545 HB3 ALA 97 HB3 ALA 64 -21.362 -24.671 2.536 546 H SER 98 H SER 65 -23.831 -22.978 0.842 547 HA SER 98 HA SER 65 -26.246 -23.088 2.504 548 HB2 SER 98 HB2 SER 65 -26.239 -21.896 0.340 549 HB3 SER 98 HB3 SER 65 -25.772 -23.390 -0.498 550 HG SER 98 HG SER 65 -28.028 -22.993 -0.610 551 H ARG 99 H ARG 66 -27.555 -24.917 2.590 552 HA ARG 99 HA ARG 66 -26.400 -27.509 2.720 553 HB2 ARG 99 HB2 ARG 66 -28.534 -28.381 3.101 554 HB3 ARG 99 HB3 ARG 66 -28.544 -26.795 3.846 555 HG2 ARG 99 HG2 ARG 66 -29.877 -27.578 1.210 556 HG3 ARG 99 HG3 ARG 66 -30.663 -27.323 2.761 557 HD2 ARG 99 HD2 ARG 66 -29.950 -24.931 2.726 558 HD3 ARG 99 HD3 ARG 66 -29.273 -25.200 1.102 559 HE ARG 99 HE ARG 66 -32.030 -26.018 1.264 560 HH11 ARG 99 HH11 ARG 66 -29.909 -23.200 0.769 561 HH12 ARG 99 HH12 ARG 66 -31.129 -22.248 0.001 562 HH21 ARG 99 HH21 ARG 66 -33.634 -24.760 0.181 563 HH22 ARG 99 HH22 ARG 66 -33.270 -23.170 -0.378 564 H SER 100 H SER 67 -27.625 -25.745 -0.078 565 HA SER 100 HA SER 67 -27.926 -27.974 -1.825 566 HB2 SER 100 HB2 SER 67 -27.251 -25.096 -2.545 567 HB3 SER 100 HB3 SER 67 -28.091 -26.293 -3.542 568 HG SER 100 HG SER 67 -29.599 -24.885 -2.581 569 H GLY 101 H GLY 68 -25.046 -26.668 -0.449 570 HA2 GLY 101 HA2 GLY 68 -22.937 -27.535 -0.740 571 HA3 GLY 101 HA3 GLY 68 -23.376 -28.218 -2.316 572 H GLU 102 H GLU 69 -24.374 -24.935 -2.078 573 HA GLU 102 HA GLU 69 -22.012 -23.966 -3.612 574 HB2 GLU 102 HB2 GLU 69 -24.770 -22.764 -3.034 575 HB3 GLU 102 HB3 GLU 69 -23.464 -21.927 -3.888 576 HG2 GLU 102 HG2 GLU 69 -23.458 -23.718 -5.619 577 HG3 GLU 102 HG3 GLU 69 -24.797 -24.514 -4.796 578 H ILE 103 H ILE 70 -21.236 -21.745 -2.779 579 HA ILE 103 HA ILE 70 -21.787 -21.236 0.028 580 HB ILE 103 HB ILE 70 -19.960 -22.563 0.453 581 HG12 ILE 103 HG12 ILE 70 -19.861 -20.198 1.417 582 HG13 ILE 103 HG13 ILE 70 -18.471 -21.255 1.583 583 HG21 ILE 103 HG21 ILE 70 -17.739 -22.503 -0.583 584 HG22 ILE 103 HG22 ILE 70 -19.020 -23.085 -1.647 585 HG23 ILE 103 HG23 ILE 70 -18.387 -21.423 -1.827 586 HD11 ILE 103 HD11 ILE 70 -18.038 -18.791 0.887 587 HD12 ILE 103 HD12 ILE 70 -17.154 -20.075 0.053 588 HD13 ILE 103 HD13 ILE 70 -18.539 -19.278 -0.723 589 H VAL 104 H VAL 71 -21.801 -19.178 0.536 590 HA VAL 104 HA VAL 71 -21.314 -17.199 -1.632 591 HB VAL 104 HB VAL 71 -23.159 -16.887 0.766 592 HG11 VAL 104 HG11 VAL 71 -24.250 -15.206 -0.667 593 HG12 VAL 104 HG12 VAL 71 -22.532 -14.841 -0.484 594 HG13 VAL 104 HG13 VAL 71 -23.130 -15.573 -1.997 595 HG21 VAL 104 HG21 VAL 71 -24.078 -18.859 -0.326 596 HG22 VAL 104 HG22 VAL 71 -25.090 -17.472 -0.739 597 HG23 VAL 104 HG23 VAL 71 -23.931 -18.111 -1.922 598 H CYS 105 H CYS 72 -19.919 -15.542 -1.131 599 HA CYS 105 HA CYS 72 -18.421 -15.808 1.422 600 HB2 CYS 105 HB2 CYS 72 -17.524 -14.347 -1.083 601 HB3 CYS 105 HB3 CYS 72 -16.516 -15.064 0.191 602 HG CYS 105 HG CYS 72 -18.345 -16.458 -2.209 603 H TYR 106 H TYR 73 -17.887 -13.962 2.642 604 HA TYR 106 HA TYR 73 -19.097 -11.334 1.943 605 HB2 TYR 106 HB2 TYR 73 -19.477 -12.968 4.497 606 HB3 TYR 106 HB3 TYR 73 -19.939 -11.275 4.330 607 HD1 TYR 106 HD1 TYR 73 -21.660 -10.594 2.608 608 HD2 TYR 106 HD2 TYR 73 -20.926 -14.713 3.726 609 HE1 TYR 106 HE1 TYR 73 -23.929 -11.173 1.886 610 HE2 TYR 106 HE2 TYR 73 -23.159 -15.341 2.867 611 HH TYR 106 HH TYR 73 -25.471 -12.930 1.491 612 H ALA 107 H ALA 74 -18.326 -9.653 3.572 613 HA ALA 107 HA ALA 74 -15.443 -10.123 4.177 614 HB1 ALA 107 HB1 ALA 74 -17.099 -7.559 4.354 615 HB2 ALA 107 HB2 ALA 74 -15.330 -7.719 4.491 616 HB3 ALA 107 HB3 ALA 74 -16.126 -8.040 2.948 617 H VAL 108 H VAL 75 -14.662 -9.325 6.243 618 HA VAL 108 HA VAL 75 -16.643 -8.963 8.409 619 HB VAL 108 HB VAL 75 -15.026 -11.352 8.054 620 HG11 VAL 108 HG11 VAL 75 -13.356 -10.310 9.567 621 HG12 VAL 108 HG12 VAL 75 -14.625 -10.095 10.788 622 HG13 VAL 108 HG13 VAL 75 -14.153 -11.724 10.263 623 HG21 VAL 108 HG21 VAL 75 -17.030 -10.580 10.220 624 HG22 VAL 108 HG22 VAL 75 -17.430 -11.254 8.627 625 HG23 VAL 108 HG23 VAL 75 -16.506 -12.222 9.794 626 H ALA 109 H ALA 76 -13.380 -8.299 7.148 627 HA ALA 109 HA ALA 76 -13.300 -5.915 8.842 628 HB1 ALA 109 HB1 ALA 76 -10.945 -7.865 8.831 629 HB2 ALA 109 HB2 ALA 76 -11.047 -6.315 9.670 630 HB3 ALA 109 HB3 ALA 76 -12.072 -7.659 10.198 Start of MODEL 3 1 H1 GLY -2 H1 GLY -2 2.591 0.087 -6.063 2 H2 GLY -2 H2 GLY -2 3.844 0.382 -5.046 3 H3 GLY -2 H3 GLY -2 3.877 -0.936 -6.016 4 HA2 GLY -2 HA2 GLY -2 1.968 -0.484 -3.822 5 HA3 GLY -2 HA3 GLY -2 2.002 -1.909 -4.874 6 H HIS -1 H HIS -1 2.244 -1.936 -1.995 7 HA HIS -1 HA HIS -1 4.999 -3.047 -1.657 8 HB2 HIS -1 HB2 HIS -1 5.095 -2.031 0.552 9 HB3 HIS -1 HB3 HIS -1 4.888 -0.810 -0.692 10 HD2 HIS -1 HD2 HIS -1 2.738 0.724 -0.585 11 HE1 HIS -1 HE1 HIS -1 0.845 -1.031 2.807 12 HE2 HIS -1 HE2 HIS -1 0.784 0.914 1.172 13 H MET 34 H MET 1 1.804 -3.973 -1.703 14 HA MET 34 HA MET 1 1.572 -5.468 0.755 15 HB2 MET 34 HB2 MET 1 0.248 -5.819 -1.964 16 HB3 MET 34 HB3 MET 1 -0.201 -6.698 -0.499 17 HG2 MET 34 HG2 MET 1 -1.454 -5.026 0.289 18 HG3 MET 34 HG3 MET 1 -0.211 -3.824 -0.014 19 HE1 MET 34 HE1 MET 1 -4.117 -4.179 -2.263 20 HE2 MET 34 HE2 MET 1 -3.325 -5.736 -2.124 21 HE3 MET 34 HE3 MET 1 -3.682 -4.790 -0.655 22 H LEU 35 H LEU 2 2.173 -7.579 1.195 23 HA LEU 35 HA LEU 2 4.093 -8.991 -0.568 24 HB2 LEU 35 HB2 LEU 2 2.769 -9.675 2.113 25 HB3 LEU 35 HB3 LEU 2 3.734 -10.823 1.221 26 HG LEU 35 HG LEU 2 5.042 -9.912 2.980 27 HD11 LEU 35 HD11 LEU 2 6.103 -8.702 0.399 28 HD12 LEU 35 HD12 LEU 2 7.032 -9.229 1.814 29 HD13 LEU 35 HD13 LEU 2 6.186 -10.427 0.820 30 HD21 LEU 35 HD21 LEU 2 3.918 -7.711 3.262 31 HD22 LEU 35 HD22 LEU 2 5.685 -7.600 3.229 32 HD23 LEU 35 HD23 LEU 2 4.751 -7.124 1.805 33 H GLU 36 H GLU 3 3.434 -11.410 -1.173 34 HA GLU 36 HA GLU 3 1.188 -11.166 -2.848 35 HB2 GLU 36 HB2 GLU 3 3.018 -12.757 -3.276 36 HB3 GLU 36 HB3 GLU 3 2.497 -13.741 -1.896 37 HG2 GLU 36 HG2 GLU 3 0.383 -14.259 -2.978 38 HG3 GLU 36 HG3 GLU 3 0.747 -13.154 -4.306 39 H ALA 37 H ALA 4 1.373 -13.034 0.187 40 HA ALA 37 HA ALA 4 -1.361 -13.808 -0.008 41 HB1 ALA 37 HB1 ALA 4 0.261 -15.103 1.313 42 HB2 ALA 37 HB2 ALA 4 0.356 -13.775 2.501 43 HB3 ALA 37 HB3 ALA 4 -1.173 -14.662 2.256 44 H ASP 38 H ASP 5 0.215 -11.001 1.460 45 HA ASP 38 HA ASP 5 -2.070 -10.021 2.932 46 HB2 ASP 38 HB2 ASP 5 0.221 -9.309 3.422 47 HB3 ASP 38 HB3 ASP 5 0.373 -8.615 1.803 48 H LEU 39 H LEU 6 -0.777 -9.438 -0.375 49 HA LEU 39 HA LEU 6 -2.522 -7.394 -1.154 50 HB2 LEU 39 HB2 LEU 6 -0.477 -8.018 -2.390 51 HB3 LEU 39 HB3 LEU 6 -1.155 -9.561 -2.842 52 HG LEU 39 HG LEU 6 -2.613 -7.046 -3.663 53 HD11 LEU 39 HD11 LEU 6 -0.190 -8.197 -5.105 54 HD12 LEU 39 HD12 LEU 6 -1.256 -6.909 -5.715 55 HD13 LEU 39 HD13 LEU 6 -0.270 -6.628 -4.275 56 HD21 LEU 39 HD21 LEU 6 -2.279 -9.779 -4.973 57 HD22 LEU 39 HD22 LEU 6 -3.768 -9.110 -4.258 58 HD23 LEU 39 HD23 LEU 6 -3.109 -8.403 -5.720 59 H VAL 40 H VAL 7 -2.699 -10.928 -1.764 60 HA VAL 40 HA VAL 7 -5.190 -10.742 -3.088 61 HB VAL 40 HB VAL 7 -5.237 -13.187 -2.971 62 HG11 VAL 40 HG11 VAL 7 -2.386 -12.241 -3.462 63 HG12 VAL 40 HG12 VAL 7 -3.225 -13.602 -4.210 64 HG13 VAL 40 HG13 VAL 7 -3.727 -11.948 -4.564 65 HG21 VAL 40 HG21 VAL 7 -4.549 -13.651 -0.698 66 HG22 VAL 40 HG22 VAL 7 -3.385 -14.417 -1.781 67 HG23 VAL 40 HG23 VAL 7 -2.974 -12.901 -0.997 68 H SER 41 H SER 8 -4.438 -11.335 0.395 69 HA SER 41 HA SER 8 -7.129 -11.802 1.150 70 HB2 SER 41 HB2 SER 8 -4.847 -10.655 2.812 71 HB3 SER 41 HB3 SER 8 -6.364 -11.333 3.439 72 HG SER 41 HG SER 8 -4.180 -12.612 2.199 73 H LYS 42 H LYS 9 -5.255 -8.649 1.205 74 HA LYS 42 HA LYS 9 -7.536 -7.182 2.253 75 HB2 LYS 42 HB2 LYS 9 -4.937 -6.384 0.874 76 HB3 LYS 42 HB3 LYS 9 -6.188 -5.192 1.258 77 HG2 LYS 42 HG2 LYS 9 -6.155 -5.831 3.633 78 HG3 LYS 42 HG3 LYS 9 -4.899 -7.050 3.294 79 HD2 LYS 42 HD2 LYS 9 -3.300 -5.356 2.654 80 HD3 LYS 42 HD3 LYS 9 -4.530 -4.094 2.685 81 HE2 LYS 42 HE2 LYS 9 -3.089 -3.938 4.639 82 HE3 LYS 42 HE3 LYS 9 -4.761 -4.256 5.106 83 HZ1 LYS 42 HZ1 LYS 9 -2.690 -6.385 4.919 84 HZ2 LYS 42 HZ2 LYS 9 -3.056 -5.601 6.316 85 HZ3 LYS 42 HZ3 LYS 9 -4.184 -6.528 5.585 86 H MET 43 H MET 10 -6.399 -7.810 -1.151 87 HA MET 43 HA MET 10 -8.419 -6.046 -2.236 88 HB2 MET 43 HB2 MET 10 -6.756 -8.250 -3.499 89 HB3 MET 43 HB3 MET 10 -7.905 -7.238 -4.393 90 HG2 MET 43 HG2 MET 10 -6.687 -5.202 -3.484 91 HG3 MET 43 HG3 MET 10 -5.429 -6.301 -2.903 92 HE1 MET 43 HE1 MET 10 -3.846 -4.426 -6.068 93 HE2 MET 43 HE2 MET 10 -4.801 -3.824 -4.698 94 HE3 MET 43 HE3 MET 10 -3.455 -4.966 -4.428 95 H LEU 44 H LEU 11 -8.332 -9.632 -1.716 96 HA LEU 44 HA LEU 11 -10.913 -10.340 -2.575 97 HB2 LEU 44 HB2 LEU 11 -9.307 -11.989 -1.757 98 HB3 LEU 44 HB3 LEU 11 -9.185 -11.177 -0.211 99 HG LEU 44 HG LEU 11 -11.576 -11.808 0.265 100 HD11 LEU 44 HD11 LEU 11 -12.445 -13.734 -1.030 101 HD12 LEU 44 HD12 LEU 11 -12.303 -12.272 -2.033 102 HD13 LEU 44 HD13 LEU 11 -11.093 -13.573 -2.177 103 HD21 LEU 44 HD21 LEU 11 -10.978 -14.137 0.858 104 HD22 LEU 44 HD22 LEU 11 -9.501 -13.983 -0.110 105 HD23 LEU 44 HD23 LEU 11 -9.722 -12.960 1.308 106 H ARG 45 H ARG 12 -9.933 -9.241 0.667 107 HA ARG 45 HA ARG 12 -12.459 -8.938 1.849 108 HB2 ARG 45 HB2 ARG 12 -10.565 -8.963 3.165 109 HB3 ARG 45 HB3 ARG 12 -9.708 -7.766 2.236 110 HG2 ARG 45 HG2 ARG 12 -12.188 -6.900 3.699 111 HG3 ARG 45 HG3 ARG 12 -10.698 -7.211 4.581 112 HD2 ARG 45 HD2 ARG 12 -9.571 -5.613 2.791 113 HD3 ARG 45 HD3 ARG 12 -11.247 -5.023 2.598 114 HE ARG 45 HE ARG 12 -10.489 -5.357 5.350 115 HH11 ARG 45 HH11 ARG 12 -9.914 -3.005 2.726 116 HH12 ARG 45 HH12 ARG 12 -9.781 -1.672 3.816 117 HH21 ARG 45 HH21 ARG 12 -10.455 -3.720 6.685 118 HH22 ARG 45 HH22 ARG 12 -10.042 -2.082 6.205 119 H ALA 46 H ALA 13 -10.635 -6.468 -0.088 120 HA ALA 46 HA ALA 13 -12.580 -4.487 0.439 121 HB1 ALA 46 HB1 ALA 13 -10.279 -3.982 -0.380 122 HB2 ALA 46 HB2 ALA 13 -10.668 -4.725 -1.953 123 HB3 ALA 46 HB3 ALA 13 -11.505 -3.248 -1.432 124 H VAL 47 H VAL 14 -12.339 -6.836 -2.288 125 HA VAL 47 HA VAL 14 -14.594 -5.818 -3.745 126 HB VAL 47 HB VAL 14 -13.460 -8.648 -3.505 127 HG11 VAL 47 HG11 VAL 14 -15.794 -8.721 -4.337 128 HG12 VAL 47 HG12 VAL 14 -15.364 -7.552 -5.602 129 HG13 VAL 47 HG13 VAL 14 -14.614 -9.171 -5.570 130 HG21 VAL 47 HG21 VAL 14 -12.489 -8.099 -5.760 131 HG22 VAL 47 HG22 VAL 14 -13.078 -6.436 -5.592 132 HG23 VAL 47 HG23 VAL 14 -11.845 -7.074 -4.488 133 H LEU 48 H LEU 15 -14.316 -8.247 -1.094 134 HA LEU 48 HA LEU 15 -17.075 -8.899 -1.002 135 HB2 LEU 48 HB2 LEU 15 -14.915 -8.937 1.168 136 HB3 LEU 48 HB3 LEU 15 -16.492 -9.679 1.340 137 HG LEU 48 HG LEU 15 -14.700 -10.474 -0.981 138 HD11 LEU 48 HD11 LEU 15 -13.380 -10.737 1.046 139 HD12 LEU 48 HD12 LEU 15 -14.731 -11.538 1.874 140 HD13 LEU 48 HD13 LEU 15 -13.935 -12.340 0.497 141 HD21 LEU 48 HD21 LEU 15 -16.779 -12.010 0.597 142 HD22 LEU 48 HD22 LEU 15 -17.151 -11.158 -0.907 143 HD23 LEU 48 HD23 LEU 15 -15.988 -12.501 -0.906 144 H GLN 49 H GLN 16 -15.261 -6.266 0.672 145 HA GLN 49 HA GLN 16 -17.474 -5.469 2.317 146 HB2 GLN 49 HB2 GLN 16 -14.973 -4.004 1.386 147 HB3 GLN 49 HB3 GLN 16 -16.166 -3.237 2.413 148 HG2 GLN 49 HG2 GLN 16 -14.651 -5.769 3.159 149 HG3 GLN 49 HG3 GLN 16 -14.210 -4.148 3.649 150 HE21 GLN 49 HE22 GLN 16 -14.431 -5.611 5.778 151 HE22 GLN 49 HE21 GLN 16 -15.976 -5.406 6.595 152 H SER 50 H SER 17 -16.432 -4.415 -0.997 153 HA SER 50 HA SER 17 -18.518 -2.490 -1.298 154 HB2 SER 50 HB2 SER 17 -17.111 -4.203 -3.393 155 HB3 SER 50 HB3 SER 17 -18.055 -2.738 -3.707 156 HG SER 50 HG SER 17 -15.814 -2.257 -3.574 157 H HIS 51 H HIS 18 -18.375 -6.009 -1.854 158 HA HIS 51 HA HIS 18 -21.056 -6.032 -3.048 159 HB2 HIS 51 HB2 HIS 18 -18.888 -8.138 -2.826 160 HB3 HIS 51 HB3 HIS 18 -20.446 -8.356 -3.618 161 HD2 HIS 51 HD2 HIS 18 -18.785 -8.907 -5.761 162 HE1 HIS 51 HE1 HIS 18 -18.117 -4.845 -6.787 163 HE2 HIS 51 HE2 HIS 18 -17.964 -7.233 -7.631 164 H LYS 52 H LYS 19 -21.806 -5.351 -0.741 165 HA LYS 52 HA LYS 19 -21.761 -7.137 1.441 166 HB2 LYS 52 HB2 LYS 19 -23.843 -5.055 0.620 167 HB3 LYS 52 HB3 LYS 19 -23.861 -5.872 2.172 168 HG2 LYS 52 HG2 LYS 19 -21.608 -4.081 1.163 169 HG3 LYS 52 HG3 LYS 19 -22.868 -3.648 2.322 170 HD2 LYS 52 HD2 LYS 19 -22.027 -5.582 3.794 171 HD3 LYS 52 HD3 LYS 19 -20.616 -5.667 2.717 172 HE2 LYS 52 HE2 LYS 19 -20.171 -3.229 3.120 173 HE3 LYS 52 HE3 LYS 19 -21.589 -3.153 4.175 174 HZ1 LYS 52 HZ1 LYS 19 -19.049 -4.600 4.722 175 HZ2 LYS 52 HZ2 LYS 19 -19.689 -3.356 5.535 176 HZ3 LYS 52 HZ3 LYS 19 -20.426 -4.807 5.631 177 H ASN 53 H ASN 20 -23.809 -7.339 -1.414 178 HA ASN 53 HA ASN 20 -25.764 -9.137 -0.326 179 HB2 ASN 53 HB2 ASN 20 -25.998 -7.870 -2.475 180 HB3 ASN 53 HB3 ASN 20 -24.730 -8.869 -3.184 181 HD21 ASN 53 HD22 ASN 20 -27.972 -9.153 -1.548 182 HD22 ASN 53 HD21 ASN 20 -28.470 -10.549 -2.475 183 H GLY 54 H GLY 21 -22.408 -9.627 -0.868 184 HA2 GLY 54 HA2 GLY 21 -21.140 -11.454 -0.511 185 HA3 GLY 54 HA3 GLY 21 -22.563 -12.509 -0.433 186 H ILE 55 H ILE 22 -20.411 -13.368 -1.848 187 HA ILE 55 HA ILE 22 -21.378 -13.376 -4.651 188 HB ILE 55 HB ILE 22 -18.763 -13.319 -5.184 189 HG12 ILE 55 HG12 ILE 22 -18.880 -11.518 -2.708 190 HG13 ILE 55 HG13 ILE 22 -17.927 -12.982 -2.899 191 HG21 ILE 55 HG21 ILE 22 -20.120 -10.656 -4.699 192 HG22 ILE 55 HG22 ILE 22 -18.976 -11.148 -5.992 193 HG23 ILE 55 HG23 ILE 22 -20.629 -11.756 -5.991 194 HD11 ILE 55 HD11 ILE 22 -17.583 -10.273 -4.262 195 HD12 ILE 55 HD12 ILE 22 -16.447 -11.101 -3.198 196 HD13 ILE 55 HD13 ILE 22 -16.722 -11.716 -4.836 197 H VAL 56 H VAL 23 -21.649 -15.340 -5.286 198 HA VAL 56 HA VAL 23 -21.032 -17.618 -3.707 199 HB VAL 56 HB VAL 23 -21.710 -18.868 -5.766 200 HG11 VAL 56 HG11 VAL 23 -23.570 -16.632 -4.851 201 HG12 VAL 56 HG12 VAL 23 -24.065 -18.073 -5.758 202 HG13 VAL 56 HG13 VAL 23 -23.384 -18.259 -4.147 203 HG21 VAL 56 HG21 VAL 23 -22.620 -17.684 -7.703 204 HG22 VAL 56 HG22 VAL 23 -22.174 -16.109 -7.025 205 HG23 VAL 56 HG23 VAL 23 -20.917 -17.273 -7.502 206 H LEU 57 H LEU 24 -19.375 -19.245 -3.960 207 HA LEU 57 HA LEU 24 -16.920 -18.274 -4.297 208 HB2 LEU 57 HB2 LEU 24 -15.885 -20.308 -4.160 209 HB3 LEU 57 HB3 LEU 24 -17.310 -20.349 -3.176 210 HG LEU 57 HG LEU 24 -17.070 -21.616 -5.955 211 HD11 LEU 57 HD11 LEU 24 -15.562 -22.689 -4.377 212 HD12 LEU 57 HD12 LEU 24 -16.877 -22.924 -3.213 213 HD13 LEU 57 HD13 LEU 24 -16.897 -23.768 -4.771 214 HD21 LEU 57 HD21 LEU 24 -19.197 -22.151 -3.832 215 HD22 LEU 57 HD22 LEU 24 -19.475 -21.168 -5.272 216 HD23 LEU 57 HD23 LEU 24 -19.084 -22.877 -5.438 217 HA PRO 58 HA PRO 25 -16.051 -19.131 -8.862 218 HB2 PRO 58 HB2 PRO 25 -18.047 -19.126 -10.733 219 HB3 PRO 58 HB3 PRO 25 -17.483 -20.603 -9.903 220 HG2 PRO 58 HG2 PRO 25 -19.906 -18.913 -9.231 221 HG3 PRO 58 HG3 PRO 25 -19.801 -20.689 -9.393 222 HD2 PRO 58 HD2 PRO 25 -19.674 -19.485 -6.968 223 HD3 PRO 58 HD3 PRO 25 -18.696 -20.924 -7.357 224 H ARG 59 H ARG 26 -18.946 -17.132 -8.157 225 HA ARG 59 HA ARG 26 -18.231 -14.881 -9.822 226 HB2 ARG 59 HB2 ARG 26 -20.519 -15.437 -8.898 227 HB3 ARG 59 HB3 ARG 26 -19.953 -14.931 -7.294 228 HG2 ARG 59 HG2 ARG 26 -19.532 -12.657 -8.180 229 HG3 ARG 59 HG3 ARG 26 -19.982 -13.211 -9.811 230 HD2 ARG 59 HD2 ARG 26 -22.296 -13.704 -8.950 231 HD3 ARG 59 HD3 ARG 26 -21.833 -13.050 -7.389 232 HE ARG 59 HE ARG 26 -21.746 -10.894 -8.248 233 HH11 ARG 59 HH11 ARG 26 -22.504 -13.140 -10.913 234 HH12 ARG 59 HH12 ARG 26 -23.028 -11.895 -11.979 235 HH21 ARG 59 HH21 ARG 26 -22.491 -9.256 -9.672 236 HH22 ARG 59 HH22 ARG 26 -23.049 -9.656 -11.255 237 H LEU 60 H LEU 27 -17.444 -15.923 -6.524 238 HA LEU 60 HA LEU 27 -16.153 -13.637 -5.597 239 HB2 LEU 60 HB2 LEU 27 -16.602 -15.694 -4.246 240 HB3 LEU 60 HB3 LEU 27 -15.336 -16.559 -5.086 241 HG LEU 60 HG LEU 27 -14.733 -15.775 -2.841 242 HD11 LEU 60 HD11 LEU 27 -13.004 -16.330 -4.561 243 HD12 LEU 60 HD12 LEU 27 -12.857 -14.586 -4.914 244 HD13 LEU 60 HD13 LEU 27 -12.485 -15.197 -3.306 245 HD21 LEU 60 HD21 LEU 27 -15.867 -13.570 -3.003 246 HD22 LEU 60 HD22 LEU 27 -14.247 -13.505 -2.344 247 HD23 LEU 60 HD23 LEU 27 -14.520 -12.984 -4.024 248 H GLN 61 H GLN 28 -14.697 -16.415 -7.481 249 HA GLN 61 HA GLN 28 -12.143 -15.248 -7.801 250 HB2 GLN 61 HB2 GLN 28 -13.704 -17.252 -9.470 251 HB3 GLN 61 HB3 GLN 28 -12.184 -16.597 -10.061 252 HG2 GLN 61 HG2 GLN 28 -11.053 -17.352 -7.972 253 HG3 GLN 61 HG3 GLN 28 -12.547 -18.170 -7.490 254 HE21 GLN 61 HE22 GLN 28 -9.548 -18.537 -9.314 255 HE22 GLN 61 HE21 GLN 28 -9.998 -19.998 -10.120 256 H GLY 62 H GLY 29 -15.056 -14.853 -9.924 257 HA2 GLY 62 HA2 GLY 29 -13.743 -13.354 -11.927 258 HA3 GLY 62 HA3 GLY 29 -15.475 -13.284 -11.556 259 H GLU 63 H GLU 30 -15.587 -12.126 -9.055 260 HA GLU 63 HA GLU 30 -15.068 -9.367 -9.756 261 HB2 GLU 63 HB2 GLU 30 -16.062 -10.650 -7.182 262 HB3 GLU 63 HB3 GLU 30 -16.026 -8.914 -7.489 263 HG2 GLU 63 HG2 GLU 30 -17.623 -10.962 -9.084 264 HG3 GLU 63 HG3 GLU 30 -18.255 -9.851 -7.880 265 H TYR 64 H TYR 31 -13.591 -11.656 -7.438 266 HA TYR 64 HA TYR 31 -11.622 -10.021 -6.235 267 HB2 TYR 64 HB2 TYR 31 -11.969 -12.273 -5.477 268 HB3 TYR 64 HB3 TYR 31 -11.700 -12.921 -7.093 269 HD1 TYR 64 HD2 TYR 31 -9.538 -13.223 -8.085 270 HD2 TYR 64 HD1 TYR 31 -9.987 -11.644 -4.095 271 HE1 TYR 64 HE2 TYR 31 -7.154 -13.586 -7.676 272 HE2 TYR 64 HE1 TYR 31 -7.587 -12.073 -3.658 273 HH TYR 64 HH TYR 31 -5.414 -13.469 -6.205 274 H ARG 65 H ARG 32 -11.426 -11.943 -9.281 275 HA ARG 65 HA ARG 32 -8.831 -11.057 -9.954 276 HB2 ARG 65 HB2 ARG 32 -9.840 -13.066 -10.848 277 HB3 ARG 65 HB3 ARG 32 -11.048 -12.134 -11.754 278 HG2 ARG 65 HG2 ARG 32 -9.410 -11.210 -13.232 279 HG3 ARG 65 HG3 ARG 32 -8.078 -11.597 -12.128 280 HD2 ARG 65 HD2 ARG 32 -8.646 -14.034 -12.468 281 HD3 ARG 65 HD3 ARG 32 -9.666 -13.529 -13.833 282 HE ARG 65 HE ARG 32 -6.731 -13.213 -13.466 283 HH11 ARG 65 HH21 ARG 32 -9.469 -13.210 -15.734 284 HH12 ARG 65 HH22 ARG 32 -8.494 -13.089 -17.156 285 HH21 ARG 65 HH11 ARG 32 -5.414 -13.110 -15.361 286 HH22 ARG 65 HH12 ARG 32 -6.129 -13.043 -16.934 287 H SER 66 H SER 33 -12.034 -9.672 -10.715 288 HA SER 66 HA SER 33 -11.112 -7.777 -12.608 289 HB2 SER 66 HB2 SER 33 -13.439 -7.536 -10.653 290 HB3 SER 66 HB3 SER 33 -13.162 -6.522 -12.067 291 HG SER 66 HG SER 33 -13.595 -9.351 -12.080 292 H LEU 67 H LEU 34 -11.006 -7.713 -8.989 293 HA LEU 67 HA LEU 34 -9.803 -5.031 -9.091 294 HB2 LEU 67 HB2 LEU 34 -11.213 -5.682 -7.190 295 HB3 LEU 67 HB3 LEU 34 -10.061 -6.957 -6.758 296 HG LEU 67 HG LEU 34 -8.320 -5.271 -6.309 297 HD11 LEU 67 HD11 LEU 34 -8.903 -2.838 -6.215 298 HD12 LEU 67 HD12 LEU 34 -8.885 -3.456 -7.863 299 HD13 LEU 67 HD13 LEU 34 -10.441 -3.203 -7.036 300 HD21 LEU 67 HD21 LEU 34 -10.945 -4.590 -4.922 301 HD22 LEU 67 HD22 LEU 34 -9.858 -5.922 -4.499 302 HD23 LEU 67 HD23 LEU 34 -9.306 -4.250 -4.314 303 H THR 68 H THR 35 -8.491 -8.392 -8.352 304 HA THR 68 HA THR 35 -5.889 -7.307 -7.704 305 HB THR 68 HB THR 35 -5.273 -9.773 -7.761 306 HG1 THR 68 HG1 THR 35 -7.194 -11.166 -7.941 307 HG21 THR 68 HG21 THR 35 -7.767 -9.139 -6.139 308 HG22 THR 68 HG22 THR 35 -6.520 -10.366 -5.804 309 HG23 THR 68 HG23 THR 35 -6.097 -8.677 -5.701 310 H GLY 69 H GLY 36 -7.328 -8.666 -10.668 311 HA2 GLY 69 HA2 GLY 36 -6.477 -8.856 -12.793 312 HA3 GLY 69 HA3 GLY 36 -4.943 -8.120 -12.275 313 H ASP 70 H ASP 37 -6.308 -10.832 -10.381 314 HA ASP 70 HA ASP 37 -4.486 -12.804 -11.637 315 HB2 ASP 70 HB2 ASP 37 -3.334 -11.560 -9.704 316 HB3 ASP 70 HB3 ASP 37 -4.528 -12.301 -8.629 317 H TRP 71 H TRP 38 -4.979 -15.028 -10.682 318 HA TRP 71 HA TRP 38 -7.861 -15.369 -10.133 319 HB2 TRP 71 HB2 TRP 38 -5.596 -17.325 -10.704 320 HB3 TRP 71 HB3 TRP 38 -7.228 -17.819 -10.296 321 HD1 TRP 71 HD1 TRP 38 -5.184 -17.408 -13.201 322 HE1 TRP 71 HE1 TRP 38 -6.526 -17.171 -15.354 323 HE3 TRP 71 HE3 TRP 38 -9.761 -16.329 -11.163 324 HZ2 TRP 71 HZ2 TRP 38 -9.265 -16.523 -16.112 325 HZ3 TRP 71 HZ3 TRP 38 -11.656 -15.754 -12.621 326 HH2 TRP 71 HH2 TRP 38 -11.456 -15.906 -15.096 327 H ILE 72 H ILE 39 -8.444 -16.624 -8.210 328 HA ILE 72 HA ILE 39 -7.179 -15.895 -5.801 329 HB ILE 72 HB ILE 39 -9.056 -18.138 -6.581 330 HG12 ILE 72 HG12 ILE 39 -9.816 -15.688 -6.542 331 HG13 ILE 72 HG13 ILE 39 -10.789 -16.859 -5.666 332 HG21 ILE 72 HG21 ILE 39 -9.472 -18.525 -4.114 333 HG22 ILE 72 HG22 ILE 39 -7.938 -19.115 -4.744 334 HG23 ILE 72 HG23 ILE 39 -7.978 -17.618 -3.792 335 HD11 ILE 72 HD11 ILE 39 -10.414 -14.643 -4.523 336 HD12 ILE 72 HD12 ILE 39 -10.102 -16.091 -3.572 337 HD13 ILE 72 HD13 ILE 39 -8.737 -15.147 -4.245 338 HA PRO 73 HA PRO 40 -3.752 -18.715 -6.269 339 HB2 PRO 73 HB2 PRO 40 -2.144 -17.974 -4.243 340 HB3 PRO 73 HB3 PRO 40 -2.604 -16.802 -5.496 341 HG2 PRO 73 HG2 PRO 40 -3.987 -17.236 -2.817 342 HG3 PRO 73 HG3 PRO 40 -3.306 -15.720 -3.481 343 HD2 PRO 73 HD2 PRO 40 -5.944 -16.405 -3.741 344 HD3 PRO 73 HD3 PRO 40 -5.065 -15.521 -5.030 345 H PHE 74 H PHE 41 -6.081 -20.084 -5.293 346 HA PHE 74 HA PHE 41 -5.841 -20.943 -2.560 347 HB2 PHE 74 HB2 PHE 41 -7.570 -22.505 -2.971 348 HB3 PHE 74 HB3 PHE 41 -8.008 -20.999 -3.712 349 HD1 PHE 74 HD2 PHE 41 -7.720 -20.815 -6.344 350 HD2 PHE 74 HD1 PHE 41 -7.543 -24.528 -4.155 351 HE1 PHE 74 HE2 PHE 41 -8.220 -22.060 -8.420 352 HE2 PHE 74 HE1 PHE 41 -8.108 -25.773 -6.233 353 HZ PHE 74 HZ PHE 41 -8.449 -24.537 -8.367 354 H LYS 75 H LYS 42 -5.271 -22.842 -5.552 355 HA LYS 75 HA LYS 42 -4.036 -25.000 -4.099 356 HB2 LYS 75 HB2 LYS 42 -5.339 -25.013 -6.294 357 HB3 LYS 75 HB3 LYS 42 -3.909 -24.337 -7.078 358 HG2 LYS 75 HG2 LYS 42 -2.602 -26.352 -6.417 359 HG3 LYS 75 HG3 LYS 42 -4.012 -26.983 -5.529 360 HD2 LYS 75 HD2 LYS 42 -5.291 -27.131 -7.616 361 HD3 LYS 75 HD3 LYS 42 -3.923 -26.440 -8.533 362 HE2 LYS 75 HE2 LYS 42 -2.506 -28.369 -7.845 363 HE3 LYS 75 HE3 LYS 42 -3.861 -29.048 -6.935 364 HZ1 LYS 75 HZ1 LYS 42 -5.068 -29.282 -9.040 365 HZ2 LYS 75 HZ2 LYS 42 -3.815 -28.650 -9.881 366 HZ3 LYS 75 HZ3 LYS 42 -3.644 -30.077 -9.121 367 H GLN 76 H GLN 43 -2.926 -22.050 -5.545 368 HA GLN 76 HA GLN 43 -0.163 -22.678 -5.919 369 HB2 GLN 76 HB2 GLN 43 -1.556 -19.969 -5.620 370 HB3 GLN 76 HB3 GLN 43 0.029 -20.277 -6.302 371 HG2 GLN 76 HG2 GLN 43 -1.148 -20.061 -8.234 372 HG3 GLN 76 HG3 GLN 43 -1.298 -21.795 -8.046 373 HE21 GLN 76 HE22 GLN 43 -3.115 -19.463 -9.312 374 HE22 GLN 76 HE21 GLN 43 -4.685 -19.798 -8.591 375 H LEU 77 H LEU 44 -2.061 -21.145 -3.245 376 HA LEU 77 HA LEU 44 0.281 -20.951 -1.482 377 HB2 LEU 77 HB2 LEU 44 -2.672 -20.465 -1.082 378 HB3 LEU 77 HB3 LEU 44 -1.485 -20.353 0.220 379 HG LEU 77 HG LEU 44 -1.418 -18.680 -2.321 380 HD11 LEU 77 HD11 LEU 44 -2.252 -17.827 0.487 381 HD12 LEU 77 HD12 LEU 44 -2.219 -16.813 -0.970 382 HD13 LEU 77 HD13 LEU 44 -3.373 -18.147 -0.858 383 HD21 LEU 77 HD21 LEU 44 0.227 -18.472 0.239 384 HD22 LEU 77 HD22 LEU 44 0.832 -18.863 -1.386 385 HD23 LEU 77 HD23 LEU 44 0.194 -17.254 -1.056 386 H GLY 78 H GLY 45 -2.308 -23.293 -2.138 387 HA2 GLY 78 HA2 GLY 45 -1.531 -25.594 -1.837 388 HA3 GLY 78 HA3 GLY 45 -0.926 -25.156 -0.240 389 H TYR 79 H TYR 46 -3.972 -23.695 -1.040 390 HA TYR 79 HA TYR 46 -5.441 -25.362 0.872 391 HB2 TYR 79 HB2 TYR 46 -6.393 -23.112 -0.948 392 HB3 TYR 79 HB3 TYR 46 -7.257 -23.805 0.411 393 HD1 TYR 79 HD2 TYR 46 -6.224 -23.604 2.763 394 HD2 TYR 79 HD1 TYR 46 -4.852 -21.307 -0.616 395 HE1 TYR 79 HE2 TYR 46 -5.120 -22.040 4.290 396 HE2 TYR 79 HE1 TYR 46 -3.770 -19.704 0.893 397 HH TYR 79 HH TYR 46 -3.805 -20.076 4.487 398 HA PRO 80 HA PRO 47 -6.370 -28.005 -2.543 399 HB2 PRO 80 HB2 PRO 47 -8.627 -29.398 -1.716 400 HB3 PRO 80 HB3 PRO 47 -6.998 -29.646 -1.031 401 HG2 PRO 80 HG2 PRO 47 -9.206 -27.855 0.053 402 HG3 PRO 80 HG3 PRO 47 -8.263 -29.100 0.937 403 HD2 PRO 80 HD2 PRO 47 -7.494 -26.512 1.066 404 HD3 PRO 80 HD3 PRO 47 -6.263 -27.785 0.840 405 H THR 81 H THR 48 -9.035 -25.870 -1.440 406 HA THR 81 HA THR 48 -10.084 -25.759 -4.218 407 HB THR 81 HB THR 48 -12.365 -25.926 -3.041 408 HG1 THR 81 HG1 THR 48 -12.104 -27.015 -0.895 409 HG21 THR 81 HG21 THR 48 -11.299 -27.936 -4.175 410 HG22 THR 81 HG22 THR 48 -10.696 -28.430 -2.579 411 HG23 THR 81 HG23 THR 48 -12.441 -28.313 -2.871 412 H LEU 82 H LEU 49 -11.668 -23.967 -4.458 413 HA LEU 82 HA LEU 49 -10.713 -21.445 -3.475 414 HB2 LEU 82 HB2 LEU 49 -13.415 -22.322 -4.636 415 HB3 LEU 82 HB3 LEU 49 -13.073 -20.673 -4.194 416 HG LEU 82 HG LEU 49 -12.882 -20.879 -6.559 417 HD11 LEU 82 HD11 LEU 49 -10.580 -20.075 -6.936 418 HD12 LEU 82 HD12 LEU 49 -11.295 -19.348 -5.474 419 HD13 LEU 82 HD13 LEU 49 -10.087 -20.656 -5.352 420 HD21 LEU 82 HD21 LEU 49 -12.363 -23.309 -6.717 421 HD22 LEU 82 HD22 LEU 49 -11.334 -22.305 -7.737 422 HD23 LEU 82 HD23 LEU 49 -10.677 -22.957 -6.235 423 H GLU 83 H GLU 50 -13.395 -23.609 -2.402 424 HA GLU 83 HA GLU 50 -14.252 -21.837 -0.363 425 HB2 GLU 83 HB2 GLU 50 -15.479 -23.606 0.592 426 HB3 GLU 83 HB3 GLU 50 -15.581 -23.756 -1.159 427 HG2 GLU 83 HG2 GLU 50 -13.931 -25.595 -1.113 428 HG3 GLU 83 HG3 GLU 50 -13.775 -25.427 0.639 429 H ALA 84 H ALA 51 -11.702 -24.444 -0.246 430 HA ALA 84 HA ALA 51 -11.218 -24.148 2.538 431 HB1 ALA 84 HB1 ALA 51 -9.336 -25.036 0.329 432 HB2 ALA 84 HB2 ALA 51 -9.088 -25.272 2.077 433 HB3 ALA 84 HB3 ALA 51 -10.446 -26.066 1.260 434 H TYR 85 H TYR 52 -9.717 -22.440 -0.257 435 HA TYR 85 HA TYR 52 -7.917 -20.816 1.232 436 HB2 TYR 85 HB2 TYR 52 -7.769 -20.875 -1.130 437 HB3 TYR 85 HB3 TYR 52 -9.445 -20.391 -1.351 438 HD1 TYR 85 HD1 TYR 52 -6.097 -19.171 -0.222 439 HD2 TYR 85 HD2 TYR 52 -10.098 -18.101 -1.435 440 HE1 TYR 85 HE1 TYR 52 -5.404 -16.804 -0.335 441 HE2 TYR 85 HE2 TYR 52 -9.442 -15.730 -1.506 442 HH TYR 85 HH TYR 52 -7.649 -14.181 -1.386 443 H LEU 86 H LEU 53 -11.397 -20.246 0.391 444 HA LEU 86 HA LEU 53 -11.547 -17.770 1.809 445 HB2 LEU 86 HB2 LEU 53 -13.683 -19.743 0.920 446 HB3 LEU 86 HB3 LEU 53 -14.017 -18.128 1.550 447 HG LEU 86 HG LEU 53 -12.202 -18.453 -0.839 448 HD11 LEU 86 HD11 LEU 53 -14.128 -19.688 -1.526 449 HD12 LEU 86 HD12 LEU 53 -15.223 -18.487 -0.831 450 HD13 LEU 86 HD13 LEU 53 -14.234 -18.092 -2.275 451 HD21 LEU 86 HD21 LEU 53 -12.916 -16.207 -1.331 452 HD22 LEU 86 HD22 LEU 53 -14.102 -16.230 0.002 453 HD23 LEU 86 HD23 LEU 53 -12.352 -16.254 0.342 454 H ARG 87 H ARG 54 -12.196 -21.107 2.899 455 HA ARG 87 HA ARG 54 -13.181 -20.496 5.552 456 HB2 ARG 87 HB2 ARG 54 -11.526 -22.850 4.514 457 HB3 ARG 87 HB3 ARG 54 -11.819 -22.633 6.215 458 HG2 ARG 87 HG2 ARG 54 -13.347 -24.211 5.604 459 HG3 ARG 87 HG3 ARG 54 -14.300 -22.732 5.800 460 HD2 ARG 87 HD2 ARG 54 -14.526 -22.525 3.373 461 HD3 ARG 87 HD3 ARG 54 -13.206 -23.672 3.157 462 HE ARG 87 HE ARG 54 -14.656 -25.251 2.855 463 HH11 ARG 87 HH21 ARG 54 -16.067 -23.462 5.619 464 HH12 ARG 87 HH22 ARG 54 -17.494 -24.427 5.648 465 HH21 ARG 87 HH11 ARG 54 -16.577 -26.339 2.794 466 HH22 ARG 87 HH12 ARG 54 -17.748 -26.187 4.087 467 H SER 88 H SER 55 -9.898 -20.535 4.214 468 HA SER 88 HA SER 55 -8.604 -20.445 6.778 469 HB2 SER 88 HB2 SER 55 -7.497 -20.123 3.972 470 HB3 SER 88 HB3 SER 55 -6.570 -20.427 5.458 471 HG SER 88 HG SER 55 -8.425 -22.127 4.141 472 H VAL 89 H VAL 56 -10.302 -17.925 5.673 473 HA VAL 89 HA VAL 56 -8.365 -15.959 6.791 474 HB VAL 89 HB VAL 56 -8.217 -15.769 4.445 475 HG11 VAL 89 HG11 VAL 56 -10.052 -16.756 3.463 476 HG12 VAL 89 HG12 VAL 56 -11.230 -15.801 4.363 477 HG13 VAL 89 HG13 VAL 56 -10.274 -15.054 3.060 478 HG21 VAL 89 HG21 VAL 56 -9.930 -13.397 5.187 479 HG22 VAL 89 HG22 VAL 56 -8.258 -13.627 5.750 480 HG23 VAL 89 HG23 VAL 56 -8.611 -13.499 4.018 481 HA PRO 90 HA PRO 57 -12.796 -16.053 8.446 482 HB2 PRO 90 HB2 PRO 57 -12.587 -17.071 10.966 483 HB3 PRO 90 HB3 PRO 57 -12.652 -18.100 9.499 484 HG2 PRO 90 HG2 PRO 57 -10.199 -17.218 11.049 485 HG3 PRO 90 HG3 PRO 57 -10.621 -18.864 10.475 486 HD2 PRO 90 HD2 PRO 57 -8.937 -17.186 9.081 487 HD3 PRO 90 HD3 PRO 57 -10.004 -18.369 8.298 488 H ALA 91 H ALA 58 -9.807 -14.711 9.708 489 HA ALA 91 HA ALA 58 -11.107 -12.977 11.668 490 HB1 ALA 91 HB1 ALA 58 -8.789 -13.815 11.980 491 HB2 ALA 91 HB2 ALA 58 -8.274 -12.935 10.517 492 HB3 ALA 91 HB3 ALA 58 -8.844 -12.044 11.940 493 H VAL 92 H VAL 59 -10.882 -12.854 8.264 494 HA VAL 92 HA VAL 59 -11.298 -9.896 8.267 495 HB VAL 92 HB VAL 59 -9.626 -11.415 6.242 496 HG11 VAL 92 HG11 VAL 59 -10.560 -9.294 5.439 497 HG12 VAL 92 HG12 VAL 59 -9.846 -8.427 6.811 498 HG13 VAL 92 HG13 VAL 59 -8.804 -9.195 5.591 499 HG21 VAL 92 HG21 VAL 59 -7.611 -10.357 7.278 500 HG22 VAL 92 HG22 VAL 59 -8.624 -9.816 8.634 501 HG23 VAL 92 HG23 VAL 59 -8.360 -11.554 8.329 502 H VAL 93 H VAL 60 -12.258 -13.042 7.096 503 HA VAL 93 HA VAL 60 -14.277 -11.871 5.266 504 HB VAL 93 HB VAL 60 -12.141 -13.950 4.803 505 HG11 VAL 93 HG11 VAL 60 -14.498 -13.610 2.927 506 HG12 VAL 93 HG12 VAL 60 -13.024 -14.546 2.617 507 HG13 VAL 93 HG13 VAL 60 -14.110 -15.056 3.896 508 HG21 VAL 93 HG21 VAL 60 -11.751 -12.571 2.709 509 HG22 VAL 93 HG22 VAL 60 -12.919 -11.402 3.360 510 HG23 VAL 93 HG23 VAL 60 -11.417 -11.741 4.229 511 H ARG 94 H ARG 61 -15.944 -13.567 4.770 512 HA ARG 94 HA ARG 61 -16.503 -15.468 6.974 513 HB2 ARG 94 HB2 ARG 61 -17.492 -13.437 7.805 514 HB3 ARG 94 HB3 ARG 61 -18.164 -13.026 6.233 515 HG2 ARG 94 HG2 ARG 61 -19.751 -14.960 6.411 516 HG3 ARG 94 HG3 ARG 61 -19.018 -15.381 7.975 517 HD2 ARG 94 HD2 ARG 61 -21.032 -14.213 8.448 518 HD3 ARG 94 HD3 ARG 61 -19.719 -13.109 8.817 519 HE ARG 94 HE ARG 61 -20.173 -11.845 6.834 520 HH11 ARG 94 HH21 ARG 61 -22.521 -14.540 7.116 521 HH12 ARG 94 HH22 ARG 61 -23.790 -13.659 6.337 522 HH21 ARG 94 HH11 ARG 61 -21.938 -10.669 5.889 523 HH22 ARG 94 HH12 ARG 61 -23.400 -11.491 5.503 524 H ILE 95 H ILE 62 -18.129 -17.034 6.249 525 HA ILE 95 HA ILE 62 -18.959 -16.843 3.438 526 HB ILE 95 HB ILE 62 -18.257 -19.166 3.005 527 HG12 ILE 95 HG12 ILE 62 -16.666 -18.952 5.579 528 HG13 ILE 95 HG13 ILE 62 -18.027 -20.039 5.256 529 HG21 ILE 95 HG21 ILE 62 -16.859 -17.126 2.310 530 HG22 ILE 95 HG22 ILE 62 -15.786 -17.506 3.675 531 HG23 ILE 95 HG23 ILE 62 -16.026 -18.675 2.349 532 HD11 ILE 95 HD11 ILE 62 -15.279 -20.142 3.949 533 HD12 ILE 95 HD12 ILE 62 -15.989 -21.274 5.105 534 HD13 ILE 95 HD13 ILE 62 -16.678 -21.146 3.469 535 H GLU 96 H GLU 63 -20.811 -18.079 2.997 536 HA GLU 96 HA GLU 63 -22.086 -19.527 5.275 537 HB2 GLU 96 HB2 GLU 63 -23.472 -17.721 3.243 538 HB3 GLU 96 HB3 GLU 63 -24.250 -18.645 4.517 539 HG2 GLU 96 HG2 GLU 63 -22.348 -16.291 4.888 540 HG3 GLU 96 HG3 GLU 63 -24.090 -16.247 5.041 541 H ALA 97 H ALA 64 -21.583 -21.568 4.544 542 HA ALA 97 HA ALA 64 -21.953 -22.371 1.744 543 HB1 ALA 97 HB1 ALA 64 -20.254 -23.489 3.123 544 HB2 ALA 97 HB2 ALA 64 -21.515 -24.019 4.273 545 HB3 ALA 97 HB3 ALA 64 -21.508 -24.624 2.601 546 H SER 98 H SER 65 -23.880 -22.833 0.884 547 HA SER 98 HA SER 65 -26.324 -22.769 2.485 548 HB2 SER 98 HB2 SER 65 -26.222 -21.697 0.276 549 HB3 SER 98 HB3 SER 65 -25.762 -23.231 -0.483 550 HG SER 98 HG SER 65 -28.081 -22.614 -0.548 551 H ARG 99 H ARG 66 -27.770 -24.537 2.534 552 HA ARG 99 HA ARG 66 -26.650 -27.183 2.827 553 HB2 ARG 99 HB2 ARG 66 -28.889 -27.950 3.220 554 HB3 ARG 99 HB3 ARG 66 -28.584 -26.468 4.096 555 HG2 ARG 99 HG2 ARG 66 -30.753 -26.239 3.384 556 HG3 ARG 99 HG3 ARG 66 -29.882 -25.235 2.228 557 HD2 ARG 99 HD2 ARG 66 -30.182 -26.867 0.470 558 HD3 ARG 99 HD3 ARG 66 -30.623 -28.122 1.629 559 HE ARG 99 HE ARG 66 -32.730 -27.195 1.965 560 HH11 ARG 99 HH11 ARG 66 -31.025 -25.408 -0.643 561 HH12 ARG 99 HH12 ARG 66 -32.462 -24.619 -1.174 562 HH21 ARG 99 HH21 ARG 66 -34.599 -26.156 1.204 563 HH22 ARG 99 HH22 ARG 66 -34.531 -25.064 -0.126 564 H SER 100 H SER 67 -27.852 -25.413 0.037 565 HA SER 100 HA SER 67 -28.283 -27.688 -1.643 566 HB2 SER 100 HB2 SER 67 -27.498 -24.867 -2.460 567 HB3 SER 100 HB3 SER 67 -28.405 -26.057 -3.409 568 HG SER 100 HG SER 67 -29.745 -24.458 -2.422 569 H GLY 101 H GLY 68 -25.335 -26.362 -0.371 570 HA2 GLY 101 HA2 GLY 68 -23.290 -27.438 -0.625 571 HA3 GLY 101 HA3 GLY 68 -23.743 -28.021 -2.234 572 H GLU 102 H GLU 69 -24.668 -24.821 -2.289 573 HA GLU 102 HA GLU 69 -22.204 -23.878 -3.597 574 HB2 GLU 102 HB2 GLU 69 -24.868 -22.526 -2.912 575 HB3 GLU 102 HB3 GLU 69 -23.542 -21.735 -3.756 576 HG2 GLU 102 HG2 GLU 69 -25.127 -24.148 -4.743 577 HG3 GLU 102 HG3 GLU 69 -25.272 -22.492 -5.318 578 H ILE 103 H ILE 70 -21.293 -21.744 -2.750 579 HA ILE 103 HA ILE 70 -21.791 -21.217 0.063 580 HB ILE 103 HB ILE 70 -20.018 -22.574 0.493 581 HG12 ILE 103 HG12 ILE 70 -19.791 -20.197 1.397 582 HG13 ILE 103 HG13 ILE 70 -18.445 -21.306 1.567 583 HG21 ILE 103 HG21 ILE 70 -18.392 -21.571 -1.810 584 HG22 ILE 103 HG22 ILE 70 -17.828 -22.683 -0.555 585 HG23 ILE 103 HG23 ILE 70 -19.134 -23.188 -1.626 586 HD11 ILE 103 HD11 ILE 70 -18.487 -19.348 -0.765 587 HD12 ILE 103 HD12 ILE 70 -17.909 -18.891 0.824 588 HD13 ILE 103 HD13 ILE 70 -17.119 -20.217 -0.047 589 H VAL 104 H VAL 71 -21.755 -19.147 0.542 590 HA VAL 104 HA VAL 71 -21.220 -17.225 -1.663 591 HB VAL 104 HB VAL 71 -23.109 -16.862 0.705 592 HG11 VAL 104 HG11 VAL 71 -22.413 -14.827 -0.526 593 HG12 VAL 104 HG12 VAL 71 -22.981 -15.549 -2.054 594 HG13 VAL 104 HG13 VAL 71 -24.134 -15.157 -0.762 595 HG21 VAL 104 HG21 VAL 71 -25.005 -17.406 -0.840 596 HG22 VAL 104 HG22 VAL 71 -23.830 -18.050 -2.002 597 HG23 VAL 104 HG23 VAL 71 -24.031 -18.819 -0.425 598 H CYS 105 H CYS 72 -19.746 -15.647 -1.215 599 HA CYS 105 HA CYS 72 -18.296 -15.849 1.366 600 HB2 CYS 105 HB2 CYS 72 -17.412 -14.371 -1.130 601 HB3 CYS 105 HB3 CYS 72 -16.403 -15.058 0.156 602 HG CYS 105 HG CYS 72 -18.159 -16.498 -2.270 603 H TYR 106 H TYR 73 -17.762 -13.984 2.571 604 HA TYR 106 HA TYR 73 -19.021 -11.377 1.876 605 HB2 TYR 106 HB2 TYR 73 -19.428 -13.052 4.392 606 HB3 TYR 106 HB3 TYR 73 -19.872 -11.353 4.270 607 HD1 TYR 106 HD1 TYR 73 -21.572 -10.622 2.519 608 HD2 TYR 106 HD2 TYR 73 -20.858 -14.764 3.572 609 HE1 TYR 106 HE1 TYR 73 -23.863 -11.168 1.836 610 HE2 TYR 106 HE2 TYR 73 -23.111 -15.359 2.729 611 HH TYR 106 HH TYR 73 -25.186 -14.539 1.942 612 H ALA 107 H ALA 74 -18.290 -9.719 3.587 613 HA ALA 107 HA ALA 74 -15.398 -10.140 4.161 614 HB1 ALA 107 HB1 ALA 74 -17.104 -7.616 4.388 615 HB2 ALA 107 HB2 ALA 74 -15.330 -7.741 4.517 616 HB3 ALA 107 HB3 ALA 74 -16.123 -8.049 2.977 617 H VAL 108 H VAL 75 -14.648 -9.275 6.250 618 HA VAL 108 HA VAL 75 -16.645 -9.013 8.414 619 HB VAL 108 HB VAL 75 -14.995 -11.358 8.057 620 HG11 VAL 108 HG11 VAL 75 -14.065 -11.715 10.248 621 HG12 VAL 108 HG12 VAL 75 -13.305 -10.297 9.516 622 HG13 VAL 108 HG13 VAL 75 -14.535 -10.097 10.775 623 HG21 VAL 108 HG21 VAL 75 -16.414 -12.266 9.800 624 HG22 VAL 108 HG22 VAL 75 -16.933 -10.636 10.283 625 HG23 VAL 108 HG23 VAL 75 -17.398 -11.291 8.696 626 H ALA 109 H ALA 76 -13.397 -8.250 7.167 627 HA ALA 109 HA ALA 76 -13.378 -5.899 8.903 628 HB1 ALA 109 HB1 ALA 76 -12.128 -7.659 10.242 629 HB2 ALA 109 HB2 ALA 76 -10.983 -7.793 8.882 630 HB3 ALA 109 HB3 ALA 76 -11.144 -6.269 9.771 Start of MODEL 4 1 H1 GLY -2 H1 GLY -2 6.305 1.373 1.030 2 H2 GLY -2 H2 GLY -2 5.205 1.457 -0.176 3 H3 GLY -2 H3 GLY -2 4.744 0.954 1.323 4 HA2 GLY -2 HA2 GLY -2 6.594 -0.473 -0.476 5 HA3 GLY -2 HA3 GLY -2 6.130 -1.017 1.140 6 H HIS -1 H HIS -1 5.624 -1.850 -1.911 7 HA HIS -1 HA HIS -1 2.745 -2.007 -2.162 8 HB2 HIS -1 HB2 HIS -1 4.399 -2.114 -4.041 9 HB3 HIS -1 HB3 HIS -1 4.877 -3.712 -3.471 10 HD2 HIS -1 HD2 HIS -1 3.754 -5.535 -4.881 11 HE1 HIS -1 HE1 HIS -1 -0.023 -3.724 -5.658 12 HE2 HIS -1 HE2 HIS -1 1.422 -5.784 -6.072 13 H MET 34 H MET 1 1.469 -4.021 -2.036 14 HA MET 34 HA MET 1 1.856 -5.404 0.449 15 HB2 MET 34 HB2 MET 1 0.054 -5.983 -1.941 16 HB3 MET 34 HB3 MET 1 0.012 -6.859 -0.403 17 HG2 MET 34 HG2 MET 1 -1.531 -5.400 0.241 18 HG3 MET 34 HG3 MET 1 -0.203 -4.282 0.477 19 HE1 MET 34 HE1 MET 1 -3.442 -5.203 -1.369 20 HE2 MET 34 HE2 MET 1 -3.496 -4.121 -2.779 21 HE3 MET 34 HE3 MET 1 -2.411 -5.516 -2.782 22 H LEU 35 H LEU 2 2.375 -7.568 0.851 23 HA LEU 35 HA LEU 2 4.228 -8.939 -0.994 24 HB2 LEU 35 HB2 LEU 2 2.997 -9.837 1.657 25 HB3 LEU 35 HB3 LEU 2 4.266 -10.679 0.774 26 HG LEU 35 HG LEU 2 4.529 -7.933 2.073 27 HD11 LEU 35 HD11 LEU 2 5.758 -10.625 2.809 28 HD12 LEU 35 HD12 LEU 2 6.036 -9.074 3.630 29 HD13 LEU 35 HD13 LEU 2 4.430 -9.815 3.673 30 HD21 LEU 35 HD21 LEU 2 6.600 -9.591 0.565 31 HD22 LEU 35 HD22 LEU 2 5.966 -7.988 0.103 32 HD23 LEU 35 HD23 LEU 2 6.958 -8.156 1.551 33 H GLU 36 H GLU 3 3.639 -11.392 -1.479 34 HA GLU 36 HA GLU 3 1.407 -11.276 -3.150 35 HB2 GLU 36 HB2 GLU 3 3.285 -12.812 -3.490 36 HB3 GLU 36 HB3 GLU 3 2.798 -13.760 -2.080 37 HG2 GLU 36 HG2 GLU 3 0.697 -14.402 -3.171 38 HG3 GLU 36 HG3 GLU 3 1.047 -13.346 -4.536 39 H ALA 37 H ALA 4 1.571 -13.151 -0.119 40 HA ALA 37 HA ALA 4 -1.167 -13.896 -0.308 41 HB1 ALA 37 HB1 ALA 4 0.423 -15.178 1.058 42 HB2 ALA 37 HB2 ALA 4 0.541 -13.819 2.209 43 HB3 ALA 37 HB3 ALA 4 -1.001 -14.689 1.993 44 H ASP 38 H ASP 5 0.434 -11.131 1.225 45 HA ASP 38 HA ASP 5 -1.831 -10.144 2.681 46 HB2 ASP 38 HB2 ASP 5 0.533 -9.502 3.102 47 HB3 ASP 38 HB3 ASP 5 0.559 -8.648 1.551 48 H LEU 39 H LEU 6 -0.603 -9.533 -0.620 49 HA LEU 39 HA LEU 6 -2.374 -7.453 -1.353 50 HB2 LEU 39 HB2 LEU 6 -0.361 -8.050 -2.651 51 HB3 LEU 39 HB3 LEU 6 -1.021 -9.611 -3.057 52 HG LEU 39 HG LEU 6 -2.733 -7.285 -3.832 53 HD11 LEU 39 HD11 LEU 6 -0.492 -6.395 -4.329 54 HD12 LEU 39 HD12 LEU 6 -0.114 -7.860 -5.270 55 HD13 LEU 39 HD13 LEU 6 -1.388 -6.746 -5.813 56 HD21 LEU 39 HD21 LEU 6 -1.854 -9.801 -5.295 57 HD22 LEU 39 HD22 LEU 6 -3.435 -9.501 -4.547 58 HD23 LEU 39 HD23 LEU 6 -2.950 -8.568 -5.952 59 H VAL 40 H VAL 7 -2.561 -11.004 -1.993 60 HA VAL 40 HA VAL 7 -5.072 -10.706 -3.271 61 HB VAL 40 HB VAL 7 -5.161 -13.129 -3.311 62 HG11 VAL 40 HG11 VAL 7 -3.139 -13.555 -4.534 63 HG12 VAL 40 HG12 VAL 7 -3.581 -11.877 -4.820 64 HG13 VAL 40 HG13 VAL 7 -2.264 -12.260 -3.711 65 HG21 VAL 40 HG21 VAL 7 -4.432 -13.659 -1.000 66 HG22 VAL 40 HG22 VAL 7 -3.505 -14.555 -2.202 67 HG23 VAL 40 HG23 VAL 7 -2.797 -13.129 -1.424 68 H SER 41 H SER 8 -4.243 -11.425 0.144 69 HA SER 41 HA SER 8 -6.924 -11.878 0.988 70 HB2 SER 41 HB2 SER 8 -4.564 -10.794 2.585 71 HB3 SER 41 HB3 SER 8 -6.054 -11.480 3.248 72 HG SER 41 HG SER 8 -3.926 -12.729 1.890 73 H LYS 42 H LYS 9 -5.020 -8.762 0.853 74 HA LYS 42 HA LYS 9 -7.181 -7.228 2.015 75 HB2 LYS 42 HB2 LYS 9 -4.679 -6.549 0.444 76 HB3 LYS 42 HB3 LYS 9 -5.894 -5.303 0.779 77 HG2 LYS 42 HG2 LYS 9 -5.756 -5.627 3.155 78 HG3 LYS 42 HG3 LYS 9 -4.729 -7.064 2.963 79 HD2 LYS 42 HD2 LYS 9 -2.943 -5.729 1.969 80 HD3 LYS 42 HD3 LYS 9 -3.909 -4.243 2.146 81 HE2 LYS 42 HE2 LYS 9 -3.829 -4.380 4.559 82 HE3 LYS 42 HE3 LYS 9 -3.226 -6.044 4.503 83 HZ1 LYS 42 HZ1 LYS 9 -1.178 -5.262 3.549 84 HZ2 LYS 42 HZ2 LYS 9 -1.677 -3.683 3.602 85 HZ3 LYS 42 HZ3 LYS 9 -1.445 -4.524 4.992 86 H MET 43 H MET 10 -6.257 -7.916 -1.376 87 HA MET 43 HA MET 10 -8.260 -6.233 -2.538 88 HB2 MET 43 HB2 MET 10 -6.891 -8.752 -3.578 89 HB3 MET 43 HB3 MET 10 -7.844 -7.640 -4.567 90 HG2 MET 43 HG2 MET 10 -5.534 -6.498 -2.971 91 HG3 MET 43 HG3 MET 10 -5.180 -7.487 -4.361 92 HE1 MET 43 HE1 MET 10 -4.423 -4.321 -6.253 93 HE2 MET 43 HE2 MET 10 -3.789 -5.024 -4.755 94 HE3 MET 43 HE3 MET 10 -4.152 -6.073 -6.142 95 H LEU 44 H LEU 11 -8.282 -9.747 -1.732 96 HA LEU 44 HA LEU 11 -10.921 -10.440 -2.344 97 HB2 LEU 44 HB2 LEU 11 -9.234 -12.057 -1.587 98 HB3 LEU 44 HB3 LEU 11 -9.035 -11.213 -0.064 99 HG LEU 44 HG LEU 11 -11.408 -11.810 0.536 100 HD11 LEU 44 HD11 LEU 11 -11.033 -13.670 -1.861 101 HD12 LEU 44 HD12 LEU 11 -12.389 -13.727 -0.710 102 HD13 LEU 44 HD13 LEU 11 -12.176 -12.313 -1.772 103 HD21 LEU 44 HD21 LEU 11 -10.809 -14.176 1.097 104 HD22 LEU 44 HD22 LEU 11 -9.337 -13.970 0.121 105 HD23 LEU 44 HD23 LEU 11 -9.586 -12.978 1.560 106 H ARG 45 H ARG 12 -9.715 -9.252 0.815 107 HA ARG 45 HA ARG 12 -12.145 -8.928 2.161 108 HB2 ARG 45 HB2 ARG 12 -10.186 -8.869 3.360 109 HB3 ARG 45 HB3 ARG 12 -9.376 -7.762 2.298 110 HG2 ARG 45 HG2 ARG 12 -11.597 -6.799 4.110 111 HG3 ARG 45 HG3 ARG 12 -9.919 -6.951 4.629 112 HD2 ARG 45 HD2 ARG 12 -9.425 -5.545 2.400 113 HD3 ARG 45 HD3 ARG 12 -11.073 -4.960 2.711 114 HE ARG 45 HE ARG 12 -8.635 -4.274 4.039 115 HH11 ARG 45 HH11 ARG 12 -11.961 -4.987 5.025 116 HH12 ARG 45 HH12 ARG 12 -11.958 -3.942 6.339 117 HH21 ARG 45 HH21 ARG 12 -8.661 -2.729 5.755 118 HH22 ARG 45 HH22 ARG 12 -10.088 -2.514 6.702 119 H ALA 46 H ALA 13 -10.525 -6.518 0.000 120 HA ALA 46 HA ALA 13 -12.504 -4.565 0.585 121 HB1 ALA 46 HB1 ALA 13 -10.233 -4.032 -0.324 122 HB2 ALA 46 HB2 ALA 13 -10.671 -4.808 -1.867 123 HB3 ALA 46 HB3 ALA 13 -11.507 -3.330 -1.340 124 H VAL 47 H VAL 14 -12.273 -6.905 -2.194 125 HA VAL 47 HA VAL 14 -14.555 -5.830 -3.552 126 HB VAL 47 HB VAL 14 -13.372 -8.650 -3.572 127 HG11 VAL 47 HG11 VAL 14 -14.558 -8.991 -5.682 128 HG12 VAL 47 HG12 VAL 14 -15.714 -8.725 -4.379 129 HG13 VAL 47 HG13 VAL 14 -15.355 -7.407 -5.522 130 HG21 VAL 47 HG21 VAL 14 -12.463 -7.847 -5.794 131 HG22 VAL 47 HG22 VAL 14 -13.091 -6.237 -5.438 132 HG23 VAL 47 HG23 VAL 14 -11.816 -6.955 -4.422 133 H LEU 48 H LEU 15 -14.212 -8.305 -0.991 134 HA LEU 48 HA LEU 15 -16.958 -9.072 -0.936 135 HB2 LEU 48 HB2 LEU 15 -14.811 -9.009 1.249 136 HB3 LEU 48 HB3 LEU 15 -16.363 -9.780 1.441 137 HG LEU 48 HG LEU 15 -14.514 -10.598 -0.828 138 HD11 LEU 48 HD11 LEU 15 -13.779 -12.406 0.737 139 HD12 LEU 48 HD12 LEU 15 -13.282 -10.770 1.251 140 HD13 LEU 48 HD13 LEU 15 -14.654 -11.572 2.045 141 HD21 LEU 48 HD21 LEU 15 -16.718 -12.059 0.683 142 HD22 LEU 48 HD22 LEU 15 -16.895 -11.374 -0.942 143 HD23 LEU 48 HD23 LEU 15 -15.762 -12.716 -0.637 144 H GLN 49 H GLN 16 -15.203 -6.379 0.738 145 HA GLN 49 HA GLN 16 -17.497 -5.636 2.316 146 HB2 GLN 49 HB2 GLN 16 -14.983 -4.131 1.485 147 HB3 GLN 49 HB3 GLN 16 -16.238 -3.381 2.461 148 HG2 GLN 49 HG2 GLN 16 -14.729 -5.905 3.269 149 HG3 GLN 49 HG3 GLN 16 -14.327 -4.272 3.782 150 HE21 GLN 49 HE22 GLN 16 -14.632 -5.815 5.842 151 HE22 GLN 49 HE21 GLN 16 -16.209 -5.631 6.609 152 H SER 50 H SER 17 -16.329 -4.546 -0.942 153 HA SER 50 HA SER 17 -18.341 -2.585 -1.329 154 HB2 SER 50 HB2 SER 17 -16.986 -4.394 -3.376 155 HB3 SER 50 HB3 SER 17 -17.830 -2.875 -3.714 156 HG SER 50 HG SER 17 -15.586 -2.487 -3.552 157 H HIS 51 H HIS 18 -18.385 -6.115 -1.787 158 HA HIS 51 HA HIS 18 -21.048 -5.989 -3.048 159 HB2 HIS 51 HB2 HIS 18 -18.945 -8.152 -2.916 160 HB3 HIS 51 HB3 HIS 18 -20.519 -8.315 -3.693 161 HD2 HIS 51 HD2 HIS 18 -18.743 -8.813 -5.823 162 HE1 HIS 51 HE1 HIS 18 -18.257 -4.717 -6.813 163 HE2 HIS 51 HE2 HIS 18 -17.990 -7.085 -7.669 164 H LYS 52 H LYS 19 -21.766 -5.356 -0.714 165 HA LYS 52 HA LYS 19 -21.761 -7.132 1.443 166 HB2 LYS 52 HB2 LYS 19 -23.812 -5.033 0.599 167 HB3 LYS 52 HB3 LYS 19 -23.879 -5.861 2.148 168 HG2 LYS 52 HG2 LYS 19 -21.574 -4.104 1.205 169 HG3 LYS 52 HG3 LYS 19 -22.864 -3.649 2.324 170 HD2 LYS 52 HD2 LYS 19 -22.100 -5.617 3.803 171 HD3 LYS 52 HD3 LYS 19 -20.654 -5.706 2.784 172 HE2 LYS 52 HE2 LYS 19 -20.201 -3.273 3.234 173 HE3 LYS 52 HE3 LYS 19 -21.648 -3.196 4.239 174 HZ1 LYS 52 HZ1 LYS 19 -20.552 -4.875 5.718 175 HZ2 LYS 52 HZ2 LYS 19 -19.153 -4.682 4.845 176 HZ3 LYS 52 HZ3 LYS 19 -19.785 -3.431 5.656 177 H ASN 53 H ASN 20 -23.866 -7.310 -1.390 178 HA ASN 53 HA ASN 20 -25.821 -9.080 -0.270 179 HB2 ASN 53 HB2 ASN 20 -26.077 -7.845 -2.427 180 HB3 ASN 53 HB3 ASN 20 -24.805 -8.850 -3.140 181 HD21 ASN 53 HD22 ASN 20 -28.049 -9.131 -1.496 182 HD22 ASN 53 HD21 ASN 20 -28.535 -10.536 -2.410 183 H GLY 54 H GLY 21 -22.469 -9.637 -0.870 184 HA2 GLY 54 HA2 GLY 21 -21.254 -11.498 -0.475 185 HA3 GLY 54 HA3 GLY 21 -22.700 -12.526 -0.465 186 H ILE 55 H ILE 22 -20.474 -13.314 -1.834 187 HA ILE 55 HA ILE 22 -21.392 -13.352 -4.646 188 HB ILE 55 HB ILE 22 -18.809 -13.176 -5.197 189 HG12 ILE 55 HG12 ILE 22 -18.903 -11.492 -2.640 190 HG13 ILE 55 HG13 ILE 22 -17.889 -12.891 -2.964 191 HG21 ILE 55 HG21 ILE 22 -20.753 -11.638 -5.910 192 HG22 ILE 55 HG22 ILE 22 -20.200 -10.556 -4.626 193 HG23 ILE 55 HG23 ILE 22 -19.107 -11.011 -5.970 194 HD11 ILE 55 HD11 ILE 22 -16.841 -11.449 -4.862 195 HD12 ILE 55 HD12 ILE 22 -17.749 -10.098 -4.172 196 HD13 ILE 55 HD13 ILE 22 -16.531 -10.906 -3.201 197 H VAL 56 H VAL 23 -21.617 -15.345 -5.234 198 HA VAL 56 HA VAL 23 -20.882 -17.559 -3.642 199 HB VAL 56 HB VAL 23 -21.534 -18.867 -5.696 200 HG11 VAL 56 HG11 VAL 23 -23.908 -18.194 -5.628 201 HG12 VAL 56 HG12 VAL 23 -23.184 -18.291 -4.018 202 HG13 VAL 56 HG13 VAL 23 -23.476 -16.703 -4.768 203 HG21 VAL 56 HG21 VAL 23 -22.117 -16.134 -6.957 204 HG22 VAL 56 HG22 VAL 23 -20.826 -17.248 -7.443 205 HG23 VAL 56 HG23 VAL 23 -22.506 -17.724 -7.620 206 H LEU 57 H LEU 24 -19.188 -19.269 -3.992 207 HA LEU 57 HA LEU 24 -16.790 -18.075 -4.259 208 HB2 LEU 57 HB2 LEU 24 -15.598 -19.947 -3.962 209 HB3 LEU 57 HB3 LEU 24 -17.119 -20.260 -3.224 210 HG LEU 57 HG LEU 24 -17.719 -21.705 -5.268 211 HD11 LEU 57 HD11 LEU 24 -16.238 -21.196 -7.069 212 HD12 LEU 57 HD12 LEU 24 -14.843 -21.023 -5.995 213 HD13 LEU 57 HD13 LEU 24 -15.505 -22.621 -6.403 214 HD21 LEU 57 HD21 LEU 24 -16.979 -22.696 -3.176 215 HD22 LEU 57 HD22 LEU 24 -16.253 -23.581 -4.500 216 HD23 LEU 57 HD23 LEU 24 -15.285 -22.411 -3.569 217 HA PRO 58 HA PRO 25 -15.921 -18.901 -8.832 218 HB2 PRO 58 HB2 PRO 25 -17.951 -18.987 -10.672 219 HB3 PRO 58 HB3 PRO 25 -17.277 -20.429 -9.857 220 HG2 PRO 58 HG2 PRO 25 -19.786 -18.890 -9.140 221 HG3 PRO 58 HG3 PRO 25 -19.562 -20.665 -9.275 222 HD2 PRO 58 HD2 PRO 25 -19.494 -19.381 -6.883 223 HD3 PRO 58 HD3 PRO 25 -18.456 -20.787 -7.219 224 H ARG 59 H ARG 26 -18.839 -16.994 -8.017 225 HA ARG 59 HA ARG 26 -18.192 -14.720 -9.716 226 HB2 ARG 59 HB2 ARG 26 -20.469 -15.358 -8.848 227 HB3 ARG 59 HB3 ARG 26 -19.954 -14.826 -7.228 228 HG2 ARG 59 HG2 ARG 26 -19.590 -12.551 -8.108 229 HG3 ARG 59 HG3 ARG 26 -19.990 -13.120 -9.744 230 HD2 ARG 59 HD2 ARG 26 -22.301 -13.686 -8.941 231 HD3 ARG 59 HD3 ARG 26 -21.891 -13.043 -7.357 232 HE ARG 59 HE ARG 26 -21.848 -10.865 -8.174 233 HH11 ARG 59 HH21 ARG 26 -22.526 -13.092 -10.875 234 HH12 ARG 59 HH22 ARG 26 -23.107 -11.845 -11.922 235 HH21 ARG 59 HH11 ARG 26 -22.649 -9.234 -9.569 236 HH22 ARG 59 HH12 ARG 26 -23.170 -9.618 -11.167 237 H LEU 60 H LEU 27 -17.401 -15.752 -6.406 238 HA LEU 60 HA LEU 27 -16.192 -13.381 -5.491 239 HB2 LEU 60 HB2 LEU 27 -16.651 -15.348 -4.033 240 HB3 LEU 60 HB3 LEU 27 -15.433 -16.295 -4.845 241 HG LEU 60 HG LEU 27 -14.814 -15.421 -2.639 242 HD11 LEU 60 HD11 LEU 27 -13.157 -16.225 -4.318 243 HD12 LEU 60 HD12 LEU 27 -12.849 -14.519 -4.757 244 HD13 LEU 60 HD13 LEU 27 -12.548 -15.085 -3.112 245 HD21 LEU 60 HD21 LEU 27 -14.109 -13.161 -2.326 246 HD22 LEU 60 HD22 LEU 27 -14.405 -12.732 -4.024 247 HD23 LEU 60 HD23 LEU 27 -15.747 -13.131 -2.932 248 H GLN 61 H GLN 28 -14.693 -16.252 -7.124 249 HA GLN 61 HA GLN 28 -12.157 -15.130 -7.598 250 HB2 GLN 61 HB2 GLN 28 -13.841 -17.266 -8.875 251 HB3 GLN 61 HB3 GLN 28 -12.483 -16.673 -9.819 252 HG2 GLN 61 HG2 GLN 28 -12.025 -17.453 -6.933 253 HG3 GLN 61 HG3 GLN 28 -12.236 -18.714 -8.146 254 HE21 GLN 61 HE22 GLN 28 -10.245 -19.490 -8.943 255 HE22 GLN 61 HE21 GLN 28 -8.827 -18.504 -9.163 256 H GLY 62 H GLY 29 -15.094 -14.910 -9.708 257 HA2 GLY 62 HA2 GLY 29 -13.963 -13.500 -11.822 258 HA3 GLY 62 HA3 GLY 29 -15.646 -13.343 -11.292 259 H GLU 63 H GLU 30 -15.710 -11.980 -9.038 260 HA GLU 63 HA GLU 30 -15.071 -9.322 -9.907 261 HB2 GLU 63 HB2 GLU 30 -16.094 -10.415 -7.246 262 HB3 GLU 63 HB3 GLU 30 -16.007 -8.700 -7.642 263 HG2 GLU 63 HG2 GLU 30 -17.644 -10.754 -9.194 264 HG3 GLU 63 HG3 GLU 30 -18.273 -9.661 -7.970 265 H TYR 64 H TYR 31 -13.585 -11.494 -7.485 266 HA TYR 64 HA TYR 31 -11.642 -9.738 -6.382 267 HB2 TYR 64 HB2 TYR 31 -11.912 -11.874 -5.386 268 HB3 TYR 64 HB3 TYR 31 -11.734 -12.702 -6.934 269 HD1 TYR 64 HD2 TYR 31 -9.668 -13.162 -7.994 270 HD2 TYR 64 HD1 TYR 31 -9.827 -11.111 -4.199 271 HE1 TYR 64 HE2 TYR 31 -7.258 -13.509 -7.702 272 HE2 TYR 64 HE1 TYR 31 -7.391 -11.515 -3.898 273 HH TYR 64 HH TYR 31 -5.400 -13.093 -6.461 274 H ARG 65 H ARG 32 -11.515 -11.853 -9.313 275 HA ARG 65 HA ARG 32 -8.875 -11.038 -9.956 276 HB2 ARG 65 HB2 ARG 32 -9.976 -13.180 -10.603 277 HB3 ARG 65 HB3 ARG 32 -10.923 -12.311 -11.819 278 HG2 ARG 65 HG2 ARG 32 -8.008 -11.739 -11.932 279 HG3 ARG 65 HG3 ARG 32 -8.379 -13.447 -12.090 280 HD2 ARG 65 HD2 ARG 32 -9.880 -12.942 -13.986 281 HD3 ARG 65 HD3 ARG 32 -9.477 -11.211 -13.826 282 HE ARG 65 HE ARG 32 -7.096 -12.730 -13.929 283 HH11 ARG 65 HH11 ARG 32 -9.738 -11.852 -16.134 284 HH12 ARG 65 HH12 ARG 32 -8.773 -11.905 -17.565 285 HH21 ARG 65 HH21 ARG 32 -5.786 -12.782 -15.837 286 HH22 ARG 65 HH22 ARG 32 -6.477 -12.459 -17.385 287 H SER 66 H SER 33 -12.069 -9.684 -10.916 288 HA SER 66 HA SER 33 -11.086 -7.859 -12.849 289 HB2 SER 66 HB2 SER 33 -13.293 -7.397 -10.801 290 HB3 SER 66 HB3 SER 33 -13.065 -6.511 -12.312 291 HG SER 66 HG SER 33 -13.569 -8.375 -13.468 292 H LEU 67 H LEU 34 -11.073 -7.664 -9.219 293 HA LEU 67 HA LEU 34 -9.997 -4.972 -9.323 294 HB2 LEU 67 HB2 LEU 34 -11.306 -5.770 -7.385 295 HB3 LEU 67 HB3 LEU 34 -10.036 -6.938 -7.011 296 HG LEU 67 HG LEU 34 -8.419 -5.072 -6.667 297 HD11 LEU 67 HD11 LEU 34 -10.837 -3.261 -7.105 298 HD12 LEU 67 HD12 LEU 34 -9.288 -2.744 -6.396 299 HD13 LEU 67 HD13 LEU 34 -9.339 -3.296 -8.066 300 HD21 LEU 67 HD21 LEU 34 -9.281 -4.299 -4.531 301 HD22 LEU 67 HD22 LEU 34 -10.936 -4.743 -4.990 302 HD23 LEU 67 HD23 LEU 34 -9.698 -5.997 -4.763 303 H THR 68 H THR 35 -8.457 -8.225 -8.600 304 HA THR 68 HA THR 35 -5.890 -7.017 -8.084 305 HB THR 68 HB THR 35 -5.177 -9.488 -8.240 306 HG1 THR 68 HG1 THR 35 -6.972 -10.961 -8.372 307 HG21 THR 68 HG21 THR 35 -5.985 -8.298 -6.163 308 HG22 THR 68 HG22 THR 35 -7.576 -9.080 -6.439 309 HG23 THR 68 HG23 THR 35 -6.109 -10.052 -6.156 310 H GLY 69 H GLY 36 -7.344 -8.666 -10.915 311 HA2 GLY 69 HA2 GLY 36 -6.587 -8.802 -13.103 312 HA3 GLY 69 HA3 GLY 36 -5.096 -7.938 -12.673 313 H ASP 70 H ASP 37 -6.156 -10.607 -10.579 314 HA ASP 70 HA ASP 37 -4.383 -12.595 -11.857 315 HB2 ASP 70 HB2 ASP 37 -3.061 -11.260 -10.071 316 HB3 ASP 70 HB3 ASP 37 -4.183 -11.929 -8.872 317 H TRP 71 H TRP 38 -4.948 -14.774 -11.055 318 HA TRP 71 HA TRP 38 -7.719 -14.966 -10.005 319 HB2 TRP 71 HB2 TRP 38 -5.784 -17.112 -10.971 320 HB3 TRP 71 HB3 TRP 38 -7.469 -17.357 -10.536 321 HD1 TRP 71 HD1 TRP 38 -5.286 -16.531 -13.406 322 HE1 TRP 71 HE1 TRP 38 -6.642 -16.071 -15.518 323 HE3 TRP 71 HE3 TRP 38 -9.890 -15.956 -11.259 324 HZ2 TRP 71 HZ2 TRP 38 -9.412 -15.520 -16.205 325 HZ3 TRP 71 HZ3 TRP 38 -11.848 -15.355 -12.655 326 HH2 TRP 71 HH2 TRP 38 -11.639 -15.193 -15.129 327 H ILE 72 H ILE 39 -8.124 -16.268 -8.070 328 HA ILE 72 HA ILE 39 -6.427 -15.660 -5.949 329 HB ILE 72 HB ILE 39 -8.727 -17.568 -6.272 330 HG12 ILE 72 HG12 ILE 39 -8.127 -15.069 -4.630 331 HG13 ILE 72 HG13 ILE 39 -9.099 -15.181 -6.103 332 HG21 ILE 72 HG21 ILE 39 -7.314 -18.812 -4.748 333 HG22 ILE 72 HG22 ILE 39 -7.127 -17.391 -3.685 334 HG23 ILE 72 HG23 ILE 39 -8.701 -18.187 -3.898 335 HD11 ILE 72 HD11 ILE 39 -10.788 -16.498 -4.920 336 HD12 ILE 72 HD12 ILE 39 -9.849 -16.362 -3.421 337 HD13 ILE 72 HD13 ILE 39 -10.492 -14.902 -4.177 338 HA PRO 73 HA PRO 40 -3.385 -18.869 -6.417 339 HB2 PRO 73 HB2 PRO 40 -1.623 -18.180 -4.474 340 HB3 PRO 73 HB3 PRO 40 -1.941 -17.116 -5.859 341 HG2 PRO 73 HG2 PRO 40 -3.244 -17.012 -3.128 342 HG3 PRO 73 HG3 PRO 40 -2.404 -15.686 -3.999 343 HD2 PRO 73 HD2 PRO 40 -5.125 -16.056 -4.077 344 HD3 PRO 73 HD3 PRO 40 -4.212 -15.441 -5.492 345 H PHE 74 H PHE 41 -5.757 -20.043 -5.376 346 HA PHE 74 HA PHE 41 -5.541 -20.727 -2.565 347 HB2 PHE 74 HB2 PHE 41 -7.369 -22.226 -2.907 348 HB3 PHE 74 HB3 PHE 41 -7.726 -20.697 -3.657 349 HD1 PHE 74 HD2 PHE 41 -7.571 -20.533 -6.265 350 HD2 PHE 74 HD1 PHE 41 -7.420 -24.255 -4.090 351 HE1 PHE 74 HE2 PHE 41 -8.115 -21.762 -8.337 352 HE2 PHE 74 HE1 PHE 41 -8.024 -25.481 -6.165 353 HZ PHE 74 HZ PHE 41 -8.365 -24.240 -8.295 354 H LYS 75 H LYS 42 -5.114 -22.816 -5.448 355 HA LYS 75 HA LYS 42 -3.992 -24.991 -3.962 356 HB2 LYS 75 HB2 LYS 42 -5.205 -24.986 -6.191 357 HB3 LYS 75 HB3 LYS 42 -3.754 -24.309 -6.932 358 HG2 LYS 75 HG2 LYS 42 -2.477 -26.344 -6.250 359 HG3 LYS 75 HG3 LYS 42 -3.929 -26.984 -5.448 360 HD2 LYS 75 HD2 LYS 42 -5.122 -26.996 -7.626 361 HD3 LYS 75 HD3 LYS 42 -3.674 -26.405 -8.447 362 HE2 LYS 75 HE2 LYS 42 -3.859 -29.031 -6.889 363 HE3 LYS 75 HE3 LYS 42 -4.091 -28.880 -8.632 364 HZ1 LYS 75 HZ1 LYS 42 -1.793 -28.074 -8.806 365 HZ2 LYS 75 HZ2 LYS 42 -1.560 -28.277 -7.195 366 HZ3 LYS 75 HZ3 LYS 42 -1.852 -29.563 -8.150 367 H GLN 76 H GLN 43 -2.693 -22.125 -5.408 368 HA GLN 76 HA GLN 43 0.067 -22.899 -5.580 369 HB2 GLN 76 HB2 GLN 43 -1.189 -20.121 -5.584 370 HB3 GLN 76 HB3 GLN 43 0.396 -20.579 -6.175 371 HG2 GLN 76 HG2 GLN 43 -0.709 -20.451 -8.168 372 HG3 GLN 76 HG3 GLN 43 -0.961 -22.155 -7.844 373 HE21 GLN 76 HE22 GLN 43 -2.603 -19.742 -9.300 374 HE22 GLN 76 HE21 GLN 43 -4.215 -19.981 -8.632 375 H LEU 77 H LEU 44 -1.905 -21.089 -3.161 376 HA LEU 77 HA LEU 44 0.277 -20.781 -1.236 377 HB2 LEU 77 HB2 LEU 44 -2.724 -20.475 -1.057 378 HB3 LEU 77 HB3 LEU 44 -1.632 -20.255 0.312 379 HG LEU 77 HG LEU 44 -1.462 -18.612 -2.237 380 HD11 LEU 77 HD11 LEU 44 -3.616 -18.197 -1.066 381 HD12 LEU 77 HD12 LEU 44 -2.726 -17.845 0.435 382 HD13 LEU 77 HD13 LEU 44 -2.541 -16.796 -0.969 383 HD21 LEU 77 HD21 LEU 44 -0.119 -17.059 -0.878 384 HD22 LEU 77 HD22 LEU 44 -0.188 -18.191 0.495 385 HD23 LEU 77 HD23 LEU 44 0.654 -18.635 -1.003 386 H GLY 78 H GLY 45 -2.198 -23.220 -1.992 387 HA2 GLY 78 HA2 GLY 45 -1.420 -25.504 -1.611 388 HA3 GLY 78 HA3 GLY 45 -0.914 -25.035 0.012 389 H TYR 79 H TYR 46 -3.915 -23.586 -0.890 390 HA TYR 79 HA TYR 46 -5.445 -25.307 0.930 391 HB2 TYR 79 HB2 TYR 46 -6.339 -22.983 -0.817 392 HB3 TYR 79 HB3 TYR 46 -7.247 -23.738 0.492 393 HD1 TYR 79 HD2 TYR 46 -6.337 -23.599 2.875 394 HD2 TYR 79 HD1 TYR 46 -4.752 -21.264 -0.380 395 HE1 TYR 79 HE2 TYR 46 -5.225 -22.129 4.483 396 HE2 TYR 79 HE1 TYR 46 -3.641 -19.755 1.224 397 HH TYR 79 HH TYR 46 -3.224 -19.279 3.510 398 HA PRO 80 HA PRO 47 -6.328 -27.802 -2.597 399 HB2 PRO 80 HB2 PRO 47 -8.589 -29.248 -1.833 400 HB3 PRO 80 HB3 PRO 47 -6.952 -29.533 -1.170 401 HG2 PRO 80 HG2 PRO 47 -9.164 -27.797 0.002 402 HG3 PRO 80 HG3 PRO 47 -8.210 -29.075 0.830 403 HD2 PRO 80 HD2 PRO 47 -7.475 -26.487 1.071 404 HD3 PRO 80 HD3 PRO 47 -6.230 -27.735 0.797 405 H THR 81 H THR 48 -8.977 -25.706 -1.420 406 HA THR 81 HA THR 48 -10.042 -25.504 -4.178 407 HB THR 81 HB THR 48 -12.322 -25.694 -3.034 408 HG1 THR 81 HG1 THR 48 -12.073 -26.873 -0.920 409 HG21 THR 81 HG21 THR 48 -10.677 -28.216 -2.612 410 HG22 THR 81 HG22 THR 48 -12.411 -28.083 -2.928 411 HG23 THR 81 HG23 THR 48 -11.250 -27.673 -4.206 412 H LEU 82 H LEU 49 -11.601 -23.662 -4.347 413 HA LEU 82 HA LEU 49 -10.621 -21.228 -3.150 414 HB2 LEU 82 HB2 LEU 49 -13.263 -21.944 -4.531 415 HB3 LEU 82 HB3 LEU 49 -12.979 -20.362 -3.851 416 HG LEU 82 HG LEU 49 -12.598 -20.197 -6.172 417 HD11 LEU 82 HD11 LEU 49 -9.840 -20.281 -4.882 418 HD12 LEU 82 HD12 LEU 49 -10.324 -19.350 -6.293 419 HD13 LEU 82 HD13 LEU 49 -11.021 -18.952 -4.708 420 HD21 LEU 82 HD21 LEU 49 -10.512 -22.408 -6.033 421 HD22 LEU 82 HD22 LEU 49 -12.163 -22.592 -6.678 422 HD23 LEU 82 HD23 LEU 49 -11.017 -21.503 -7.464 423 H GLU 83 H GLU 50 -13.297 -23.470 -2.272 424 HA GLU 83 HA GLU 50 -14.228 -21.792 -0.168 425 HB2 GLU 83 HB2 GLU 50 -15.402 -23.654 0.719 426 HB3 GLU 83 HB3 GLU 50 -15.580 -23.634 -1.027 427 HG2 GLU 83 HG2 GLU 50 -13.977 -25.478 -1.242 428 HG3 GLU 83 HG3 GLU 50 -13.688 -25.472 0.503 429 H ALA 84 H ALA 51 -11.690 -24.422 -0.118 430 HA ALA 84 HA ALA 51 -11.216 -24.218 2.664 431 HB1 ALA 84 HB1 ALA 51 -9.309 -24.993 0.433 432 HB2 ALA 84 HB2 ALA 51 -9.069 -25.285 2.176 433 HB3 ALA 84 HB3 ALA 51 -10.414 -26.073 1.317 434 H TYR 85 H TYR 52 -9.701 -22.415 -0.064 435 HA TYR 85 HA TYR 52 -7.942 -20.835 1.487 436 HB2 TYR 85 HB2 TYR 52 -7.754 -20.838 -0.881 437 HB3 TYR 85 HB3 TYR 52 -9.430 -20.347 -1.114 438 HD1 TYR 85 HD1 TYR 52 -6.151 -19.184 0.265 439 HD2 TYR 85 HD2 TYR 52 -10.018 -18.060 -1.287 440 HE1 TYR 85 HE1 TYR 52 -5.439 -16.830 0.308 441 HE2 TYR 85 HE2 TYR 52 -9.317 -15.685 -1.277 442 HH TYR 85 HH TYR 52 -6.103 -14.616 -0.031 443 H LEU 86 H LEU 53 -11.399 -20.115 0.545 444 HA LEU 86 HA LEU 53 -11.585 -17.746 2.081 445 HB2 LEU 86 HB2 LEU 53 -13.704 -19.729 1.180 446 HB3 LEU 86 HB3 LEU 53 -14.058 -18.148 1.868 447 HG LEU 86 HG LEU 53 -12.271 -18.342 -0.582 448 HD11 LEU 86 HD11 LEU 53 -15.298 -18.417 -0.504 449 HD12 LEU 86 HD12 LEU 53 -14.341 -17.985 -1.957 450 HD13 LEU 86 HD13 LEU 53 -14.204 -19.595 -1.246 451 HD21 LEU 86 HD21 LEU 53 -13.118 -16.100 -1.009 452 HD22 LEU 86 HD22 LEU 53 -14.177 -16.188 0.418 453 HD23 LEU 86 HD23 LEU 53 -12.402 -16.176 0.604 454 H ARG 87 H ARG 54 -12.208 -21.127 3.098 455 HA ARG 87 HA ARG 54 -13.207 -20.540 5.745 456 HB2 ARG 87 HB2 ARG 54 -11.566 -22.910 4.714 457 HB3 ARG 87 HB3 ARG 54 -11.911 -22.711 6.403 458 HG2 ARG 87 HG2 ARG 54 -13.458 -24.252 5.740 459 HG3 ARG 87 HG3 ARG 54 -14.389 -22.752 5.882 460 HD2 ARG 87 HD2 ARG 54 -14.490 -22.535 3.454 461 HD3 ARG 87 HD3 ARG 54 -13.175 -23.696 3.295 462 HE ARG 87 HE ARG 54 -14.667 -25.188 2.816 463 HH11 ARG 87 HH11 ARG 54 -16.074 -23.628 5.737 464 HH12 ARG 87 HH12 ARG 54 -17.457 -24.654 5.721 465 HH21 ARG 87 HH21 ARG 54 -16.520 -26.362 2.747 466 HH22 ARG 87 HH22 ARG 54 -17.685 -26.315 4.049 467 H SER 88 H SER 55 -9.926 -20.556 4.420 468 HA SER 88 HA SER 55 -8.646 -20.489 7.008 469 HB2 SER 88 HB2 SER 55 -7.499 -20.230 4.209 470 HB3 SER 88 HB3 SER 55 -6.605 -20.549 5.702 471 HG SER 88 HG SER 55 -8.489 -22.196 4.365 472 H VAL 89 H VAL 56 -10.308 -17.969 5.812 473 HA VAL 89 HA VAL 56 -8.409 -16.010 6.997 474 HB VAL 89 HB VAL 56 -8.180 -15.780 4.653 475 HG11 VAL 89 HG11 VAL 56 -9.967 -16.776 3.595 476 HG12 VAL 89 HG12 VAL 56 -11.187 -15.870 4.487 477 HG13 VAL 89 HG13 VAL 56 -10.216 -15.071 3.219 478 HG21 VAL 89 HG21 VAL 56 -8.291 -13.662 5.987 479 HG22 VAL 89 HG22 VAL 56 -8.604 -13.512 4.249 480 HG23 VAL 89 HG23 VAL 56 -9.954 -13.452 5.383 481 HA PRO 90 HA PRO 57 -12.892 -16.214 8.522 482 HB2 PRO 90 HB2 PRO 57 -12.709 -17.206 11.052 483 HB3 PRO 90 HB3 PRO 57 -12.670 -18.255 9.604 484 HG2 PRO 90 HG2 PRO 57 -10.312 -17.212 11.200 485 HG3 PRO 90 HG3 PRO 57 -10.629 -18.894 10.655 486 HD2 PRO 90 HD2 PRO 57 -8.999 -17.175 9.267 487 HD3 PRO 90 HD3 PRO 57 -10.007 -18.419 8.481 488 H ALA 91 H ALA 58 -9.985 -14.742 9.850 489 HA ALA 91 HA ALA 58 -11.405 -13.061 11.767 490 HB1 ALA 91 HB1 ALA 58 -9.184 -12.066 12.135 491 HB2 ALA 91 HB2 ALA 58 -9.073 -13.834 12.149 492 HB3 ALA 91 HB3 ALA 58 -8.536 -12.920 10.720 493 H VAL 92 H VAL 59 -11.063 -12.917 8.374 494 HA VAL 92 HA VAL 59 -11.597 -9.973 8.384 495 HB VAL 92 HB VAL 59 -9.808 -11.420 6.400 496 HG11 VAL 92 HG11 VAL 59 -10.854 -9.330 5.553 497 HG12 VAL 92 HG12 VAL 59 -10.172 -8.438 6.926 498 HG13 VAL 92 HG13 VAL 59 -9.103 -9.178 5.714 499 HG21 VAL 92 HG21 VAL 59 -8.578 -11.469 8.502 500 HG22 VAL 92 HG22 VAL 59 -7.880 -10.230 7.469 501 HG23 VAL 92 HG23 VAL 59 -8.948 -9.752 8.804 502 H VAL 93 H VAL 60 -12.358 -13.172 7.127 503 HA VAL 93 HA VAL 60 -14.403 -12.069 5.281 504 HB VAL 93 HB VAL 60 -12.174 -14.054 4.837 505 HG11 VAL 93 HG11 VAL 60 -14.055 -15.148 3.794 506 HG12 VAL 93 HG12 VAL 60 -14.514 -13.651 2.949 507 HG13 VAL 93 HG13 VAL 60 -13.000 -14.484 2.555 508 HG21 VAL 93 HG21 VAL 60 -12.898 -11.407 3.568 509 HG22 VAL 93 HG22 VAL 60 -11.409 -11.849 4.404 510 HG23 VAL 93 HG23 VAL 60 -11.744 -12.547 2.825 511 H ARG 94 H ARG 61 -15.960 -13.791 4.713 512 HA ARG 94 HA ARG 61 -16.542 -15.754 6.853 513 HB2 ARG 94 HB2 ARG 61 -17.414 -13.802 7.840 514 HB3 ARG 94 HB3 ARG 61 -18.011 -13.160 6.316 515 HG2 ARG 94 HG2 ARG 61 -19.874 -14.741 6.304 516 HG3 ARG 94 HG3 ARG 61 -19.185 -15.613 7.685 517 HD2 ARG 94 HD2 ARG 61 -21.099 -14.143 8.299 518 HD3 ARG 94 HD3 ARG 61 -19.603 -13.765 9.168 519 HE ARG 94 HE ARG 61 -19.958 -12.169 6.758 520 HH11 ARG 94 HH11 ARG 61 -21.281 -12.389 10.031 521 HH12 ARG 94 HH12 ARG 61 -21.320 -10.678 10.290 522 HH21 ARG 94 HH21 ARG 61 -19.710 -9.922 7.198 523 HH22 ARG 94 HH22 ARG 61 -20.564 -9.227 8.543 524 H ILE 95 H ILE 62 -18.261 -17.218 6.145 525 HA ILE 95 HA ILE 62 -19.137 -16.944 3.354 526 HB ILE 95 HB ILE 62 -18.478 -19.276 2.845 527 HG12 ILE 95 HG12 ILE 62 -16.840 -19.155 5.397 528 HG13 ILE 95 HG13 ILE 62 -18.251 -20.178 5.105 529 HG21 ILE 95 HG21 ILE 62 -17.023 -17.265 2.194 530 HG22 ILE 95 HG22 ILE 62 -15.964 -17.708 3.546 531 HG23 ILE 95 HG23 ILE 62 -16.238 -18.831 2.191 532 HD11 ILE 95 HD11 ILE 62 -15.549 -20.386 3.733 533 HD12 ILE 95 HD12 ILE 62 -16.289 -21.517 4.871 534 HD13 ILE 95 HD13 ILE 62 -16.997 -21.310 3.251 535 H GLU 96 H GLU 63 -21.020 -18.172 2.914 536 HA GLU 96 HA GLU 63 -22.186 -19.751 5.168 537 HB2 GLU 96 HB2 GLU 63 -23.680 -17.854 3.295 538 HB3 GLU 96 HB3 GLU 63 -24.418 -19.027 4.398 539 HG2 GLU 96 HG2 GLU 63 -23.141 -17.854 6.294 540 HG3 GLU 96 HG3 GLU 63 -22.802 -16.562 5.137 541 H ALA 97 H ALA 64 -21.579 -21.722 4.388 542 HA ALA 97 HA ALA 64 -22.040 -22.509 1.581 543 HB1 ALA 97 HB1 ALA 64 -21.255 -24.112 4.041 544 HB2 ALA 97 HB2 ALA 64 -21.366 -24.724 2.372 545 HB3 ALA 97 HB3 ALA 64 -20.157 -23.494 2.777 546 H SER 98 H SER 65 -24.077 -22.709 0.949 547 HA SER 98 HA SER 65 -26.315 -22.828 2.799 548 HB2 SER 98 HB2 SER 65 -26.439 -21.551 0.711 549 HB3 SER 98 HB3 SER 65 -26.084 -23.007 -0.246 550 HG SER 98 HG SER 65 -28.387 -22.385 -0.026 551 H ARG 99 H ARG 66 -27.823 -24.521 2.839 552 HA ARG 99 HA ARG 66 -26.835 -27.220 2.832 553 HB2 ARG 99 HB2 ARG 66 -29.187 -27.901 3.195 554 HB3 ARG 99 HB3 ARG 66 -28.562 -26.735 4.333 555 HG2 ARG 99 HG2 ARG 66 -30.828 -26.188 3.890 556 HG3 ARG 99 HG3 ARG 66 -29.814 -24.908 3.255 557 HD2 ARG 99 HD2 ARG 66 -31.712 -25.360 1.798 558 HD3 ARG 99 HD3 ARG 66 -30.208 -25.689 0.965 559 HE ARG 99 HE ARG 66 -31.484 -27.992 2.290 560 HH11 ARG 99 HH11 ARG 66 -31.031 -26.267 -0.822 561 HH12 ARG 99 HH12 ARG 66 -31.709 -27.552 -1.756 562 HH21 ARG 99 HH21 ARG 66 -32.278 -29.714 1.000 563 HH22 ARG 99 HH22 ARG 66 -32.340 -29.573 -0.717 564 H SER 100 H SER 67 -28.039 -25.242 0.225 565 HA SER 100 HA SER 67 -28.720 -27.410 -1.538 566 HB2 SER 100 HB2 SER 67 -27.894 -24.557 -2.192 567 HB3 SER 100 HB3 SER 67 -28.861 -25.650 -3.199 568 HG SER 100 HG SER 67 -30.112 -24.089 -1.959 569 H GLY 101 H GLY 68 -25.666 -26.589 -0.279 570 HA2 GLY 101 HA2 GLY 68 -23.634 -27.469 -0.793 571 HA3 GLY 101 HA3 GLY 68 -24.322 -28.288 -2.206 572 H GLU 102 H GLU 69 -24.439 -24.802 -1.448 573 HA GLU 102 HA GLU 69 -22.403 -24.150 -3.492 574 HB2 GLU 102 HB2 GLU 69 -25.118 -22.781 -3.115 575 HB3 GLU 102 HB3 GLU 69 -23.773 -22.121 -4.058 576 HG2 GLU 102 HG2 GLU 69 -23.850 -24.096 -5.558 577 HG3 GLU 102 HG3 GLU 69 -25.226 -24.732 -4.650 578 H ILE 103 H ILE 70 -21.572 -21.833 -2.854 579 HA ILE 103 HA ILE 70 -21.955 -21.244 -0.003 580 HB ILE 103 HB ILE 70 -20.071 -22.620 0.159 581 HG12 ILE 103 HG12 ILE 70 -19.947 -20.284 1.235 582 HG13 ILE 103 HG13 ILE 70 -18.544 -21.337 1.252 583 HG21 ILE 103 HG21 ILE 70 -18.836 -21.309 -2.241 584 HG22 ILE 103 HG22 ILE 70 -17.962 -22.356 -1.103 585 HG23 ILE 103 HG23 ILE 70 -19.322 -23.011 -2.027 586 HD11 ILE 103 HD11 ILE 70 -18.160 -18.852 0.665 587 HD12 ILE 103 HD12 ILE 70 -17.361 -20.073 -0.337 588 HD13 ILE 103 HD13 ILE 70 -18.805 -19.229 -0.926 589 H VAL 104 H VAL 71 -21.993 -19.164 0.468 590 HA VAL 104 HA VAL 71 -21.473 -17.198 -1.713 591 HB VAL 104 HB VAL 71 -23.250 -16.862 0.747 592 HG11 VAL 104 HG11 VAL 71 -24.216 -15.015 -0.599 593 HG12 VAL 104 HG12 VAL 71 -22.476 -14.792 -0.364 594 HG13 VAL 104 HG13 VAL 71 -23.096 -15.376 -1.928 595 HG21 VAL 104 HG21 VAL 71 -25.218 -17.220 -0.720 596 HG22 VAL 104 HG22 VAL 71 -24.145 -17.749 -2.030 597 HG23 VAL 104 HG23 VAL 71 -24.267 -18.697 -0.531 598 H CYS 105 H CYS 72 -19.861 -15.700 -1.273 599 HA CYS 105 HA CYS 72 -18.432 -15.947 1.314 600 HB2 CYS 105 HB2 CYS 72 -17.511 -14.423 -1.151 601 HB3 CYS 105 HB3 CYS 72 -16.525 -15.127 0.151 602 HG CYS 105 HG CYS 72 -18.184 -16.522 -2.340 603 H TYR 106 H TYR 73 -17.877 -14.083 2.533 604 HA TYR 106 HA TYR 73 -19.122 -11.468 1.877 605 HB2 TYR 106 HB2 TYR 73 -19.513 -13.130 4.404 606 HB3 TYR 106 HB3 TYR 73 -19.950 -11.432 4.277 607 HD1 TYR 106 HD1 TYR 73 -21.645 -10.701 2.511 608 HD2 TYR 106 HD2 TYR 73 -21.015 -14.829 3.661 609 HE1 TYR 106 HE1 TYR 73 -23.926 -11.199 1.828 610 HE2 TYR 106 HE2 TYR 73 -23.271 -15.400 2.822 611 HH TYR 106 HH TYR 73 -25.531 -12.922 1.460 612 H ALA 107 H ALA 74 -18.357 -9.815 3.531 613 HA ALA 107 HA ALA 74 -15.515 -10.324 4.274 614 HB1 ALA 107 HB1 ALA 74 -15.390 -7.946 4.643 615 HB2 ALA 107 HB2 ALA 74 -16.107 -8.200 3.061 616 HB3 ALA 107 HB3 ALA 74 -17.155 -7.755 4.421 617 H VAL 108 H VAL 75 -14.875 -9.538 6.413 618 HA VAL 108 HA VAL 75 -17.030 -9.389 8.467 619 HB VAL 108 HB VAL 75 -15.254 -11.597 8.064 620 HG11 VAL 108 HG11 VAL 75 -14.843 -10.451 10.846 621 HG12 VAL 108 HG12 VAL 75 -14.280 -12.014 10.216 622 HG13 VAL 108 HG13 VAL 75 -13.613 -10.511 9.562 623 HG21 VAL 108 HG21 VAL 75 -17.638 -11.676 8.686 624 HG22 VAL 108 HG22 VAL 75 -16.640 -12.630 9.810 625 HG23 VAL 108 HG23 VAL 75 -17.252 -11.032 10.293 626 H ALA 109 H ALA 76 -13.898 -8.214 7.337 627 HA ALA 109 HA ALA 76 -13.985 -6.183 9.462 628 HB1 ALA 109 HB1 ALA 76 -11.458 -7.728 8.718 629 HB2 ALA 109 HB2 ALA 76 -11.584 -6.386 9.864 630 HB3 ALA 109 HB3 ALA 76 -12.360 -7.936 10.244 Start of MODEL 5 1 H1 GLY -2 H1 GLY -2 5.646 1.117 -4.054 2 H2 GLY -2 H2 GLY -2 7.080 0.881 -3.285 3 H3 GLY -2 H3 GLY -2 6.410 -0.333 -4.157 4 HA2 GLY -2 HA2 GLY -2 6.097 -0.735 -1.802 5 HA3 GLY -2 HA3 GLY -2 5.289 0.835 -1.694 6 H HIS -1 H HIS -1 4.786 -2.468 -2.035 7 HA HIS -1 HA HIS -1 1.941 -2.149 -2.609 8 HB2 HIS -1 HB2 HIS -1 1.920 -3.828 -4.382 9 HB3 HIS -1 HB3 HIS -1 2.843 -2.420 -4.876 10 HD2 HIS -1 HD2 HIS -1 3.119 -6.150 -4.422 11 HE1 HIS -1 HE1 HIS -1 7.082 -4.861 -5.334 12 HE2 HIS -1 HE2 HIS -1 5.562 -6.886 -5.080 13 H MET 34 H MET 1 0.806 -4.227 -2.137 14 HA MET 34 HA MET 1 1.699 -5.249 0.372 15 HB2 MET 34 HB2 MET 1 -0.483 -6.214 -1.527 16 HB3 MET 34 HB3 MET 1 -0.263 -6.772 0.133 17 HG2 MET 34 HG2 MET 1 -1.789 -5.207 0.628 18 HG3 MET 34 HG3 MET 1 -0.423 -4.114 0.578 19 HE1 MET 34 HE1 MET 1 -4.108 -4.190 -2.200 20 HE2 MET 34 HE2 MET 1 -3.178 -5.679 -2.169 21 HE3 MET 34 HE3 MET 1 -3.866 -5.039 -0.658 22 H LEU 35 H LEU 2 2.291 -7.398 0.956 23 HA LEU 35 HA LEU 2 3.981 -8.893 -0.923 24 HB2 LEU 35 HB2 LEU 2 2.906 -9.663 1.828 25 HB3 LEU 35 HB3 LEU 2 4.152 -10.525 0.932 26 HG LEU 35 HG LEU 2 4.392 -7.715 2.085 27 HD11 LEU 35 HD11 LEU 2 5.761 -10.327 2.858 28 HD12 LEU 35 HD12 LEU 2 6.024 -8.733 3.600 29 HD13 LEU 35 HD13 LEU 2 4.449 -9.532 3.761 30 HD21 LEU 35 HD21 LEU 2 6.434 -9.357 0.520 31 HD22 LEU 35 HD22 LEU 2 5.722 -7.795 0.047 32 HD23 LEU 35 HD23 LEU 2 6.800 -7.883 1.445 33 H GLU 36 H GLU 3 3.450 -11.228 -1.501 34 HA GLU 36 HA GLU 3 1.147 -11.250 -2.982 35 HB2 GLU 36 HB2 GLU 3 3.026 -12.743 -3.398 36 HB3 GLU 36 HB3 GLU 3 2.631 -13.681 -1.944 37 HG2 GLU 36 HG2 GLU 3 0.490 -14.371 -2.928 38 HG3 GLU 36 HG3 GLU 3 0.767 -13.330 -4.331 39 H ALA 37 H ALA 4 1.396 -13.105 0.068 40 HA ALA 37 HA ALA 4 -1.319 -13.942 -0.154 41 HB1 ALA 37 HB1 ALA 4 0.337 -15.187 1.188 42 HB2 ALA 37 HB2 ALA 4 0.354 -13.863 2.387 43 HB3 ALA 37 HB3 ALA 4 -1.132 -14.804 2.102 44 H ASP 38 H ASP 5 0.136 -11.082 1.344 45 HA ASP 38 HA ASP 5 -2.203 -10.249 2.836 46 HB2 ASP 38 HB2 ASP 5 0.178 -9.580 3.328 47 HB3 ASP 38 HB3 ASP 5 0.173 -8.613 1.854 48 H LEU 39 H LEU 6 -0.806 -9.520 -0.371 49 HA LEU 39 HA LEU 6 -2.522 -7.476 -1.212 50 HB2 LEU 39 HB2 LEU 6 -0.421 -8.201 -2.367 51 HB3 LEU 39 HB3 LEU 6 -1.184 -9.669 -2.887 52 HG LEU 39 HG LEU 6 -2.491 -7.064 -3.648 53 HD11 LEU 39 HD11 LEU 6 -1.055 -6.906 -5.651 54 HD12 LEU 39 HD12 LEU 6 -0.095 -6.734 -4.173 55 HD13 LEU 39 HD13 LEU 6 -0.071 -8.266 -5.059 56 HD21 LEU 39 HD21 LEU 6 -2.212 -9.745 -5.081 57 HD22 LEU 39 HD22 LEU 6 -3.694 -9.083 -4.343 58 HD23 LEU 39 HD23 LEU 6 -2.998 -8.301 -5.752 59 H VAL 40 H VAL 7 -2.712 -11.011 -1.853 60 HA VAL 40 HA VAL 7 -5.173 -10.701 -3.222 61 HB VAL 40 HB VAL 7 -5.274 -13.123 -3.263 62 HG11 VAL 40 HG11 VAL 7 -3.210 -13.533 -4.454 63 HG12 VAL 40 HG12 VAL 7 -3.681 -11.860 -4.743 64 HG13 VAL 40 HG13 VAL 7 -2.378 -12.228 -3.608 65 HG21 VAL 40 HG21 VAL 7 -3.599 -14.554 -2.175 66 HG22 VAL 40 HG22 VAL 7 -2.940 -13.143 -1.328 67 HG23 VAL 40 HG23 VAL 7 -4.571 -13.710 -0.971 68 H SER 41 H SER 8 -4.483 -11.459 0.238 69 HA SER 41 HA SER 8 -7.217 -11.948 0.904 70 HB2 SER 41 HB2 SER 8 -4.948 -10.994 2.700 71 HB3 SER 41 HB3 SER 8 -6.485 -11.711 3.228 72 HG SER 41 HG SER 8 -4.272 -12.907 1.963 73 H LYS 42 H LYS 9 -5.294 -8.855 1.075 74 HA LYS 42 HA LYS 9 -7.524 -7.345 2.214 75 HB2 LYS 42 HB2 LYS 9 -4.864 -6.682 0.917 76 HB3 LYS 42 HB3 LYS 9 -6.073 -5.420 1.029 77 HG2 LYS 42 HG2 LYS 9 -4.499 -5.366 2.872 78 HG3 LYS 42 HG3 LYS 9 -6.192 -5.524 3.401 79 HD2 LYS 42 HD2 LYS 9 -5.778 -7.931 3.915 80 HD3 LYS 42 HD3 LYS 9 -4.098 -7.732 3.359 81 HE2 LYS 42 HE2 LYS 9 -3.890 -5.820 5.037 82 HE3 LYS 42 HE3 LYS 9 -5.466 -6.287 5.684 83 HZ1 LYS 42 HZ1 LYS 9 -3.659 -7.269 6.956 84 HZ2 LYS 42 HZ2 LYS 9 -4.466 -8.489 6.210 85 HZ3 LYS 42 HZ3 LYS 9 -3.013 -7.957 5.618 86 H MET 43 H MET 10 -6.380 -7.865 -1.219 87 HA MET 43 HA MET 10 -8.419 -6.092 -2.232 88 HB2 MET 43 HB2 MET 10 -6.765 -8.255 -3.586 89 HB3 MET 43 HB3 MET 10 -7.922 -7.215 -4.439 90 HG2 MET 43 HG2 MET 10 -6.680 -5.212 -3.435 91 HG3 MET 43 HG3 MET 10 -5.415 -6.348 -2.968 92 HE1 MET 43 HE1 MET 10 -3.483 -4.989 -4.389 93 HE2 MET 43 HE2 MET 10 -3.838 -4.334 -6.000 94 HE3 MET 43 HE3 MET 10 -4.783 -3.783 -4.601 95 H LEU 44 H LEU 11 -8.354 -9.686 -1.832 96 HA LEU 44 HA LEU 11 -10.935 -10.380 -2.659 97 HB2 LEU 44 HB2 LEU 11 -9.291 -12.011 -1.837 98 HB3 LEU 44 HB3 LEU 11 -9.221 -11.212 -0.278 99 HG LEU 44 HG LEU 11 -11.633 -11.888 0.108 100 HD11 LEU 44 HD11 LEU 11 -12.392 -13.832 -1.185 101 HD12 LEU 44 HD12 LEU 11 -12.174 -12.426 -2.260 102 HD13 LEU 44 HD13 LEU 11 -10.959 -13.727 -2.236 103 HD21 LEU 44 HD21 LEU 11 -9.473 -13.987 -0.151 104 HD22 LEU 44 HD22 LEU 11 -9.776 -12.962 1.254 105 HD23 LEU 44 HD23 LEU 11 -10.973 -14.185 0.779 106 H ARG 45 H ARG 12 -9.970 -9.325 0.609 107 HA ARG 45 HA ARG 12 -12.523 -9.017 1.762 108 HB2 ARG 45 HB2 ARG 12 -10.649 -9.125 3.094 109 HB3 ARG 45 HB3 ARG 12 -9.750 -7.926 2.206 110 HG2 ARG 45 HG2 ARG 12 -12.189 -7.063 3.767 111 HG3 ARG 45 HG3 ARG 12 -10.645 -7.422 4.533 112 HD2 ARG 45 HD2 ARG 12 -9.578 -5.788 2.805 113 HD3 ARG 45 HD3 ARG 12 -11.245 -5.177 2.616 114 HE ARG 45 HE ARG 12 -10.453 -5.567 5.365 115 HH11 ARG 45 HH11 ARG 12 -9.730 -3.251 2.755 116 HH12 ARG 45 HH12 ARG 12 -9.737 -1.872 3.792 117 HH21 ARG 45 HH21 ARG 12 -10.802 -3.736 6.643 118 HH22 ARG 45 HH22 ARG 12 -10.219 -2.175 6.131 119 H ALA 46 H ALA 13 -10.632 -6.583 -0.144 120 HA ALA 46 HA ALA 13 -12.510 -4.545 0.415 121 HB1 ALA 46 HB1 ALA 13 -11.402 -3.304 -1.420 122 HB2 ALA 46 HB2 ALA 13 -10.195 -4.117 -0.406 123 HB3 ALA 46 HB3 ALA 13 -10.637 -4.798 -1.990 124 H VAL 47 H VAL 14 -12.337 -6.873 -2.326 125 HA VAL 47 HA VAL 14 -14.576 -5.813 -3.770 126 HB VAL 47 HB VAL 14 -13.494 -8.667 -3.534 127 HG11 VAL 47 HG11 VAL 14 -15.822 -8.703 -4.379 128 HG12 VAL 47 HG12 VAL 14 -15.376 -7.533 -5.635 129 HG13 VAL 47 HG13 VAL 14 -14.645 -9.163 -5.610 130 HG21 VAL 47 HG21 VAL 14 -11.838 -7.132 -4.499 131 HG22 VAL 47 HG22 VAL 14 -12.501 -8.115 -5.790 132 HG23 VAL 47 HG23 VAL 14 -13.055 -6.451 -5.603 133 H LEU 48 H LEU 15 -14.328 -8.259 -1.145 134 HA LEU 48 HA LEU 15 -17.095 -8.876 -1.040 135 HB2 LEU 48 HB2 LEU 15 -14.929 -8.967 1.124 136 HB3 LEU 48 HB3 LEU 15 -16.517 -9.675 1.302 137 HG LEU 48 HG LEU 15 -14.782 -10.485 -1.063 138 HD11 LEU 48 HD11 LEU 15 -13.974 -12.362 0.345 139 HD12 LEU 48 HD12 LEU 15 -13.417 -10.790 0.940 140 HD13 LEU 48 HD13 LEU 15 -14.749 -11.619 1.768 141 HD21 LEU 48 HD21 LEU 15 -16.109 -12.515 -0.912 142 HD22 LEU 48 HD22 LEU 15 -16.875 -11.954 0.575 143 HD23 LEU 48 HD23 LEU 15 -17.226 -11.127 -0.952 144 H GLN 49 H GLN 16 -15.243 -6.259 0.573 145 HA GLN 49 HA GLN 16 -17.454 -5.448 2.240 146 HB2 GLN 49 HB2 GLN 16 -14.812 -4.134 1.484 147 HB3 GLN 49 HB3 GLN 16 -16.015 -3.332 2.519 148 HG2 GLN 49 HG2 GLN 16 -16.049 -5.306 4.026 149 HG3 GLN 49 HG3 GLN 16 -14.785 -6.061 3.048 150 HE21 GLN 49 HE22 GLN 16 -14.406 -5.907 5.733 151 HE22 GLN 49 HE21 GLN 16 -13.153 -4.746 6.076 152 H SER 50 H SER 17 -16.424 -4.476 -1.069 153 HA SER 50 HA SER 17 -18.444 -2.428 -1.306 154 HB2 SER 50 HB2 SER 17 -17.100 -4.157 -3.427 155 HB3 SER 50 HB3 SER 17 -18.024 -2.669 -3.718 156 HG SER 50 HG SER 17 -15.779 -2.221 -3.628 157 H HIS 51 H HIS 18 -18.381 -5.943 -1.889 158 HA HIS 51 HA HIS 18 -21.074 -5.907 -3.050 159 HB2 HIS 51 HB2 HIS 18 -18.944 -8.052 -2.854 160 HB3 HIS 51 HB3 HIS 18 -20.508 -8.256 -3.622 161 HD2 HIS 51 HD2 HIS 18 -18.886 -8.831 -5.781 162 HE1 HIS 51 HE1 HIS 18 -18.197 -4.776 -6.842 163 HE2 HIS 51 HE2 HIS 18 -18.085 -7.165 -7.674 164 H LYS 52 H LYS 19 -21.877 -5.251 -0.749 165 HA LYS 52 HA LYS 19 -21.819 -7.042 1.426 166 HB2 LYS 52 HB2 LYS 19 -23.964 -5.016 0.606 167 HB3 LYS 52 HB3 LYS 19 -23.934 -5.828 2.159 168 HG2 LYS 52 HG2 LYS 19 -21.868 -3.863 1.131 169 HG3 LYS 52 HG3 LYS 19 -23.041 -3.637 2.435 170 HD2 LYS 52 HD2 LYS 19 -21.867 -5.689 3.562 171 HD3 LYS 52 HD3 LYS 19 -20.559 -5.403 2.418 172 HE2 LYS 52 HE2 LYS 19 -21.624 -3.482 4.541 173 HE3 LYS 52 HE3 LYS 19 -20.050 -4.276 4.514 174 HZ1 LYS 52 HZ1 LYS 19 -20.976 -2.113 2.702 175 HZ2 LYS 52 HZ2 LYS 19 -19.785 -2.031 3.807 176 HZ3 LYS 52 HZ3 LYS 19 -19.574 -2.940 2.452 177 H ASN 53 H ASN 20 -23.873 -7.270 -1.427 178 HA ASN 53 HA ASN 20 -25.794 -9.080 -0.325 179 HB2 ASN 53 HB2 ASN 20 -26.035 -7.839 -2.491 180 HB3 ASN 53 HB3 ASN 20 -24.751 -8.832 -3.189 181 HD21 ASN 53 HD22 ASN 20 -27.978 -9.177 -1.540 182 HD22 ASN 53 HD21 ASN 20 -28.457 -10.574 -2.477 183 H GLY 54 H GLY 21 -22.426 -9.571 -0.830 184 HA2 GLY 54 HA2 GLY 21 -21.158 -11.404 -0.509 185 HA3 GLY 54 HA3 GLY 21 -22.590 -12.448 -0.406 186 H ILE 55 H ILE 22 -20.485 -13.338 -1.828 187 HA ILE 55 HA ILE 22 -21.463 -13.349 -4.629 188 HB ILE 55 HB ILE 22 -18.868 -13.255 -5.207 189 HG12 ILE 55 HG12 ILE 22 -18.936 -11.520 -2.682 190 HG13 ILE 55 HG13 ILE 22 -17.955 -12.952 -2.971 191 HG21 ILE 55 HG21 ILE 22 -19.104 -11.085 -5.990 192 HG22 ILE 55 HG22 ILE 22 -20.762 -11.687 -5.946 193 HG23 ILE 55 HG23 ILE 22 -20.212 -10.601 -4.662 194 HD11 ILE 55 HD11 ILE 22 -16.553 -10.999 -3.236 195 HD12 ILE 55 HD12 ILE 22 -16.866 -11.559 -4.891 196 HD13 ILE 55 HD13 ILE 22 -17.744 -10.170 -4.218 197 H VAL 56 H VAL 23 -21.710 -15.324 -5.251 198 HA VAL 56 HA VAL 23 -21.049 -17.595 -3.685 199 HB VAL 56 HB VAL 23 -21.668 -18.850 -5.761 200 HG11 VAL 56 HG11 VAL 23 -24.037 -18.129 -5.763 201 HG12 VAL 56 HG12 VAL 23 -23.364 -18.310 -4.143 202 HG13 VAL 56 HG13 VAL 23 -23.601 -16.686 -4.830 203 HG21 VAL 56 HG21 VAL 23 -20.909 -17.231 -7.486 204 HG22 VAL 56 HG22 VAL 23 -22.599 -17.684 -7.692 205 HG23 VAL 56 HG23 VAL 23 -22.191 -16.102 -7.009 206 H LEU 57 H LEU 24 -19.317 -19.171 -3.906 207 HA LEU 57 HA LEU 24 -16.898 -18.143 -4.250 208 HB2 LEU 57 HB2 LEU 24 -15.796 -20.149 -4.178 209 HB3 LEU 57 HB3 LEU 24 -17.193 -20.233 -3.156 210 HG LEU 57 HG LEU 24 -16.934 -21.504 -5.931 211 HD11 LEU 57 HD11 LEU 24 -15.426 -22.537 -4.289 212 HD12 LEU 57 HD12 LEU 24 -16.787 -22.798 -3.184 213 HD13 LEU 57 HD13 LEU 24 -16.731 -23.638 -4.750 214 HD21 LEU 57 HD21 LEU 24 -19.083 -22.079 -3.829 215 HD22 LEU 57 HD22 LEU 24 -19.358 -21.097 -5.264 216 HD23 LEU 57 HD23 LEU 24 -18.931 -22.794 -5.438 217 HA PRO 58 HA PRO 25 -15.984 -18.985 -8.820 218 HB2 PRO 58 HB2 PRO 25 -17.961 -19.027 -10.712 219 HB3 PRO 58 HB3 PRO 25 -17.369 -20.493 -9.876 220 HG2 PRO 58 HG2 PRO 25 -19.819 -18.843 -9.206 221 HG3 PRO 58 HG3 PRO 25 -19.694 -20.619 -9.372 222 HD2 PRO 58 HD2 PRO 25 -19.600 -19.450 -6.932 223 HD3 PRO 58 HD3 PRO 25 -18.562 -20.847 -7.348 224 H ARG 59 H ARG 26 -18.902 -17.045 -8.075 225 HA ARG 59 HA ARG 26 -18.206 -14.786 -9.750 226 HB2 ARG 59 HB2 ARG 26 -20.509 -15.358 -8.893 227 HB3 ARG 59 HB3 ARG 26 -19.979 -14.905 -7.255 228 HG2 ARG 59 HG2 ARG 26 -19.559 -12.598 -8.046 229 HG3 ARG 59 HG3 ARG 26 -20.011 -13.076 -9.691 230 HD2 ARG 59 HD2 ARG 26 -22.296 -13.611 -8.932 231 HD3 ARG 59 HD3 ARG 26 -21.867 -13.139 -7.270 232 HE ARG 59 HE ARG 26 -21.231 -10.986 -9.001 233 HH11 ARG 59 HH11 ARG 26 -24.178 -12.652 -7.860 234 HH12 ARG 59 HH12 ARG 26 -25.157 -11.234 -7.921 235 HH21 ARG 59 HH21 ARG 26 -22.556 -9.104 -9.074 236 HH22 ARG 59 HH22 ARG 26 -24.222 -9.188 -8.639 237 H LEU 60 H LEU 27 -17.460 -15.827 -6.430 238 HA LEU 60 HA LEU 27 -16.205 -13.493 -5.516 239 HB2 LEU 60 HB2 LEU 27 -16.720 -15.463 -4.070 240 HB3 LEU 60 HB3 LEU 27 -15.491 -16.416 -4.869 241 HG LEU 60 HG LEU 27 -14.892 -15.558 -2.646 242 HD11 LEU 60 HD11 LEU 27 -12.906 -14.637 -4.737 243 HD12 LEU 60 HD12 LEU 27 -12.607 -15.280 -3.120 244 HD13 LEU 60 HD13 LEU 27 -13.230 -16.355 -4.372 245 HD21 LEU 60 HD21 LEU 27 -14.280 -13.310 -2.258 246 HD22 LEU 60 HD22 LEU 27 -14.361 -12.883 -3.988 247 HD23 LEU 60 HD23 LEU 27 -15.830 -13.247 -3.049 248 H GLN 61 H GLN 28 -14.723 -16.357 -7.200 249 HA GLN 61 HA GLN 28 -12.166 -15.247 -7.626 250 HB2 GLN 61 HB2 GLN 28 -13.852 -17.330 -8.978 251 HB3 GLN 61 HB3 GLN 28 -12.480 -16.726 -9.891 252 HG2 GLN 61 HG2 GLN 28 -12.072 -17.658 -7.039 253 HG3 GLN 61 HG3 GLN 28 -12.265 -18.822 -8.343 254 HE21 GLN 61 HE22 GLN 28 -10.240 -19.565 -9.088 255 HE22 GLN 61 HE21 GLN 28 -8.818 -18.569 -9.223 256 H GLY 62 H GLY 29 -15.098 -14.893 -9.716 257 HA2 GLY 62 HA2 GLY 29 -13.866 -13.487 -11.811 258 HA3 GLY 62 HA3 GLY 29 -15.573 -13.358 -11.348 259 H GLU 63 H GLU 30 -15.653 -12.071 -8.981 260 HA GLU 63 HA GLU 30 -15.045 -9.377 -9.799 261 HB2 GLU 63 HB2 GLU 30 -16.092 -10.523 -7.171 262 HB3 GLU 63 HB3 GLU 30 -16.029 -8.801 -7.570 263 HG2 GLU 63 HG2 GLU 30 -17.642 -10.880 -9.108 264 HG3 GLU 63 HG3 GLU 30 -18.273 -9.765 -7.914 265 H TYR 64 H TYR 31 -13.588 -11.623 -7.436 266 HA TYR 64 HA TYR 31 -11.624 -9.975 -6.227 267 HB2 TYR 64 HB2 TYR 31 -11.886 -12.224 -5.465 268 HB3 TYR 64 HB3 TYR 31 -11.705 -12.875 -7.088 269 HD1 TYR 64 HD2 TYR 31 -9.576 -13.126 -8.205 270 HD2 TYR 64 HD1 TYR 31 -9.861 -11.619 -4.177 271 HE1 TYR 64 HE2 TYR 31 -7.165 -13.450 -7.908 272 HE2 TYR 64 HE1 TYR 31 -7.451 -12.030 -3.841 273 HH TYR 64 HH TYR 31 -5.356 -13.330 -6.518 274 H ARG 65 H ARG 32 -11.504 -11.857 -9.302 275 HA ARG 65 HA ARG 32 -8.910 -10.986 -9.997 276 HB2 ARG 65 HB2 ARG 32 -9.918 -12.987 -10.863 277 HB3 ARG 65 HB3 ARG 32 -11.173 -12.076 -11.719 278 HG2 ARG 65 HG2 ARG 32 -9.637 -11.144 -13.291 279 HG3 ARG 65 HG3 ARG 32 -8.248 -11.485 -12.249 280 HD2 ARG 65 HD2 ARG 32 -8.827 -13.952 -12.529 281 HD3 ARG 65 HD3 ARG 32 -9.867 -13.462 -13.871 282 HE ARG 65 HE ARG 32 -6.930 -13.189 -13.552 283 HH11 ARG 65 HH11 ARG 32 -9.696 -12.940 -15.772 284 HH12 ARG 65 HH12 ARG 32 -8.733 -12.843 -17.202 285 HH21 ARG 65 HH21 ARG 32 -5.632 -13.079 -15.477 286 HH22 ARG 65 HH22 ARG 32 -6.380 -12.924 -17.024 287 H SER 66 H SER 33 -12.146 -9.539 -10.773 288 HA SER 66 HA SER 33 -11.170 -7.637 -12.593 289 HB2 SER 66 HB2 SER 33 -13.409 -7.281 -10.554 290 HB3 SER 66 HB3 SER 33 -13.156 -6.315 -12.017 291 HG SER 66 HG SER 33 -14.695 -7.943 -12.413 292 H LEU 67 H LEU 34 -11.057 -7.627 -8.975 293 HA LEU 67 HA LEU 34 -9.874 -4.947 -9.017 294 HB2 LEU 67 HB2 LEU 34 -11.247 -5.661 -7.127 295 HB3 LEU 67 HB3 LEU 34 -10.072 -6.922 -6.727 296 HG LEU 67 HG LEU 34 -8.348 -5.221 -6.261 297 HD11 LEU 67 HD11 LEU 34 -8.965 -2.798 -6.130 298 HD12 LEU 67 HD12 LEU 34 -8.950 -3.388 -7.790 299 HD13 LEU 67 HD13 LEU 34 -10.499 -3.159 -6.941 300 HD21 LEU 67 HD21 LEU 34 -9.881 -5.907 -4.455 301 HD22 LEU 67 HD22 LEU 34 -9.332 -4.242 -4.249 302 HD23 LEU 67 HD23 LEU 34 -10.973 -4.570 -4.853 303 H THR 68 H THR 35 -8.495 -8.305 -8.376 304 HA THR 68 HA THR 35 -5.904 -7.188 -7.763 305 HB THR 68 HB THR 35 -5.254 -9.663 -7.939 306 HG1 THR 68 HG1 THR 35 -7.193 -11.046 -8.045 307 HG21 THR 68 HG21 THR 35 -7.668 -9.108 -6.180 308 HG22 THR 68 HG22 THR 35 -6.369 -10.303 -5.929 309 HG23 THR 68 HG23 THR 35 -5.983 -8.602 -5.816 310 H GLY 69 H GLY 36 -7.400 -8.541 -10.697 311 HA2 GLY 69 HA2 GLY 36 -6.641 -8.622 -12.867 312 HA3 GLY 69 HA3 GLY 36 -5.100 -7.875 -12.387 313 H ASP 70 H ASP 37 -6.356 -10.657 -10.530 314 HA ASP 70 HA ASP 37 -4.552 -12.564 -11.885 315 HB2 ASP 70 HB2 ASP 37 -3.344 -11.291 -9.980 316 HB3 ASP 70 HB3 ASP 37 -4.453 -12.111 -8.874 317 H TRP 71 H TRP 38 -4.864 -14.765 -10.778 318 HA TRP 71 HA TRP 38 -7.717 -15.247 -10.065 319 HB2 TRP 71 HB2 TRP 38 -5.463 -17.155 -10.838 320 HB3 TRP 71 HB3 TRP 38 -7.097 -17.633 -10.406 321 HD1 TRP 71 HD1 TRP 38 -5.061 -16.871 -13.341 322 HE1 TRP 71 HE1 TRP 38 -6.482 -16.659 -15.459 323 HE3 TRP 71 HE3 TRP 38 -9.653 -16.435 -11.151 324 HZ2 TRP 71 HZ2 TRP 38 -9.305 -16.277 -16.122 325 HZ3 TRP 71 HZ3 TRP 38 -11.665 -16.010 -12.536 326 HH2 TRP 71 HH2 TRP 38 -11.516 -15.969 -15.005 327 H ILE 72 H ILE 39 -8.122 -16.421 -8.078 328 HA ILE 72 HA ILE 39 -6.479 -15.727 -5.924 329 HB ILE 72 HB ILE 39 -8.776 -17.619 -6.298 330 HG12 ILE 72 HG12 ILE 39 -8.188 -15.202 -4.520 331 HG13 ILE 72 HG13 ILE 39 -9.013 -15.176 -6.086 332 HG21 ILE 72 HG21 ILE 39 -7.212 -17.502 -3.688 333 HG22 ILE 72 HG22 ILE 39 -8.809 -18.244 -3.920 334 HG23 ILE 72 HG23 ILE 39 -7.434 -18.911 -4.762 335 HD11 ILE 72 HD11 ILE 39 -10.585 -14.953 -4.341 336 HD12 ILE 72 HD12 ILE 39 -10.848 -16.487 -5.198 337 HD13 ILE 72 HD13 ILE 39 -10.076 -16.473 -3.580 338 HA PRO 73 HA PRO 40 -3.422 -18.925 -6.326 339 HB2 PRO 73 HB2 PRO 40 -1.702 -18.243 -4.339 340 HB3 PRO 73 HB3 PRO 40 -1.975 -17.193 -5.744 341 HG2 PRO 73 HG2 PRO 40 -3.352 -17.028 -3.057 342 HG3 PRO 73 HG3 PRO 40 -2.473 -15.725 -3.933 343 HD2 PRO 73 HD2 PRO 40 -5.186 -16.060 -4.073 344 HD3 PRO 73 HD3 PRO 40 -4.235 -15.504 -5.487 345 H PHE 74 H PHE 41 -5.809 -20.112 -5.346 346 HA PHE 74 HA PHE 41 -5.663 -20.798 -2.540 347 HB2 PHE 74 HB2 PHE 41 -7.473 -22.320 -2.916 348 HB3 PHE 74 HB3 PHE 41 -7.828 -20.796 -3.668 349 HD1 PHE 74 HD1 PHE 41 -7.587 -20.629 -6.276 350 HD2 PHE 74 HD2 PHE 41 -7.485 -24.346 -4.102 351 HE1 PHE 74 HE1 PHE 41 -8.074 -21.854 -8.360 352 HE2 PHE 74 HE2 PHE 41 -8.036 -25.578 -6.187 353 HZ PHE 74 HZ PHE 41 -8.324 -24.332 -8.328 354 H LYS 75 H LYS 42 -5.152 -22.890 -5.414 355 HA LYS 75 HA LYS 42 -4.042 -25.056 -3.897 356 HB2 LYS 75 HB2 LYS 42 -5.205 -25.045 -6.164 357 HB3 LYS 75 HB3 LYS 42 -3.728 -24.386 -6.863 358 HG2 LYS 75 HG2 LYS 42 -2.500 -26.441 -6.092 359 HG3 LYS 75 HG3 LYS 42 -4.002 -27.045 -5.368 360 HD2 LYS 75 HD2 LYS 42 -5.078 -27.082 -7.596 361 HD3 LYS 75 HD3 LYS 42 -3.583 -26.459 -8.336 362 HE2 LYS 75 HE2 LYS 42 -2.355 -28.472 -7.519 363 HE3 LYS 75 HE3 LYS 42 -3.856 -29.097 -6.819 364 HZ1 LYS 75 HZ1 LYS 42 -4.791 -29.211 -9.053 365 HZ2 LYS 75 HZ2 LYS 42 -3.418 -28.611 -9.712 366 HZ3 LYS 75 HZ3 LYS 42 -3.407 -30.071 -8.982 367 H GLN 76 H GLN 43 -2.738 -22.181 -5.308 368 HA GLN 76 HA GLN 43 0.023 -22.943 -5.426 369 HB2 GLN 76 HB2 GLN 43 -1.234 -20.166 -5.444 370 HB3 GLN 76 HB3 GLN 43 0.355 -20.619 -6.005 371 HG2 GLN 76 HG2 GLN 43 -0.714 -20.472 -8.013 372 HG3 GLN 76 HG3 GLN 43 -0.943 -22.180 -7.715 373 HE21 GLN 76 HE22 GLN 43 -2.601 -19.823 -9.213 374 HE22 GLN 76 HE21 GLN 43 -4.222 -20.069 -8.569 375 H LEU 77 H LEU 44 -2.009 -21.125 -3.049 376 HA LEU 77 HA LEU 44 0.117 -20.810 -1.071 377 HB2 LEU 77 HB2 LEU 44 -2.890 -20.540 -0.947 378 HB3 LEU 77 HB3 LEU 44 -1.826 -20.288 0.433 379 HG LEU 77 HG LEU 44 -1.629 -18.660 -2.123 380 HD11 LEU 77 HD11 LEU 44 -3.835 -18.288 -1.052 381 HD12 LEU 77 HD12 LEU 44 -3.019 -17.924 0.495 382 HD13 LEU 77 HD13 LEU 44 -2.805 -16.861 -0.896 383 HD21 LEU 77 HD21 LEU 44 -0.469 -18.163 0.646 384 HD22 LEU 77 HD22 LEU 44 0.438 -18.618 -0.814 385 HD23 LEU 77 HD23 LEU 44 -0.378 -17.055 -0.743 386 H GLY 78 H GLY 45 -2.298 -23.282 -1.906 387 HA2 GLY 78 HA2 GLY 45 -1.481 -25.552 -1.503 388 HA3 GLY 78 HA3 GLY 45 -1.045 -25.082 0.142 389 H TYR 79 H TYR 46 -4.046 -23.675 -0.821 390 HA TYR 79 HA TYR 46 -5.564 -25.455 0.940 391 HB2 TYR 79 HB2 TYR 46 -6.503 -23.122 -0.781 392 HB3 TYR 79 HB3 TYR 46 -7.386 -23.901 0.537 393 HD1 TYR 79 HD2 TYR 46 -6.414 -23.794 2.909 394 HD2 TYR 79 HD1 TYR 46 -4.993 -21.343 -0.342 395 HE1 TYR 79 HE2 TYR 46 -5.296 -22.326 4.520 396 HE2 TYR 79 HE1 TYR 46 -3.885 -19.835 1.262 397 HH TYR 79 HH TYR 46 -3.930 -20.405 4.827 398 HA PRO 80 HA PRO 47 -6.459 -27.891 -2.610 399 HB2 PRO 80 HB2 PRO 47 -8.715 -29.348 -1.898 400 HB3 PRO 80 HB3 PRO 47 -7.103 -29.618 -1.167 401 HG2 PRO 80 HG2 PRO 47 -9.344 -27.859 -0.090 402 HG3 PRO 80 HG3 PRO 47 -8.434 -29.147 0.780 403 HD2 PRO 80 HD2 PRO 47 -7.663 -26.575 1.040 404 HD3 PRO 80 HD3 PRO 47 -6.432 -27.845 0.801 405 H THR 81 H THR 48 -9.114 -25.775 -1.470 406 HA THR 81 HA THR 48 -10.135 -25.578 -4.252 407 HB THR 81 HB THR 48 -12.431 -25.749 -3.105 408 HG1 THR 81 HG1 THR 48 -12.192 -26.968 -1.006 409 HG21 THR 81 HG21 THR 48 -10.806 -28.291 -2.731 410 HG22 THR 81 HG22 THR 48 -12.541 -28.139 -3.050 411 HG23 THR 81 HG23 THR 48 -11.378 -27.722 -4.315 412 H LEU 82 H LEU 49 -11.670 -23.723 -4.457 413 HA LEU 82 HA LEU 49 -10.696 -21.293 -3.257 414 HB2 LEU 82 HB2 LEU 49 -13.323 -21.981 -4.675 415 HB3 LEU 82 HB3 LEU 49 -13.010 -20.399 -4.009 416 HG LEU 82 HG LEU 49 -12.603 -20.284 -6.330 417 HD11 LEU 82 HD11 LEU 49 -9.870 -20.355 -4.966 418 HD12 LEU 82 HD12 LEU 49 -10.297 -19.479 -6.424 419 HD13 LEU 82 HD13 LEU 49 -11.030 -19.008 -4.870 420 HD21 LEU 82 HD21 LEU 49 -12.174 -22.679 -6.786 421 HD22 LEU 82 HD22 LEU 49 -10.997 -21.612 -7.565 422 HD23 LEU 82 HD23 LEU 49 -10.533 -22.508 -6.112 423 H GLU 83 H GLU 50 -13.420 -23.508 -2.420 424 HA GLU 83 HA GLU 50 -14.349 -21.819 -0.334 425 HB2 GLU 83 HB2 GLU 50 -15.635 -23.590 0.487 426 HB3 GLU 83 HB3 GLU 50 -15.651 -23.725 -1.266 427 HG2 GLU 83 HG2 GLU 50 -13.994 -25.567 -1.126 428 HG3 GLU 83 HG3 GLU 50 -13.978 -25.412 0.637 429 H ALA 84 H ALA 51 -11.850 -24.481 -0.237 430 HA ALA 84 HA ALA 51 -11.422 -24.280 2.560 431 HB1 ALA 84 HB1 ALA 51 -10.655 -26.165 1.221 432 HB2 ALA 84 HB2 ALA 51 -9.490 -25.126 0.372 433 HB3 ALA 84 HB3 ALA 51 -9.307 -25.433 2.114 434 H TYR 85 H TYR 52 -9.824 -22.520 -0.136 435 HA TYR 85 HA TYR 52 -8.048 -20.962 1.437 436 HB2 TYR 85 HB2 TYR 52 -7.818 -20.946 -0.923 437 HB3 TYR 85 HB3 TYR 52 -9.493 -20.483 -1.193 438 HD1 TYR 85 HD1 TYR 52 -6.288 -19.252 0.289 439 HD2 TYR 85 HD2 TYR 52 -10.103 -18.217 -1.427 440 HE1 TYR 85 HE1 TYR 52 -5.599 -16.888 0.291 441 HE2 TYR 85 HE2 TYR 52 -9.431 -15.835 -1.454 442 HH TYR 85 HH TYR 52 -6.274 -14.691 -0.132 443 H LEU 86 H LEU 53 -11.493 -20.240 0.487 444 HA LEU 86 HA LEU 53 -11.645 -17.845 1.999 445 HB2 LEU 86 HB2 LEU 53 -13.787 -19.785 1.062 446 HB3 LEU 86 HB3 LEU 53 -14.114 -18.207 1.771 447 HG LEU 86 HG LEU 53 -12.298 -18.385 -0.650 448 HD11 LEU 86 HD11 LEU 53 -14.226 -19.610 -1.386 449 HD12 LEU 86 HD12 LEU 53 -15.322 -18.439 -0.652 450 HD13 LEU 86 HD13 LEU 53 -14.327 -17.983 -2.066 451 HD21 LEU 86 HD21 LEU 53 -14.218 -16.254 0.376 452 HD22 LEU 86 HD22 LEU 53 -12.449 -16.249 0.584 453 HD23 LEU 86 HD23 LEU 53 -13.139 -16.125 -1.037 454 H ARG 87 H ARG 54 -12.345 -21.203 3.003 455 HA ARG 87 HA ARG 54 -13.336 -20.624 5.662 456 HB2 ARG 87 HB2 ARG 54 -11.723 -23.013 4.601 457 HB3 ARG 87 HB3 ARG 54 -12.065 -22.822 6.292 458 HG2 ARG 87 HG2 ARG 54 -13.604 -24.361 5.572 459 HG3 ARG 87 HG3 ARG 54 -14.520 -22.875 5.819 460 HD2 ARG 87 HD2 ARG 54 -14.692 -22.547 3.387 461 HD3 ARG 87 HD3 ARG 54 -13.388 -23.708 3.156 462 HE ARG 87 HE ARG 54 -14.826 -25.259 2.770 463 HH11 ARG 87 HH11 ARG 54 -16.364 -23.473 5.469 464 HH12 ARG 87 HH12 ARG 54 -17.787 -24.443 5.437 465 HH21 ARG 87 HH22 ARG 54 -16.775 -26.333 2.602 466 HH22 ARG 87 HH21 ARG 54 -18.003 -26.164 3.828 467 H SER 88 H SER 55 -10.061 -20.683 4.326 468 HA SER 88 HA SER 55 -8.781 -20.615 6.918 469 HB2 SER 88 HB2 SER 55 -7.630 -20.443 4.122 470 HB3 SER 88 HB3 SER 55 -6.746 -20.751 5.629 471 HG SER 88 HG SER 55 -8.652 -22.389 4.315 472 H VAL 89 H VAL 56 -10.377 -18.096 5.663 473 HA VAL 89 HA VAL 56 -8.390 -16.154 6.732 474 HB VAL 89 HB VAL 56 -8.283 -16.033 4.365 475 HG11 VAL 89 HG11 VAL 56 -11.296 -15.930 4.363 476 HG12 VAL 89 HG12 VAL 56 -10.346 -15.272 3.004 477 HG13 VAL 89 HG13 VAL 56 -10.191 -16.967 3.462 478 HG21 VAL 89 HG21 VAL 56 -8.586 -13.762 3.899 479 HG22 VAL 89 HG22 VAL 56 -9.913 -13.598 5.046 480 HG23 VAL 89 HG23 VAL 56 -8.247 -13.857 5.633 481 HA PRO 90 HA PRO 57 -12.827 -16.098 8.419 482 HB2 PRO 90 HB2 PRO 57 -12.650 -17.105 10.939 483 HB3 PRO 90 HB3 PRO 57 -12.716 -18.145 9.488 484 HG2 PRO 90 HG2 PRO 57 -10.243 -17.260 11.018 485 HG3 PRO 90 HG3 PRO 57 -10.688 -18.915 10.495 486 HD2 PRO 90 HD2 PRO 57 -8.991 -17.322 9.047 487 HD3 PRO 90 HD3 PRO 57 -10.105 -18.494 8.302 488 H ALA 91 H ALA 58 -9.776 -14.849 9.631 489 HA ALA 91 HA ALA 58 -10.981 -13.034 11.578 490 HB1 ALA 91 HB1 ALA 58 -8.693 -13.978 11.864 491 HB2 ALA 91 HB2 ALA 58 -8.164 -13.130 10.386 492 HB3 ALA 91 HB3 ALA 58 -8.666 -12.210 11.815 493 H VAL 92 H VAL 59 -10.840 -12.996 8.183 494 HA VAL 92 HA VAL 59 -11.026 -10.010 8.095 495 HB VAL 92 HB VAL 59 -9.568 -11.697 6.054 496 HG11 VAL 92 HG11 VAL 59 -9.422 -8.725 6.653 497 HG12 VAL 92 HG12 VAL 59 -8.567 -9.583 5.351 498 HG13 VAL 92 HG13 VAL 59 -10.329 -9.477 5.326 499 HG21 VAL 92 HG21 VAL 59 -8.231 -11.995 8.071 500 HG22 VAL 92 HG22 VAL 59 -7.413 -10.863 7.002 501 HG23 VAL 92 HG23 VAL 59 -8.296 -10.246 8.411 502 H VAL 93 H VAL 60 -12.140 -13.143 6.941 503 HA VAL 93 HA VAL 60 -14.221 -11.912 5.219 504 HB VAL 93 HB VAL 60 -12.136 -14.022 4.659 505 HG11 VAL 93 HG11 VAL 60 -14.573 -13.670 2.892 506 HG12 VAL 93 HG12 VAL 60 -13.116 -14.610 2.523 507 HG13 VAL 93 HG13 VAL 60 -14.154 -15.114 3.842 508 HG21 VAL 93 HG21 VAL 60 -11.846 -12.637 2.558 509 HG22 VAL 93 HG22 VAL 60 -12.952 -11.455 3.279 510 HG23 VAL 93 HG23 VAL 60 -11.400 -11.832 4.056 511 H ARG 94 H ARG 61 -15.928 -13.571 4.767 512 HA ARG 94 HA ARG 61 -16.461 -15.429 7.009 513 HB2 ARG 94 HB2 ARG 61 -17.332 -13.456 7.914 514 HB3 ARG 94 HB3 ARG 61 -17.944 -12.865 6.370 515 HG2 ARG 94 HG2 ARG 61 -19.790 -14.459 6.426 516 HG3 ARG 94 HG3 ARG 61 -19.103 -15.279 7.839 517 HD2 ARG 94 HD2 ARG 61 -21.026 -13.759 8.376 518 HD3 ARG 94 HD3 ARG 61 -19.529 -13.414 9.263 519 HE ARG 94 HE ARG 61 -19.908 -11.852 6.801 520 HH11 ARG 94 HH11 ARG 61 -21.018 -11.913 10.145 521 HH12 ARG 94 HH12 ARG 61 -20.860 -10.213 10.404 522 HH21 ARG 94 HH21 ARG 61 -19.322 -9.625 7.243 523 HH22 ARG 94 HH22 ARG 61 -20.054 -8.854 8.612 524 H ILE 95 H ILE 62 -18.214 -16.960 6.334 525 HA ILE 95 HA ILE 62 -19.043 -16.786 3.517 526 HB ILE 95 HB ILE 62 -18.347 -19.107 3.093 527 HG12 ILE 95 HG12 ILE 62 -16.718 -18.906 5.646 528 HG13 ILE 95 HG13 ILE 62 -18.097 -19.983 5.350 529 HG21 ILE 95 HG21 ILE 62 -16.940 -17.072 2.401 530 HG22 ILE 95 HG22 ILE 62 -15.862 -17.475 3.752 531 HG23 ILE 95 HG23 ILE 62 -16.138 -18.636 2.427 532 HD11 ILE 95 HD11 ILE 62 -16.800 -21.101 3.534 533 HD12 ILE 95 HD12 ILE 62 -15.383 -20.117 3.995 534 HD13 ILE 95 HD13 ILE 62 -16.083 -21.241 5.162 535 H GLU 96 H GLU 63 -20.864 -18.039 3.031 536 HA GLU 96 HA GLU 63 -22.151 -19.552 5.261 537 HB2 GLU 96 HB2 GLU 63 -23.466 -17.638 3.284 538 HB3 GLU 96 HB3 GLU 63 -24.341 -18.762 4.317 539 HG2 GLU 96 HG2 GLU 63 -22.585 -16.448 5.252 540 HG3 GLU 96 HG3 GLU 63 -24.342 -16.465 5.205 541 H ALA 97 H ALA 64 -21.613 -21.565 4.528 542 HA ALA 97 HA ALA 64 -21.945 -22.376 1.724 543 HB1 ALA 97 HB1 ALA 64 -21.474 -24.618 2.588 544 HB2 ALA 97 HB2 ALA 64 -20.230 -23.459 3.081 545 HB3 ALA 97 HB3 ALA 64 -21.466 -23.985 4.255 546 H SER 98 H SER 65 -23.862 -22.831 0.858 547 HA SER 98 HA SER 65 -26.311 -22.842 2.460 548 HB2 SER 98 HB2 SER 65 -26.170 -21.692 0.269 549 HB3 SER 98 HB3 SER 65 -25.780 -23.229 -0.530 550 HG SER 98 HG SER 65 -28.062 -22.548 -0.570 551 H ARG 99 H ARG 66 -27.760 -24.587 2.419 552 HA ARG 99 HA ARG 66 -26.783 -27.247 2.745 553 HB2 ARG 99 HB2 ARG 66 -29.105 -27.923 2.843 554 HB3 ARG 99 HB3 ARG 66 -28.874 -26.421 3.726 555 HG2 ARG 99 HG2 ARG 66 -30.827 -25.914 2.638 556 HG3 ARG 99 HG3 ARG 66 -29.673 -25.279 1.472 557 HD2 ARG 99 HD2 ARG 66 -29.896 -27.743 0.412 558 HD3 ARG 99 HD3 ARG 66 -31.391 -27.772 1.325 559 HE ARG 99 HE ARG 66 -30.609 -26.044 -0.960 560 HH11 ARG 99 HH11 ARG 66 -33.159 -26.777 1.419 561 HH12 ARG 99 HH12 ARG 66 -34.413 -25.989 0.528 562 HH21 ARG 99 HH21 ARG 66 -32.264 -25.021 -2.141 563 HH22 ARG 99 HH22 ARG 66 -33.885 -24.959 -1.551 564 H SER 100 H SER 67 -27.778 -25.478 -0.164 565 HA SER 100 HA SER 67 -28.118 -27.731 -1.862 566 HB2 SER 100 HB2 SER 67 -27.283 -24.894 -2.584 567 HB3 SER 100 HB3 SER 67 -28.099 -26.067 -3.632 568 HG SER 100 HG SER 67 -29.527 -24.498 -2.659 569 H GLY 101 H GLY 68 -25.188 -26.700 -0.392 570 HA2 GLY 101 HA2 GLY 68 -23.054 -27.447 -0.726 571 HA3 GLY 101 HA3 GLY 68 -23.569 -28.360 -2.162 572 H GLU 102 H GLU 69 -23.931 -24.882 -1.402 573 HA GLU 102 HA GLU 69 -21.945 -24.092 -3.437 574 HB2 GLU 102 HB2 GLU 69 -24.711 -22.870 -2.991 575 HB3 GLU 102 HB3 GLU 69 -23.432 -22.100 -3.914 576 HG2 GLU 102 HG2 GLU 69 -24.797 -24.745 -4.597 577 HG3 GLU 102 HG3 GLU 69 -25.106 -23.191 -5.355 578 H ILE 103 H ILE 70 -21.206 -21.775 -2.750 579 HA ILE 103 HA ILE 70 -21.760 -21.188 0.058 580 HB ILE 103 HB ILE 70 -19.954 -22.521 0.486 581 HG12 ILE 103 HG12 ILE 70 -19.828 -20.146 1.427 582 HG13 ILE 103 HG13 ILE 70 -18.451 -21.211 1.605 583 HG21 ILE 103 HG21 ILE 70 -19.018 -23.064 -1.629 584 HG22 ILE 103 HG22 ILE 70 -18.337 -21.428 -1.793 585 HG23 ILE 103 HG23 ILE 70 -17.744 -22.524 -0.532 586 HD11 ILE 103 HD11 ILE 70 -18.003 -18.761 0.892 587 HD12 ILE 103 HD12 ILE 70 -17.131 -20.058 0.061 588 HD13 ILE 103 HD13 ILE 70 -18.509 -19.250 -0.718 589 H VAL 104 H VAL 71 -21.809 -19.131 0.517 590 HA VAL 104 HA VAL 71 -21.283 -17.180 -1.664 591 HB VAL 104 HB VAL 71 -23.121 -16.870 0.756 592 HG11 VAL 104 HG11 VAL 71 -24.139 -15.070 -0.599 593 HG12 VAL 104 HG12 VAL 71 -22.413 -14.783 -0.367 594 HG13 VAL 104 HG13 VAL 71 -23.007 -15.410 -1.927 595 HG21 VAL 104 HG21 VAL 71 -23.938 -17.865 -2.007 596 HG22 VAL 104 HG22 VAL 71 -24.069 -18.756 -0.478 597 HG23 VAL 104 HG23 VAL 71 -25.052 -17.319 -0.748 598 H CYS 105 H CYS 72 -19.835 -15.561 -1.171 599 HA CYS 105 HA CYS 72 -18.363 -15.829 1.393 600 HB2 CYS 105 HB2 CYS 72 -17.484 -14.349 -1.107 601 HB3 CYS 105 HB3 CYS 72 -16.471 -15.041 0.179 602 HG CYS 105 HG CYS 72 -18.259 -16.470 -2.226 603 H TYR 106 H TYR 73 -17.786 -13.954 2.596 604 HA TYR 106 HA TYR 73 -19.039 -11.349 1.918 605 HB2 TYR 106 HB2 TYR 73 -19.420 -12.991 4.466 606 HB3 TYR 106 HB3 TYR 73 -19.864 -11.290 4.322 607 HD1 TYR 106 HD1 TYR 73 -21.565 -10.591 2.539 608 HD2 TYR 106 HD2 TYR 73 -20.908 -14.693 3.755 609 HE1 TYR 106 HE1 TYR 73 -23.848 -11.141 1.837 610 HE2 TYR 106 HE2 TYR 73 -23.147 -15.304 2.933 611 HH TYR 106 HH TYR 73 -25.207 -14.500 2.052 612 H ALA 107 H ALA 74 -18.282 -9.697 3.614 613 HA ALA 107 HA ALA 74 -15.371 -10.107 4.106 614 HB1 ALA 107 HB1 ALA 74 -15.370 -7.693 4.508 615 HB2 ALA 107 HB2 ALA 74 -16.134 -8.040 2.944 616 HB3 ALA 107 HB3 ALA 74 -17.143 -7.624 4.345 617 H VAL 108 H VAL 75 -14.519 -9.325 6.172 618 HA VAL 108 HA VAL 75 -16.489 -9.020 8.365 619 HB VAL 108 HB VAL 75 -14.793 -11.303 7.956 620 HG11 VAL 108 HG11 VAL 75 -14.291 -10.045 10.681 621 HG12 VAL 108 HG12 VAL 75 -13.802 -11.661 10.134 622 HG13 VAL 108 HG13 VAL 75 -13.080 -10.230 9.394 623 HG21 VAL 108 HG21 VAL 75 -17.172 -11.292 8.651 624 HG22 VAL 108 HG22 VAL 75 -16.156 -12.260 9.738 625 HG23 VAL 108 HG23 VAL 75 -16.703 -10.639 10.236 626 H ALA 109 H ALA 76 -13.122 -8.248 7.301 627 HA ALA 109 HA ALA 76 -13.192 -6.004 9.253 628 HB1 ALA 109 HB1 ALA 76 -10.915 -8.027 9.111 629 HB2 ALA 109 HB2 ALA 76 -10.988 -6.571 10.115 630 HB3 ALA 109 HB3 ALA 76 -12.109 -7.914 10.430 Start of MODEL 6 1 H1 GLY -2 H1 GLY -2 6.754 1.738 -0.214 2 H2 GLY -2 H2 GLY -2 6.078 1.640 -1.705 3 H3 GLY -2 H3 GLY -2 5.123 1.712 -0.374 4 HA2 GLY -2 HA2 GLY -2 6.946 -0.509 -1.035 5 HA3 GLY -2 HA3 GLY -2 5.907 -0.418 0.397 6 H HIS -1 H HIS -1 5.285 -2.591 -0.629 7 HA HIS -1 HA HIS -1 2.748 -2.271 -2.088 8 HB2 HIS -1 HB2 HIS -1 4.514 -2.532 -3.856 9 HB3 HIS -1 HB3 HIS -1 4.950 -4.082 -3.135 10 HD2 HIS -1 HD2 HIS -1 3.900 -5.993 -4.478 11 HE1 HIS -1 HE1 HIS -1 0.194 -4.236 -5.631 12 HE2 HIS -1 HE2 HIS -1 1.649 -6.329 -5.797 13 H MET 34 H MET 1 1.469 -4.287 -1.915 14 HA MET 34 HA MET 1 1.714 -5.507 0.683 15 HB2 MET 34 HB2 MET 1 0.035 -6.284 -1.737 16 HB3 MET 34 HB3 MET 1 -0.104 -6.960 -0.116 17 HG2 MET 34 HG2 MET 1 -1.646 -5.453 0.321 18 HG3 MET 34 HG3 MET 1 -0.369 -4.250 0.364 19 HE1 MET 34 HE1 MET 1 -3.767 -4.686 -0.597 20 HE2 MET 34 HE2 MET 1 -4.003 -4.149 -2.271 21 HE3 MET 34 HE3 MET 1 -3.420 -5.776 -1.966 22 H LEU 35 H LEU 2 2.223 -7.687 1.201 23 HA LEU 35 HA LEU 2 4.131 -9.136 -0.536 24 HB2 LEU 35 HB2 LEU 2 2.955 -9.576 2.250 25 HB3 LEU 35 HB3 LEU 2 3.720 -10.895 1.383 26 HG LEU 35 HG LEU 2 5.830 -9.624 1.185 27 HD11 LEU 35 HD11 LEU 2 5.076 -7.300 1.301 28 HD12 LEU 35 HD12 LEU 2 4.451 -7.548 2.945 29 HD13 LEU 35 HD13 LEU 2 6.196 -7.619 2.621 30 HD21 LEU 35 HD21 LEU 2 5.447 -11.199 3.050 31 HD22 LEU 35 HD22 LEU 2 6.487 -9.860 3.547 32 HD23 LEU 35 HD23 LEU 2 4.775 -9.885 4.039 33 H GLU 36 H GLU 3 3.561 -11.569 -0.996 34 HA GLU 36 HA GLU 3 1.438 -11.509 -2.772 35 HB2 GLU 36 HB2 GLU 3 3.320 -13.150 -2.859 36 HB3 GLU 36 HB3 GLU 3 2.634 -13.994 -1.474 37 HG2 GLU 36 HG2 GLU 3 2.113 -15.183 -3.495 38 HG3 GLU 36 HG3 GLU 3 0.641 -14.597 -2.729 39 H ALA 37 H ALA 4 1.376 -13.126 0.403 40 HA ALA 37 HA ALA 4 -1.371 -13.869 0.062 41 HB1 ALA 37 HB1 ALA 4 0.220 -13.727 2.653 42 HB2 ALA 37 HB2 ALA 4 -1.324 -14.578 2.405 43 HB3 ALA 37 HB3 ALA 4 0.130 -15.126 1.551 44 H ASP 38 H ASP 5 0.198 -11.016 1.481 45 HA ASP 38 HA ASP 5 -2.145 -10.001 2.827 46 HB2 ASP 38 HB2 ASP 5 0.218 -9.388 3.371 47 HB3 ASP 38 HB3 ASP 5 0.331 -8.526 1.839 48 H LEU 39 H LEU 6 -0.717 -9.529 -0.393 49 HA LEU 39 HA LEU 6 -2.268 -7.439 -1.416 50 HB2 LEU 39 HB2 LEU 6 -0.247 -8.396 -2.526 51 HB3 LEU 39 HB3 LEU 6 -1.084 -9.904 -2.759 52 HG LEU 39 HG LEU 6 -2.794 -8.588 -4.206 53 HD11 LEU 39 HD11 LEU 6 -2.086 -6.313 -3.554 54 HD12 LEU 39 HD12 LEU 6 -0.472 -6.612 -4.208 55 HD13 LEU 39 HD13 LEU 6 -1.886 -6.566 -5.285 56 HD21 LEU 39 HD21 LEU 6 0.091 -8.926 -5.120 57 HD22 LEU 39 HD22 LEU 6 -1.161 -10.187 -5.116 58 HD23 LEU 39 HD23 LEU 6 -1.324 -8.782 -6.183 59 H VAL 40 H VAL 7 -2.683 -10.957 -1.871 60 HA VAL 40 HA VAL 7 -5.161 -10.688 -3.199 61 HB VAL 40 HB VAL 7 -5.240 -13.144 -3.062 62 HG11 VAL 40 HG11 VAL 7 -3.226 -13.558 -4.299 63 HG12 VAL 40 HG12 VAL 7 -3.711 -11.905 -4.650 64 HG13 VAL 40 HG13 VAL 7 -2.376 -12.220 -3.533 65 HG21 VAL 40 HG21 VAL 7 -3.495 -14.420 -1.862 66 HG22 VAL 40 HG22 VAL 7 -2.925 -12.923 -1.124 67 HG23 VAL 40 HG23 VAL 7 -4.540 -13.549 -0.759 68 H SER 41 H SER 8 -4.421 -11.312 0.296 69 HA SER 41 HA SER 8 -7.132 -11.766 1.007 70 HB2 SER 41 HB2 SER 8 -4.856 -10.705 2.741 71 HB3 SER 41 HB3 SER 8 -6.391 -11.381 3.320 72 HG SER 41 HG SER 8 -4.217 -12.675 2.073 73 H LYS 42 H LYS 9 -5.241 -8.626 1.047 74 HA LYS 42 HA LYS 9 -7.502 -7.166 2.169 75 HB2 LYS 42 HB2 LYS 9 -4.958 -6.341 0.708 76 HB3 LYS 42 HB3 LYS 9 -6.194 -5.158 1.178 77 HG2 LYS 42 HG2 LYS 9 -6.021 -5.747 3.526 78 HG3 LYS 42 HG3 LYS 9 -4.892 -7.077 3.154 79 HD2 LYS 42 HD2 LYS 9 -3.255 -5.494 2.249 80 HD3 LYS 42 HD3 LYS 9 -4.327 -4.121 2.598 81 HE2 LYS 42 HE2 LYS 9 -4.132 -4.419 4.965 82 HE3 LYS 42 HE3 LYS 9 -3.497 -6.058 4.783 83 HZ1 LYS 42 HZ1 LYS 9 -2.017 -3.603 4.021 84 HZ2 LYS 42 HZ2 LYS 9 -1.731 -4.539 5.337 85 HZ3 LYS 42 HZ3 LYS 9 -1.481 -5.163 3.840 86 H MET 43 H MET 10 -6.406 -7.784 -1.239 87 HA MET 43 HA MET 10 -8.448 -6.028 -2.293 88 HB2 MET 43 HB2 MET 10 -6.763 -8.207 -3.572 89 HB3 MET 43 HB3 MET 10 -7.940 -7.226 -4.463 90 HG2 MET 43 HG2 MET 10 -6.774 -5.162 -3.610 91 HG3 MET 43 HG3 MET 10 -5.518 -6.207 -2.938 92 HE1 MET 43 HE1 MET 10 -4.945 -3.737 -4.815 93 HE2 MET 43 HE2 MET 10 -3.597 -4.802 -4.324 94 HE3 MET 43 HE3 MET 10 -3.811 -4.376 -6.025 95 H LEU 44 H LEU 11 -8.351 -9.605 -1.797 96 HA LEU 44 HA LEU 11 -10.932 -10.328 -2.625 97 HB2 LEU 44 HB2 LEU 11 -9.284 -11.947 -1.805 98 HB3 LEU 44 HB3 LEU 11 -9.179 -11.126 -0.261 99 HG LEU 44 HG LEU 11 -11.576 -11.793 0.192 100 HD11 LEU 44 HD11 LEU 11 -11.007 -13.610 -2.186 101 HD12 LEU 44 HD12 LEU 11 -12.400 -13.741 -1.084 102 HD13 LEU 44 HD13 LEU 11 -12.221 -12.312 -2.136 103 HD21 LEU 44 HD21 LEU 11 -9.421 -13.891 -0.131 104 HD22 LEU 44 HD22 LEU 11 -9.726 -12.889 1.294 105 HD23 LEU 44 HD23 LEU 11 -10.917 -14.120 0.807 106 H ARG 45 H ARG 12 -9.920 -9.226 0.607 107 HA ARG 45 HA ARG 12 -12.441 -8.941 1.806 108 HB2 ARG 45 HB2 ARG 12 -10.542 -8.953 3.109 109 HB3 ARG 45 HB3 ARG 12 -9.693 -7.761 2.162 110 HG2 ARG 45 HG2 ARG 12 -12.154 -6.877 3.638 111 HG3 ARG 45 HG3 ARG 12 -10.648 -7.200 4.513 112 HD2 ARG 45 HD2 ARG 12 -9.527 -5.620 2.732 113 HD3 ARG 45 HD3 ARG 12 -11.203 -5.036 2.494 114 HE ARG 45 HE ARG 12 -10.396 -5.339 5.270 115 HH11 ARG 45 HH21 ARG 12 -10.029 -2.945 2.643 116 HH12 ARG 45 HH22 ARG 12 -10.031 -1.606 3.731 117 HH21 ARG 45 HH11 ARG 12 -10.547 -3.711 6.596 118 HH22 ARG 45 HH12 ARG 12 -10.273 -2.039 6.121 119 H ALA 46 H ALA 13 -10.638 -6.487 -0.159 120 HA ALA 46 HA ALA 13 -12.557 -4.498 0.404 121 HB1 ALA 46 HB1 ALA 13 -10.248 -4.017 -0.436 122 HB2 ALA 46 HB2 ALA 13 -10.681 -4.735 -2.005 123 HB3 ALA 46 HB3 ALA 13 -11.483 -3.247 -1.465 124 H VAL 47 H VAL 14 -12.357 -6.842 -2.329 125 HA VAL 47 HA VAL 14 -14.615 -5.795 -3.749 126 HB VAL 47 HB VAL 14 -13.492 -8.635 -3.555 127 HG11 VAL 47 HG11 VAL 14 -14.665 -9.102 -5.650 128 HG12 VAL 47 HG12 VAL 14 -15.829 -8.687 -4.391 129 HG13 VAL 47 HG13 VAL 14 -15.419 -7.481 -5.627 130 HG21 VAL 47 HG21 VAL 14 -12.535 -8.042 -5.823 131 HG22 VAL 47 HG22 VAL 14 -13.094 -6.380 -5.587 132 HG23 VAL 47 HG23 VAL 14 -11.860 -7.080 -4.521 133 H LEU 48 H LEU 15 -14.315 -8.197 -1.094 134 HA LEU 48 HA LEU 15 -17.086 -8.841 -0.998 135 HB2 LEU 48 HB2 LEU 15 -14.911 -8.933 1.147 136 HB3 LEU 48 HB3 LEU 15 -16.496 -9.644 1.333 137 HG LEU 48 HG LEU 15 -14.751 -10.460 -1.017 138 HD11 LEU 48 HD11 LEU 15 -13.405 -10.752 0.978 139 HD12 LEU 48 HD12 LEU 15 -14.751 -11.538 1.822 140 HD13 LEU 48 HD13 LEU 15 -13.975 -12.343 0.429 141 HD21 LEU 48 HD21 LEU 15 -16.880 -11.923 0.588 142 HD22 LEU 48 HD22 LEU 15 -17.193 -11.102 -0.947 143 HD23 LEU 48 HD23 LEU 15 -16.074 -12.485 -0.886 144 H GLN 49 H GLN 16 -15.217 -6.247 0.664 145 HA GLN 49 HA GLN 16 -17.388 -5.417 2.333 146 HB2 GLN 49 HB2 GLN 16 -14.870 -4.015 1.342 147 HB3 GLN 49 HB3 GLN 16 -16.041 -3.193 2.363 148 HG2 GLN 49 HG2 GLN 16 -14.621 -5.771 3.152 149 HG3 GLN 49 HG3 GLN 16 -14.082 -4.160 3.587 150 HE21 GLN 49 HE22 GLN 16 -14.403 -5.693 5.727 151 HE22 GLN 49 HE21 GLN 16 -15.922 -5.385 6.552 152 H SER 50 H SER 17 -16.362 -4.376 -0.995 153 HA SER 50 HA SER 17 -18.445 -2.445 -1.317 154 HB2 SER 50 HB2 SER 17 -17.041 -4.178 -3.392 155 HB3 SER 50 HB3 SER 17 -18.002 -2.719 -3.710 156 HG SER 50 HG SER 17 -15.764 -2.216 -3.612 157 H HIS 51 H HIS 18 -18.331 -5.985 -1.829 158 HA HIS 51 HA HIS 18 -21.036 -5.976 -2.971 159 HB2 HIS 51 HB2 HIS 18 -18.885 -8.096 -2.839 160 HB3 HIS 51 HB3 HIS 18 -20.460 -8.277 -3.600 161 HD2 HIS 51 HD2 HIS 18 -18.819 -8.814 -5.775 162 HE1 HIS 51 HE1 HIS 18 -18.157 -4.745 -6.767 163 HE2 HIS 51 HE2 HIS 18 -18.039 -7.117 -7.646 164 H LYS 52 H LYS 19 -21.686 -5.334 -0.582 165 HA LYS 52 HA LYS 19 -21.597 -7.226 1.513 166 HB2 LYS 52 HB2 LYS 19 -23.615 -5.050 0.815 167 HB3 LYS 52 HB3 LYS 19 -23.693 -5.954 2.321 168 HG2 LYS 52 HG2 LYS 19 -21.376 -4.171 1.459 169 HG3 LYS 52 HG3 LYS 19 -22.619 -3.778 2.649 170 HD2 LYS 52 HD2 LYS 19 -21.849 -5.773 4.038 171 HD3 LYS 52 HD3 LYS 19 -20.539 -5.996 2.883 172 HE2 LYS 52 HE2 LYS 19 -19.592 -4.804 4.701 173 HE3 LYS 52 HE3 LYS 19 -19.711 -3.675 3.351 174 HZ1 LYS 52 HZ1 LYS 19 -21.621 -3.799 5.637 175 HZ2 LYS 52 HZ2 LYS 19 -20.435 -2.696 5.461 176 HZ3 LYS 52 HZ3 LYS 19 -21.679 -2.704 4.411 177 H ASN 53 H ASN 20 -23.768 -7.166 -1.241 178 HA ASN 53 HA ASN 20 -25.767 -8.976 -0.335 179 HB2 ASN 53 HB2 ASN 20 -25.970 -7.786 -2.445 180 HB3 ASN 53 HB3 ASN 20 -24.456 -8.450 -3.046 181 HD21 ASN 53 HD22 ASN 20 -24.360 -10.678 -3.749 182 HD22 ASN 53 HD21 ASN 20 -25.836 -11.496 -4.208 183 H GLY 54 H GLY 21 -22.364 -9.531 -0.888 184 HA2 GLY 54 HA2 GLY 21 -21.136 -11.384 -0.539 185 HA3 GLY 54 HA3 GLY 21 -22.574 -12.416 -0.433 186 H ILE 55 H ILE 22 -20.487 -13.305 -1.879 187 HA ILE 55 HA ILE 22 -21.463 -13.299 -4.676 188 HB ILE 55 HB ILE 22 -18.874 -13.218 -5.253 189 HG12 ILE 55 HG12 ILE 22 -18.903 -11.525 -2.701 190 HG13 ILE 55 HG13 ILE 22 -17.953 -12.968 -3.007 191 HG21 ILE 55 HG21 ILE 22 -20.739 -11.603 -5.968 192 HG22 ILE 55 HG22 ILE 22 -20.173 -10.547 -4.664 193 HG23 ILE 55 HG23 ILE 22 -19.074 -11.034 -6.004 194 HD11 ILE 55 HD11 ILE 22 -16.491 -11.069 -3.251 195 HD12 ILE 55 HD12 ILE 22 -16.834 -11.572 -4.920 196 HD13 ILE 55 HD13 ILE 22 -17.670 -10.180 -4.210 197 H VAL 56 H VAL 23 -21.674 -15.280 -5.314 198 HA VAL 56 HA VAL 23 -21.006 -17.523 -3.707 199 HB VAL 56 HB VAL 23 -21.687 -18.803 -5.774 200 HG11 VAL 56 HG11 VAL 23 -24.046 -18.085 -5.741 201 HG12 VAL 56 HG12 VAL 23 -23.342 -18.223 -4.129 202 HG13 VAL 56 HG13 VAL 23 -23.583 -16.613 -4.861 203 HG21 VAL 56 HG21 VAL 23 -22.208 -16.050 -7.025 204 HG22 VAL 56 HG22 VAL 23 -20.916 -17.163 -7.495 205 HG23 VAL 56 HG23 VAL 23 -22.604 -17.636 -7.709 206 H LEU 57 H LEU 24 -19.307 -19.222 -4.062 207 HA LEU 57 HA LEU 24 -16.895 -18.077 -4.397 208 HB2 LEU 57 HB2 LEU 24 -15.734 -19.957 -4.129 209 HB3 LEU 57 HB3 LEU 24 -17.243 -20.256 -3.353 210 HG LEU 57 HG LEU 24 -17.895 -21.680 -5.409 211 HD11 LEU 57 HD11 LEU 24 -16.402 -21.171 -7.199 212 HD12 LEU 57 HD12 LEU 24 -15.005 -21.083 -6.120 213 HD13 LEU 57 HD13 LEU 24 -15.735 -22.643 -6.573 214 HD21 LEU 57 HD21 LEU 24 -15.472 -22.427 -3.713 215 HD22 LEU 57 HD22 LEU 24 -17.177 -22.707 -3.322 216 HD23 LEU 57 HD23 LEU 24 -16.442 -23.591 -4.650 217 HA PRO 58 HA PRO 25 -16.145 -18.929 -8.988 218 HB2 PRO 58 HB2 PRO 25 -18.218 -18.954 -10.778 219 HB3 PRO 58 HB3 PRO 25 -17.565 -20.417 -9.984 220 HG2 PRO 58 HG2 PRO 25 -20.018 -18.824 -9.200 221 HG3 PRO 58 HG3 PRO 25 -19.848 -20.595 -9.355 222 HD2 PRO 58 HD2 PRO 25 -19.683 -19.364 -6.953 223 HD3 PRO 58 HD3 PRO 25 -18.674 -20.768 -7.338 224 H ARG 59 H ARG 26 -18.992 -16.945 -8.097 225 HA ARG 59 HA ARG 26 -18.306 -14.689 -9.795 226 HB2 ARG 59 HB2 ARG 26 -20.590 -15.251 -8.901 227 HB3 ARG 59 HB3 ARG 26 -20.037 -14.781 -7.283 228 HG2 ARG 59 HG2 ARG 26 -19.650 -12.485 -8.096 229 HG3 ARG 59 HG3 ARG 26 -20.088 -12.989 -9.746 230 HD2 ARG 59 HD2 ARG 26 -22.370 -13.516 -8.998 231 HD3 ARG 59 HD3 ARG 26 -21.966 -13.008 -7.342 232 HE ARG 59 HE ARG 26 -21.300 -10.868 -9.033 233 HH11 ARG 59 HH11 ARG 26 -24.286 -12.589 -8.106 234 HH12 ARG 59 HH12 ARG 26 -25.306 -11.214 -8.318 235 HH21 ARG 59 HH21 ARG 26 -22.674 -9.053 -9.344 236 HH22 ARG 59 HH22 ARG 26 -24.369 -9.171 -9.051 237 H LEU 60 H LEU 27 -17.492 -15.751 -6.501 238 HA LEU 60 HA LEU 27 -16.189 -13.463 -5.581 239 HB2 LEU 60 HB2 LEU 27 -16.633 -15.493 -4.194 240 HB3 LEU 60 HB3 LEU 27 -15.420 -16.402 -5.061 241 HG LEU 60 HG LEU 27 -14.714 -15.686 -2.879 242 HD11 LEU 60 HD11 LEU 27 -13.066 -16.172 -4.696 243 HD12 LEU 60 HD12 LEU 27 -12.870 -14.408 -4.905 244 HD13 LEU 60 HD13 LEU 27 -12.491 -15.173 -3.360 245 HD21 LEU 60 HD21 LEU 27 -14.237 -13.425 -2.309 246 HD22 LEU 60 HD22 LEU 27 -14.527 -12.845 -3.968 247 HD23 LEU 60 HD23 LEU 27 -15.862 -13.450 -2.951 248 H GLN 61 H GLN 28 -14.778 -16.317 -7.310 249 HA GLN 61 HA GLN 28 -12.215 -15.311 -7.792 250 HB2 GLN 61 HB2 GLN 28 -14.021 -17.307 -9.112 251 HB3 GLN 61 HB3 GLN 28 -12.652 -16.765 -10.063 252 HG2 GLN 61 HG2 GLN 28 -12.169 -17.672 -7.210 253 HG3 GLN 61 HG3 GLN 28 -12.492 -18.876 -8.457 254 HE21 GLN 61 HE22 GLN 28 -10.564 -19.712 -9.401 255 HE22 GLN 61 HE21 GLN 28 -9.117 -18.768 -9.626 256 H GLY 62 H GLY 29 -15.128 -14.846 -9.896 257 HA2 GLY 62 HA2 GLY 29 -13.838 -13.420 -11.934 258 HA3 GLY 62 HA3 GLY 29 -15.546 -13.257 -11.496 259 H GLU 63 H GLU 30 -15.659 -12.006 -9.100 260 HA GLU 63 HA GLU 30 -15.009 -9.316 -9.888 261 HB2 GLU 63 HB2 GLU 30 -16.078 -10.472 -7.277 262 HB3 GLU 63 HB3 GLU 30 -15.967 -8.744 -7.643 263 HG2 GLU 63 HG2 GLU 30 -17.616 -10.753 -9.246 264 HG3 GLU 63 HG3 GLU 30 -18.243 -9.673 -8.007 265 H TYR 64 H TYR 31 -13.608 -11.566 -7.500 266 HA TYR 64 HA TYR 31 -11.649 -9.947 -6.261 267 HB2 TYR 64 HB2 TYR 31 -12.005 -12.183 -5.488 268 HB3 TYR 64 HB3 TYR 31 -11.757 -12.851 -7.102 269 HD1 TYR 64 HD2 TYR 31 -9.603 -13.212 -8.094 270 HD2 TYR 64 HD1 TYR 31 -10.011 -11.552 -4.135 271 HE1 TYR 64 HE2 TYR 31 -7.217 -13.565 -7.693 272 HE2 TYR 64 HE1 TYR 31 -7.619 -12.021 -3.691 273 HH TYR 64 HH TYR 31 -5.465 -13.440 -6.241 274 H ARG 65 H ARG 32 -11.471 -11.874 -9.304 275 HA ARG 65 HA ARG 32 -8.849 -11.038 -9.929 276 HB2 ARG 65 HB2 ARG 32 -9.827 -13.053 -10.778 277 HB3 ARG 65 HB3 ARG 32 -11.043 -12.162 -11.710 278 HG2 ARG 65 HG2 ARG 32 -9.440 -11.264 -13.225 279 HG3 ARG 65 HG3 ARG 32 -8.087 -11.583 -12.127 280 HD2 ARG 65 HD2 ARG 32 -8.582 -14.037 -12.380 281 HD3 ARG 65 HD3 ARG 32 -9.660 -13.625 -13.726 282 HE ARG 65 HE ARG 32 -6.733 -13.236 -13.465 283 HH11 ARG 65 HH21 ARG 32 -9.538 -13.276 -15.649 284 HH12 ARG 65 HH22 ARG 32 -8.595 -13.193 -17.094 285 HH21 ARG 65 HH11 ARG 32 -5.471 -13.168 -15.399 286 HH22 ARG 65 HH12 ARG 32 -6.234 -13.143 -16.948 287 H SER 66 H SER 33 -12.042 -9.573 -10.856 288 HA SER 66 HA SER 33 -10.987 -7.685 -12.638 289 HB2 SER 66 HB2 SER 33 -13.280 -7.275 -10.664 290 HB3 SER 66 HB3 SER 33 -12.949 -6.311 -12.114 291 HG SER 66 HG SER 33 -14.508 -7.895 -12.586 292 H LEU 67 H LEU 34 -10.990 -7.630 -9.007 293 HA LEU 67 HA LEU 34 -9.739 -4.983 -9.053 294 HB2 LEU 67 HB2 LEU 34 -11.175 -5.665 -7.188 295 HB3 LEU 67 HB3 LEU 34 -10.014 -6.925 -6.745 296 HG LEU 67 HG LEU 34 -8.302 -5.240 -6.246 297 HD11 LEU 67 HD11 LEU 34 -8.891 -2.803 -6.175 298 HD12 LEU 67 HD12 LEU 34 -8.802 -3.428 -7.814 299 HD13 LEU 67 HD13 LEU 34 -10.395 -3.166 -7.058 300 HD21 LEU 67 HD21 LEU 34 -10.955 -4.523 -4.936 301 HD22 LEU 67 HD22 LEU 34 -9.898 -5.871 -4.476 302 HD23 LEU 67 HD23 LEU 34 -9.339 -4.208 -4.276 303 H THR 68 H THR 35 -8.438 -8.355 -8.349 304 HA THR 68 HA THR 35 -5.835 -7.286 -7.689 305 HB THR 68 HB THR 35 -5.227 -9.767 -7.814 306 HG1 THR 68 HG1 THR 35 -7.167 -11.128 -7.975 307 HG21 THR 68 HG21 THR 35 -6.424 -10.368 -5.822 308 HG22 THR 68 HG22 THR 35 -5.991 -8.678 -5.710 309 HG23 THR 68 HG23 THR 35 -7.669 -9.132 -6.113 310 H GLY 69 H GLY 36 -7.285 -8.638 -10.647 311 HA2 GLY 69 HA2 GLY 36 -6.454 -8.760 -12.792 312 HA3 GLY 69 HA3 GLY 36 -4.906 -8.057 -12.263 313 H ASP 70 H ASP 37 -6.260 -10.766 -10.382 314 HA ASP 70 HA ASP 37 -4.534 -12.753 -11.736 315 HB2 ASP 70 HB2 ASP 37 -3.259 -11.556 -9.826 316 HB3 ASP 70 HB3 ASP 37 -4.409 -12.323 -8.718 317 H TRP 71 H TRP 38 -4.975 -14.969 -10.735 318 HA TRP 71 HA TRP 38 -7.846 -15.305 -10.066 319 HB2 TRP 71 HB2 TRP 38 -5.639 -17.324 -10.648 320 HB3 TRP 71 HB3 TRP 38 -7.297 -17.729 -10.241 321 HD1 TRP 71 HD1 TRP 38 -5.197 -17.370 -13.137 322 HE1 TRP 71 HE1 TRP 38 -6.531 -17.162 -15.315 323 HE3 TRP 71 HE3 TRP 38 -9.768 -16.274 -11.149 324 HZ2 TRP 71 HZ2 TRP 38 -9.278 -16.565 -16.093 325 HZ3 TRP 71 HZ3 TRP 38 -11.686 -15.759 -12.611 326 HH2 TRP 71 HH2 TRP 38 -11.482 -15.952 -15.081 327 H ILE 72 H ILE 39 -8.364 -16.530 -8.119 328 HA ILE 72 HA ILE 39 -7.033 -15.814 -5.759 329 HB ILE 72 HB ILE 39 -8.909 -18.067 -6.494 330 HG12 ILE 72 HG12 ILE 39 -9.676 -15.599 -6.442 331 HG13 ILE 72 HG13 ILE 39 -10.649 -16.819 -5.644 332 HG21 ILE 72 HG21 ILE 39 -9.289 -18.458 -4.039 333 HG22 ILE 72 HG22 ILE 39 -7.735 -18.999 -4.668 334 HG23 ILE 72 HG23 ILE 39 -7.814 -17.505 -3.718 335 HD11 ILE 72 HD11 ILE 39 -8.682 -15.088 -4.113 336 HD12 ILE 72 HD12 ILE 39 -10.366 -14.629 -4.433 337 HD13 ILE 72 HD13 ILE 39 -10.028 -16.080 -3.487 338 HA PRO 73 HA PRO 40 -3.641 -18.720 -6.220 339 HB2 PRO 73 HB2 PRO 40 -2.017 -17.999 -4.186 340 HB3 PRO 73 HB3 PRO 40 -2.404 -16.862 -5.489 341 HG2 PRO 73 HG2 PRO 40 -3.812 -17.091 -2.813 342 HG3 PRO 73 HG3 PRO 40 -3.054 -15.651 -3.569 343 HD2 PRO 73 HD2 PRO 40 -5.740 -16.223 -3.795 344 HD3 PRO 73 HD3 PRO 40 -4.820 -15.451 -5.122 345 H PHE 74 H PHE 41 -6.012 -20.037 -5.262 346 HA PHE 74 HA PHE 41 -5.834 -20.886 -2.515 347 HB2 PHE 74 HB2 PHE 41 -7.595 -22.408 -2.969 348 HB3 PHE 74 HB3 PHE 41 -7.992 -20.903 -3.737 349 HD1 PHE 74 HD2 PHE 41 -7.660 -20.718 -6.334 350 HD2 PHE 74 HD1 PHE 41 -7.536 -24.441 -4.158 351 HE1 PHE 74 HE2 PHE 41 -8.116 -21.963 -8.428 352 HE2 PHE 74 HE1 PHE 41 -8.038 -25.675 -6.253 353 HZ PHE 74 HZ PHE 41 -8.326 -24.434 -8.393 354 H LYS 75 H LYS 42 -5.217 -22.802 -5.486 355 HA LYS 75 HA LYS 42 -4.040 -24.968 -4.006 356 HB2 LYS 75 HB2 LYS 42 -5.274 -24.958 -6.254 357 HB3 LYS 75 HB3 LYS 42 -3.802 -24.314 -6.981 358 HG2 LYS 75 HG2 LYS 42 -2.566 -26.359 -6.226 359 HG3 LYS 75 HG3 LYS 42 -4.036 -26.945 -5.417 360 HD2 LYS 75 HD2 LYS 42 -5.203 -27.069 -7.597 361 HD3 LYS 75 HD3 LYS 42 -3.752 -26.451 -8.421 362 HE2 LYS 75 HE2 LYS 42 -2.453 -28.415 -7.587 363 HE3 LYS 75 HE3 LYS 42 -3.903 -29.028 -6.775 364 HZ1 LYS 75 HZ1 LYS 42 -4.947 -29.263 -8.955 365 HZ2 LYS 75 HZ2 LYS 42 -3.613 -28.686 -9.712 366 HZ3 LYS 75 HZ3 LYS 42 -3.547 -30.101 -8.909 367 H GLN 76 H GLN 43 -2.859 -22.043 -5.425 368 HA GLN 76 HA GLN 43 -0.092 -22.710 -5.700 369 HB2 GLN 76 HB2 GLN 43 -1.438 -19.974 -5.482 370 HB3 GLN 76 HB3 GLN 43 0.152 -20.324 -6.124 371 HG2 GLN 76 HG2 GLN 43 -0.979 -20.096 -8.081 372 HG3 GLN 76 HG3 GLN 43 -1.139 -21.825 -7.888 373 HE21 GLN 76 HE22 GLN 43 -2.900 -19.454 -9.189 374 HE22 GLN 76 HE21 GLN 43 -4.497 -19.790 -8.526 375 H LEU 77 H LEU 44 -2.053 -21.112 -3.114 376 HA LEU 77 HA LEU 44 0.217 -20.900 -1.263 377 HB2 LEU 77 HB2 LEU 44 -2.751 -20.480 -0.956 378 HB3 LEU 77 HB3 LEU 44 -1.589 -20.310 0.365 379 HG LEU 77 HG LEU 44 -1.531 -18.665 -2.184 380 HD11 LEU 77 HD11 LEU 44 -2.457 -17.836 0.609 381 HD12 LEU 77 HD12 LEU 44 -2.409 -16.805 -0.839 382 HD13 LEU 77 HD13 LEU 44 -3.528 -18.171 -0.777 383 HD21 LEU 77 HD21 LEU 44 0.048 -18.369 0.398 384 HD22 LEU 77 HD22 LEU 44 0.698 -18.761 -1.213 385 HD23 LEU 77 HD23 LEU 44 0.002 -17.170 -0.911 386 H GLY 78 H GLY 45 -2.321 -23.268 -2.031 387 HA2 GLY 78 HA2 GLY 45 -1.546 -25.560 -1.720 388 HA3 GLY 78 HA3 GLY 45 -0.988 -25.138 -0.108 389 H TYR 79 H TYR 46 -4.027 -23.691 -0.964 390 HA TYR 79 HA TYR 46 -5.520 -25.409 0.890 391 HB2 TYR 79 HB2 TYR 46 -6.444 -23.104 -0.887 392 HB3 TYR 79 HB3 TYR 46 -7.341 -23.852 0.437 393 HD1 TYR 79 HD2 TYR 46 -6.425 -23.680 2.812 394 HD2 TYR 79 HD1 TYR 46 -4.870 -21.356 -0.472 395 HE1 TYR 79 HE2 TYR 46 -5.317 -22.191 4.404 396 HE2 TYR 79 HE1 TYR 46 -3.771 -19.819 1.116 397 HH TYR 79 HH TYR 46 -3.929 -20.292 4.695 398 HA PRO 80 HA PRO 47 -6.443 -27.964 -2.573 399 HB2 PRO 80 HB2 PRO 47 -8.721 -29.364 -1.804 400 HB3 PRO 80 HB3 PRO 47 -7.101 -29.639 -1.095 401 HG2 PRO 80 HG2 PRO 47 -9.307 -27.842 -0.019 402 HG3 PRO 80 HG3 PRO 47 -8.385 -29.111 0.856 403 HD2 PRO 80 HD2 PRO 47 -7.612 -26.528 1.039 404 HD3 PRO 80 HD3 PRO 47 -6.385 -27.798 0.828 405 H THR 81 H THR 48 -9.101 -25.822 -1.472 406 HA THR 81 HA THR 48 -10.132 -25.683 -4.251 407 HB THR 81 HB THR 48 -12.432 -25.864 -3.129 408 HG1 THR 81 HG1 THR 48 -12.208 -26.960 -0.972 409 HG21 THR 81 HG21 THR 48 -10.776 -28.360 -2.596 410 HG22 THR 81 HG22 THR 48 -12.510 -28.242 -2.954 411 HG23 THR 81 HG23 THR 48 -11.325 -27.878 -4.220 412 H LEU 82 H LEU 49 -11.683 -23.864 -4.494 413 HA LEU 82 HA LEU 49 -10.732 -21.371 -3.431 414 HB2 LEU 82 HB2 LEU 49 -13.404 -22.172 -4.709 415 HB3 LEU 82 HB3 LEU 49 -13.050 -20.539 -4.199 416 HG LEU 82 HG LEU 49 -12.764 -20.662 -6.552 417 HD11 LEU 82 HD11 LEU 49 -10.012 -20.558 -5.261 418 HD12 LEU 82 HD12 LEU 49 -10.464 -19.869 -6.815 419 HD13 LEU 82 HD13 LEU 49 -11.198 -19.223 -5.331 420 HD21 LEU 82 HD21 LEU 49 -12.302 -23.107 -6.787 421 HD22 LEU 82 HD22 LEU 49 -11.215 -22.081 -7.740 422 HD23 LEU 82 HD23 LEU 49 -10.626 -22.811 -6.247 423 H GLU 83 H GLU 50 -13.417 -23.562 -2.446 424 HA GLU 83 HA GLU 50 -14.327 -21.793 -0.408 425 HB2 GLU 83 HB2 GLU 50 -15.572 -23.594 0.513 426 HB3 GLU 83 HB3 GLU 50 -15.679 -23.679 -1.237 427 HG2 GLU 83 HG2 GLU 50 -14.032 -25.520 -1.256 428 HG3 GLU 83 HG3 GLU 50 -13.881 -25.427 0.506 429 H ALA 84 H ALA 51 -11.835 -24.454 -0.266 430 HA ALA 84 HA ALA 51 -11.403 -24.194 2.517 431 HB1 ALA 84 HB1 ALA 51 -9.281 -25.354 2.091 432 HB2 ALA 84 HB2 ALA 51 -10.625 -26.104 1.219 433 HB3 ALA 84 HB3 ALA 51 -9.467 -25.070 0.342 434 H TYR 85 H TYR 52 -9.804 -22.475 -0.210 435 HA TYR 85 HA TYR 52 -8.018 -20.895 1.339 436 HB2 TYR 85 HB2 TYR 52 -7.812 -20.901 -1.028 437 HB3 TYR 85 HB3 TYR 52 -9.486 -20.412 -1.274 438 HD1 TYR 85 HD1 TYR 52 -6.195 -19.248 0.077 439 HD2 TYR 85 HD2 TYR 52 -10.081 -18.115 -1.423 440 HE1 TYR 85 HE1 TYR 52 -5.493 -16.892 0.134 441 HE2 TYR 85 HE2 TYR 52 -9.396 -15.739 -1.363 442 HH TYR 85 HH TYR 52 -6.173 -14.686 -0.148 443 H LEU 86 H LEU 53 -11.465 -20.197 0.389 444 HA LEU 86 HA LEU 53 -11.602 -17.768 1.859 445 HB2 LEU 86 HB2 LEU 53 -13.748 -19.699 0.924 446 HB3 LEU 86 HB3 LEU 53 -14.073 -18.089 1.574 447 HG LEU 86 HG LEU 53 -12.259 -18.406 -0.826 448 HD11 LEU 86 HD11 LEU 53 -15.281 -18.361 -0.753 449 HD12 LEU 86 HD12 LEU 53 -14.324 -17.962 -2.210 450 HD13 LEU 86 HD13 LEU 53 -14.232 -19.574 -1.493 451 HD21 LEU 86 HD21 LEU 53 -14.081 -16.145 0.107 452 HD22 LEU 86 HD22 LEU 53 -12.321 -16.212 0.362 453 HD23 LEU 86 HD23 LEU 53 -12.963 -16.122 -1.279 454 H ARG 87 H ARG 54 -12.351 -21.115 2.921 455 HA ARG 87 HA ARG 54 -13.336 -20.498 5.564 456 HB2 ARG 87 HB2 ARG 54 -11.690 -22.868 4.538 457 HB3 ARG 87 HB3 ARG 54 -12.019 -22.666 6.224 458 HG2 ARG 87 HG2 ARG 54 -13.554 -24.225 5.566 459 HG3 ARG 87 HG3 ARG 54 -14.485 -22.739 5.752 460 HD2 ARG 87 HD2 ARG 54 -14.655 -22.493 3.321 461 HD3 ARG 87 HD3 ARG 54 -13.347 -23.646 3.117 462 HE ARG 87 HE ARG 54 -14.796 -25.196 2.746 463 HH11 ARG 87 HH21 ARG 54 -16.238 -23.492 5.548 464 HH12 ARG 87 HH22 ARG 54 -17.653 -24.474 5.546 465 HH21 ARG 87 HH11 ARG 54 -16.721 -26.282 2.625 466 HH22 ARG 87 HH12 ARG 54 -17.899 -26.174 3.912 467 H SER 88 H SER 55 -10.038 -20.593 4.250 468 HA SER 88 HA SER 55 -8.781 -20.492 6.838 469 HB2 SER 88 HB2 SER 55 -7.601 -20.313 4.054 470 HB3 SER 88 HB3 SER 55 -6.730 -20.602 5.569 471 HG SER 88 HG SER 55 -8.612 -22.267 4.248 472 H VAL 89 H VAL 56 -10.372 -17.958 5.601 473 HA VAL 89 HA VAL 56 -8.405 -16.031 6.727 474 HB VAL 89 HB VAL 56 -8.228 -15.839 4.376 475 HG11 VAL 89 HG11 VAL 56 -11.247 -15.813 4.279 476 HG12 VAL 89 HG12 VAL 56 -10.266 -15.107 2.974 477 HG13 VAL 89 HG13 VAL 56 -10.084 -16.813 3.399 478 HG21 VAL 89 HG21 VAL 56 -8.251 -13.702 5.678 479 HG22 VAL 89 HG22 VAL 56 -8.599 -13.568 3.945 480 HG23 VAL 89 HG23 VAL 56 -9.924 -13.453 5.113 481 HA PRO 90 HA PRO 57 -12.841 -16.073 8.372 482 HB2 PRO 90 HB2 PRO 57 -12.645 -17.073 10.894 483 HB3 PRO 90 HB3 PRO 57 -12.702 -18.118 9.443 484 HG2 PRO 90 HG2 PRO 57 -10.254 -17.211 10.995 485 HG3 PRO 90 HG3 PRO 57 -10.669 -18.867 10.432 486 HD2 PRO 90 HD2 PRO 57 -8.980 -17.211 9.037 487 HD3 PRO 90 HD3 PRO 57 -10.055 -18.398 8.265 488 H ALA 91 H ALA 58 -9.842 -14.743 9.625 489 HA ALA 91 HA ALA 58 -11.120 -12.998 11.581 490 HB1 ALA 91 HB1 ALA 58 -8.818 -13.875 11.889 491 HB2 ALA 91 HB2 ALA 58 -8.285 -12.998 10.431 492 HB3 ALA 91 HB3 ALA 58 -8.837 -12.103 11.861 493 H VAL 92 H VAL 59 -10.904 -12.888 8.175 494 HA VAL 92 HA VAL 59 -11.277 -9.929 8.176 495 HB VAL 92 HB VAL 59 -9.624 -11.458 6.151 496 HG11 VAL 92 HG11 VAL 59 -9.801 -8.478 6.736 497 HG12 VAL 92 HG12 VAL 59 -8.806 -9.251 5.480 498 HG13 VAL 92 HG13 VAL 59 -10.568 -9.312 5.368 499 HG21 VAL 92 HG21 VAL 59 -8.335 -11.614 8.215 500 HG22 VAL 92 HG22 VAL 59 -7.593 -10.402 7.177 501 HG23 VAL 92 HG23 VAL 59 -8.597 -9.888 8.553 502 H VAL 93 H VAL 60 -12.244 -13.076 6.974 503 HA VAL 93 HA VAL 60 -14.287 -11.889 5.187 504 HB VAL 93 HB VAL 60 -12.131 -13.935 4.659 505 HG11 VAL 93 HG11 VAL 60 -13.067 -14.466 2.455 506 HG12 VAL 93 HG12 VAL 60 -14.079 -15.052 3.756 507 HG13 VAL 93 HG13 VAL 60 -14.545 -13.581 2.854 508 HG21 VAL 93 HG21 VAL 60 -11.398 -11.737 4.112 509 HG22 VAL 93 HG22 VAL 60 -11.800 -12.501 2.589 510 HG23 VAL 93 HG23 VAL 60 -12.929 -11.338 3.326 511 H ARG 94 H ARG 61 -15.940 -13.602 4.691 512 HA ARG 94 HA ARG 61 -16.459 -15.517 6.901 513 HB2 ARG 94 HB2 ARG 61 -17.277 -13.325 7.671 514 HB3 ARG 94 HB3 ARG 61 -18.170 -13.079 6.188 515 HG2 ARG 94 HG2 ARG 61 -19.599 -15.117 6.818 516 HG3 ARG 94 HG3 ARG 61 -18.687 -15.176 8.333 517 HD2 ARG 94 HD2 ARG 61 -20.606 -13.985 8.925 518 HD3 ARG 94 HD3 ARG 61 -19.428 -12.712 8.653 519 HE ARG 94 HE ARG 61 -20.524 -12.063 6.675 520 HH11 ARG 94 HH11 ARG 61 -22.103 -14.955 8.062 521 HH12 ARG 94 HH12 ARG 61 -23.540 -14.782 7.092 522 HH21 ARG 94 HH21 ARG 61 -22.582 -11.762 5.573 523 HH22 ARG 94 HH22 ARG 61 -23.816 -12.957 5.738 524 H ILE 95 H ILE 62 -18.197 -17.033 6.209 525 HA ILE 95 HA ILE 62 -19.082 -16.790 3.419 526 HB ILE 95 HB ILE 62 -18.394 -19.098 2.894 527 HG12 ILE 95 HG12 ILE 62 -16.805 -19.010 5.481 528 HG13 ILE 95 HG13 ILE 62 -18.193 -20.050 5.127 529 HG21 ILE 95 HG21 ILE 62 -16.154 -18.624 2.262 530 HG22 ILE 95 HG22 ILE 62 -16.948 -17.057 2.293 531 HG23 ILE 95 HG23 ILE 62 -15.902 -17.522 3.642 532 HD11 ILE 95 HD11 ILE 62 -15.457 -20.191 3.814 533 HD12 ILE 95 HD12 ILE 62 -16.213 -21.349 4.913 534 HD13 ILE 95 HD13 ILE 62 -16.877 -21.129 3.282 535 H GLU 96 H GLU 63 -20.938 -18.050 2.960 536 HA GLU 96 HA GLU 63 -22.143 -19.601 5.214 537 HB2 GLU 96 HB2 GLU 63 -23.532 -17.742 3.237 538 HB3 GLU 96 HB3 GLU 63 -24.355 -18.910 4.286 539 HG2 GLU 96 HG2 GLU 63 -23.409 -17.750 6.279 540 HG3 GLU 96 HG3 GLU 63 -22.667 -16.553 5.220 541 H ALA 97 H ALA 64 -21.468 -21.595 4.467 542 HA ALA 97 HA ALA 64 -21.907 -22.424 1.671 543 HB1 ALA 97 HB1 ALA 64 -21.105 -24.003 4.145 544 HB2 ALA 97 HB2 ALA 64 -21.178 -24.622 2.478 545 HB3 ALA 97 HB3 ALA 64 -20.001 -23.364 2.894 546 H SER 98 H SER 65 -23.896 -22.879 0.982 547 HA SER 98 HA SER 65 -26.166 -23.151 2.794 548 HB2 SER 98 HB2 SER 65 -26.369 -21.945 0.662 549 HB3 SER 98 HB3 SER 65 -25.874 -23.393 -0.240 550 HG SER 98 HG SER 65 -28.232 -22.955 -0.036 551 H ARG 99 H ARG 66 -27.436 -25.020 2.899 552 HA ARG 99 HA ARG 66 -26.123 -27.578 2.943 553 HB2 ARG 99 HB2 ARG 66 -28.225 -28.487 3.612 554 HB3 ARG 99 HB3 ARG 66 -27.996 -26.954 4.403 555 HG2 ARG 99 HG2 ARG 66 -30.172 -26.747 3.883 556 HG3 ARG 99 HG3 ARG 66 -29.526 -25.987 2.443 557 HD2 ARG 99 HD2 ARG 66 -29.947 -28.962 2.297 558 HD3 ARG 99 HD3 ARG 66 -31.403 -28.002 2.562 559 HE ARG 99 HE ARG 66 -30.048 -26.785 0.407 560 HH11 ARG 99 HH11 ARG 66 -31.672 -29.890 1.084 561 HH12 ARG 99 HH12 ARG 66 -32.100 -30.173 -0.562 562 HH21 ARG 99 HH21 ARG 66 -30.646 -27.134 -1.719 563 HH22 ARG 99 HH22 ARG 66 -31.528 -28.552 -2.215 564 H SER 100 H SER 67 -27.630 -25.796 0.356 565 HA SER 100 HA SER 67 -28.118 -28.007 -1.407 566 HB2 SER 100 HB2 SER 67 -27.548 -25.076 -2.021 567 HB3 SER 100 HB3 SER 67 -28.357 -26.237 -3.085 568 HG SER 100 HG SER 67 -29.753 -24.801 -1.743 569 H GLY 101 H GLY 68 -25.115 -26.815 -0.213 570 HA2 GLY 101 HA2 GLY 68 -23.009 -27.503 -0.765 571 HA3 GLY 101 HA3 GLY 68 -23.631 -28.391 -2.171 572 H GLU 102 H GLU 69 -24.089 -24.921 -1.383 573 HA GLU 102 HA GLU 69 -22.181 -24.076 -3.469 574 HB2 GLU 102 HB2 GLU 69 -24.981 -22.937 -2.992 575 HB3 GLU 102 HB3 GLU 69 -23.722 -22.162 -3.963 576 HG2 GLU 102 HG2 GLU 69 -23.686 -24.156 -5.471 577 HG3 GLU 102 HG3 GLU 69 -25.016 -24.858 -4.546 578 H ILE 103 H ILE 70 -21.481 -21.750 -2.807 579 HA ILE 103 HA ILE 70 -21.887 -21.171 0.031 580 HB ILE 103 HB ILE 70 -19.999 -22.509 0.252 581 HG12 ILE 103 HG12 ILE 70 -19.875 -20.157 1.294 582 HG13 ILE 103 HG13 ILE 70 -18.467 -21.204 1.326 583 HG21 ILE 103 HG21 ILE 70 -17.870 -22.240 -1.007 584 HG22 ILE 103 HG22 ILE 70 -19.222 -22.943 -1.904 585 HG23 ILE 103 HG23 ILE 70 -18.780 -21.240 -2.167 586 HD11 ILE 103 HD11 ILE 70 -18.751 -19.095 -0.857 587 HD12 ILE 103 HD12 ILE 70 -18.056 -18.740 0.714 588 HD13 ILE 103 HD13 ILE 70 -17.302 -19.958 -0.324 589 H VAL 104 H VAL 71 -21.860 -19.083 0.523 590 HA VAL 104 HA VAL 71 -21.409 -17.137 -1.694 591 HB VAL 104 HB VAL 71 -23.273 -16.786 0.692 592 HG11 VAL 104 HG11 VAL 71 -24.293 -15.071 -0.761 593 HG12 VAL 104 HG12 VAL 71 -22.571 -14.749 -0.537 594 HG13 VAL 104 HG13 VAL 71 -23.150 -15.464 -2.063 595 HG21 VAL 104 HG21 VAL 71 -25.177 -17.345 -0.794 596 HG22 VAL 104 HG22 VAL 71 -24.041 -17.934 -2.021 597 HG23 VAL 104 HG23 VAL 71 -24.172 -18.751 -0.452 598 H CYS 105 H CYS 72 -19.804 -15.668 -1.261 599 HA CYS 105 HA CYS 72 -18.403 -15.851 1.334 600 HB2 CYS 105 HB2 CYS 72 -17.548 -14.271 -1.118 601 HB3 CYS 105 HB3 CYS 72 -16.524 -14.962 0.157 602 HG CYS 105 HG CYS 72 -18.184 -16.363 -2.341 603 H TYR 106 H TYR 73 -17.846 -13.956 2.552 604 HA TYR 106 HA TYR 73 -19.125 -11.352 1.893 605 HB2 TYR 106 HB2 TYR 73 -19.484 -12.997 4.439 606 HB3 TYR 106 HB3 TYR 73 -19.933 -11.301 4.295 607 HD1 TYR 106 HD1 TYR 73 -21.624 -10.637 2.461 608 HD2 TYR 106 HD2 TYR 73 -21.002 -14.690 3.845 609 HE1 TYR 106 HE1 TYR 73 -23.918 -11.209 1.767 610 HE2 TYR 106 HE2 TYR 73 -23.235 -15.334 2.969 611 HH TYR 106 HH TYR 73 -25.280 -14.551 2.085 612 H ALA 107 H ALA 74 -18.339 -9.688 3.581 613 HA ALA 107 HA ALA 74 -15.436 -10.129 4.109 614 HB1 ALA 107 HB1 ALA 74 -17.116 -7.595 4.404 615 HB2 ALA 107 HB2 ALA 74 -15.338 -7.739 4.462 616 HB3 ALA 107 HB3 ALA 74 -16.196 -8.017 2.951 617 H VAL 108 H VAL 75 -14.627 -9.304 6.205 618 HA VAL 108 HA VAL 75 -16.608 -9.010 8.378 619 HB VAL 108 HB VAL 75 -15.034 -11.390 8.016 620 HG11 VAL 108 HG11 VAL 75 -13.272 -10.352 9.412 621 HG12 VAL 108 HG12 VAL 75 -14.455 -10.112 10.711 622 HG13 VAL 108 HG13 VAL 75 -14.034 -11.748 10.179 623 HG21 VAL 108 HG21 VAL 75 -16.879 -10.576 10.301 624 HG22 VAL 108 HG22 VAL 75 -17.416 -11.226 8.742 625 HG23 VAL 108 HG23 VAL 75 -16.435 -12.234 9.826 626 H ALA 109 H ALA 76 -13.364 -8.284 7.116 627 HA ALA 109 HA ALA 76 -13.306 -5.934 8.849 628 HB1 ALA 109 HB1 ALA 76 -10.926 -7.841 8.791 629 HB2 ALA 109 HB2 ALA 76 -11.064 -6.314 9.679 630 HB3 ALA 109 HB3 ALA 76 -12.047 -7.698 10.168 Start of MODEL 7 1 H1 GLY -2 H1 GLY -2 6.190 1.736 -1.747 2 H2 GLY -2 H2 GLY -2 5.021 2.159 -0.685 3 H3 GLY -2 H3 GLY -2 6.584 2.099 -0.195 4 HA2 GLY -2 HA2 GLY -2 6.662 -0.274 -0.506 5 HA3 GLY -2 HA3 GLY -2 5.387 0.186 0.629 6 H HIS -1 H HIS -1 5.236 -2.281 -0.551 7 HA HIS -1 HA HIS -1 2.741 -2.093 -2.113 8 HB2 HIS -1 HB2 HIS -1 4.578 -2.192 -3.801 9 HB3 HIS -1 HB3 HIS -1 5.124 -3.707 -3.083 10 HD2 HIS -1 HD2 HIS -1 4.276 -5.719 -4.434 11 HE1 HIS -1 HE1 HIS -1 0.520 -4.229 -5.798 12 HE2 HIS -1 HE2 HIS -1 2.116 -6.212 -5.866 13 H MET 34 H MET 1 1.532 -4.093 -1.950 14 HA MET 34 HA MET 1 1.812 -5.388 0.616 15 HB2 MET 34 HB2 MET 1 0.055 -5.980 -1.806 16 HB3 MET 34 HB3 MET 1 -0.061 -6.809 -0.249 17 HG2 MET 34 HG2 MET 1 -1.537 -5.279 0.377 18 HG3 MET 34 HG3 MET 1 -0.199 -4.147 0.483 19 HE1 MET 34 HE1 MET 1 -2.883 -5.565 -2.370 20 HE2 MET 34 HE2 MET 1 -3.612 -4.904 -0.886 21 HE3 MET 34 HE3 MET 1 -3.755 -4.035 -2.425 22 H LEU 35 H LEU 2 2.287 -7.578 1.043 23 HA LEU 35 HA LEU 2 4.151 -8.987 -0.774 24 HB2 LEU 35 HB2 LEU 2 2.839 -9.856 1.843 25 HB3 LEU 35 HB3 LEU 2 4.122 -10.725 0.989 26 HG LEU 35 HG LEU 2 4.383 -7.985 2.306 27 HD11 LEU 35 HD11 LEU 2 5.554 -10.697 3.056 28 HD12 LEU 35 HD12 LEU 2 5.836 -9.153 3.899 29 HD13 LEU 35 HD13 LEU 2 4.215 -9.865 3.889 30 HD21 LEU 35 HD21 LEU 2 6.823 -8.234 1.842 31 HD22 LEU 35 HD22 LEU 2 6.473 -9.666 0.847 32 HD23 LEU 35 HD23 LEU 2 5.869 -8.054 0.377 33 H GLU 36 H GLU 3 3.487 -11.382 -1.394 34 HA GLU 36 HA GLU 3 1.210 -11.155 -2.992 35 HB2 GLU 36 HB2 GLU 3 3.030 -12.749 -3.453 36 HB3 GLU 36 HB3 GLU 3 2.528 -13.738 -2.065 37 HG2 GLU 36 HG2 GLU 3 0.392 -14.240 -3.129 38 HG3 GLU 36 HG3 GLU 3 0.758 -13.129 -4.455 39 H ALA 37 H ALA 4 1.430 -13.088 0.002 40 HA ALA 37 HA ALA 4 -1.308 -13.818 -0.136 41 HB1 ALA 37 HB1 ALA 4 0.327 -15.102 1.177 42 HB2 ALA 37 HB2 ALA 4 0.436 -13.769 2.357 43 HB3 ALA 37 HB3 ALA 4 -1.094 -14.652 2.134 44 H ASP 38 H ASP 5 0.266 -10.979 1.272 45 HA ASP 38 HA ASP 5 -2.014 -10.037 2.786 46 HB2 ASP 38 HB2 ASP 5 0.351 -9.394 3.234 47 HB3 ASP 38 HB3 ASP 5 0.383 -8.515 1.698 48 H LEU 39 H LEU 6 -0.733 -9.450 -0.506 49 HA LEU 39 HA LEU 6 -2.465 -7.370 -1.291 50 HB2 LEU 39 HB2 LEU 6 -0.418 -8.027 -2.507 51 HB3 LEU 39 HB3 LEU 6 -1.096 -9.562 -2.944 52 HG LEU 39 HG LEU 6 -2.561 -7.071 -3.812 53 HD11 LEU 39 HD11 LEU 6 -0.104 -8.195 -5.208 54 HD12 LEU 39 HD12 LEU 6 -1.167 -6.912 -5.820 55 HD13 LEU 39 HD13 LEU 6 -0.206 -6.631 -4.365 56 HD21 LEU 39 HD21 LEU 6 -2.157 -9.794 -5.124 57 HD22 LEU 39 HD22 LEU 6 -3.656 -9.162 -4.407 58 HD23 LEU 39 HD23 LEU 6 -3.015 -8.419 -5.859 59 H VAL 40 H VAL 7 -2.664 -10.909 -1.877 60 HA VAL 40 HA VAL 7 -5.173 -10.707 -3.174 61 HB VAL 40 HB VAL 7 -5.241 -13.151 -3.058 62 HG11 VAL 40 HG11 VAL 7 -3.266 -13.579 -4.340 63 HG12 VAL 40 HG12 VAL 7 -3.711 -11.909 -4.663 64 HG13 VAL 40 HG13 VAL 7 -2.374 -12.265 -3.572 65 HG21 VAL 40 HG21 VAL 7 -3.484 -14.440 -1.885 66 HG22 VAL 40 HG22 VAL 7 -2.899 -12.940 -1.174 67 HG23 VAL 40 HG23 VAL 7 -4.503 -13.553 -0.757 68 H SER 41 H SER 8 -4.377 -11.299 0.298 69 HA SER 41 HA SER 8 -7.072 -11.768 1.075 70 HB2 SER 41 HB2 SER 8 -4.769 -10.666 2.735 71 HB3 SER 41 HB3 SER 8 -6.290 -11.327 3.357 72 HG SER 41 HG SER 8 -4.128 -12.625 2.115 73 H LYS 42 H LYS 9 -5.183 -8.627 1.076 74 HA LYS 42 HA LYS 9 -7.416 -7.135 2.177 75 HB2 LYS 42 HB2 LYS 9 -4.884 -6.364 0.678 76 HB3 LYS 42 HB3 LYS 9 -6.100 -5.162 1.132 77 HG2 LYS 42 HG2 LYS 9 -5.896 -5.690 3.490 78 HG3 LYS 42 HG3 LYS 9 -4.800 -7.047 3.141 79 HD2 LYS 42 HD2 LYS 9 -3.139 -5.521 2.184 80 HD3 LYS 42 HD3 LYS 9 -4.189 -4.120 2.508 81 HE2 LYS 42 HE2 LYS 9 -3.983 -4.384 4.885 82 HE3 LYS 42 HE3 LYS 9 -3.353 -6.032 4.721 83 HZ1 LYS 42 HZ1 LYS 9 -1.347 -5.181 3.765 84 HZ2 LYS 42 HZ2 LYS 9 -1.865 -3.610 3.879 85 HZ3 LYS 42 HZ3 LYS 9 -1.586 -4.485 5.235 86 H MET 43 H MET 10 -6.361 -7.779 -1.245 87 HA MET 43 HA MET 10 -8.438 -6.038 -2.274 88 HB2 MET 43 HB2 MET 10 -6.764 -8.213 -3.575 89 HB3 MET 43 HB3 MET 10 -7.933 -7.207 -4.448 90 HG2 MET 43 HG2 MET 10 -6.713 -5.164 -3.521 91 HG3 MET 43 HG3 MET 10 -5.428 -6.259 -2.999 92 HE1 MET 43 HE1 MET 10 -4.832 -3.773 -4.727 93 HE2 MET 43 HE2 MET 10 -3.500 -4.942 -4.527 94 HE3 MET 43 HE3 MET 10 -3.917 -4.344 -6.141 95 H LEU 44 H LEU 11 -8.304 -9.617 -1.737 96 HA LEU 44 HA LEU 11 -10.888 -10.347 -2.555 97 HB2 LEU 44 HB2 LEU 11 -9.271 -11.987 -1.731 98 HB3 LEU 44 HB3 LEU 11 -9.146 -11.159 -0.184 99 HG LEU 44 HG LEU 11 -11.530 -11.788 0.302 100 HD11 LEU 44 HD11 LEU 11 -11.077 -13.565 -2.141 101 HD12 LEU 44 HD12 LEU 11 -12.424 -13.705 -0.988 102 HD13 LEU 44 HD13 LEU 11 -12.274 -12.249 -1.999 103 HD21 LEU 44 HD21 LEU 11 -10.938 -14.138 0.864 104 HD22 LEU 44 HD22 LEU 11 -9.446 -13.941 -0.089 105 HD23 LEU 44 HD23 LEU 11 -9.711 -12.952 1.349 106 H ARG 45 H ARG 12 -9.874 -9.214 0.673 107 HA ARG 45 HA ARG 12 -12.390 -8.910 1.881 108 HB2 ARG 45 HB2 ARG 12 -10.480 -8.911 3.173 109 HB3 ARG 45 HB3 ARG 12 -9.639 -7.715 2.221 110 HG2 ARG 45 HG2 ARG 12 -12.094 -6.847 3.718 111 HG3 ARG 45 HG3 ARG 12 -10.583 -7.145 4.576 112 HD2 ARG 45 HD2 ARG 12 -9.474 -5.561 2.808 113 HD3 ARG 45 HD3 ARG 12 -11.147 -5.019 2.508 114 HE ARG 45 HE ARG 12 -10.237 -5.232 5.294 115 HH11 ARG 45 HH21 ARG 12 -10.329 -2.879 2.634 116 HH12 ARG 45 HH22 ARG 12 -10.649 -1.534 3.670 117 HH21 ARG 45 HH11 ARG 12 -10.916 -3.594 6.587 118 HH22 ARG 45 HH12 ARG 12 -10.857 -1.923 6.050 119 H ALA 46 H ALA 13 -10.587 -6.469 -0.109 120 HA ALA 46 HA ALA 13 -12.520 -4.480 0.434 121 HB1 ALA 46 HB1 ALA 13 -10.629 -4.721 -1.971 122 HB2 ALA 46 HB2 ALA 13 -11.441 -3.240 -1.428 123 HB3 ALA 46 HB3 ALA 13 -10.213 -3.997 -0.397 124 H VAL 47 H VAL 14 -12.305 -6.837 -2.293 125 HA VAL 47 HA VAL 14 -14.554 -5.809 -3.752 126 HB VAL 47 HB VAL 14 -13.429 -8.646 -3.506 127 HG11 VAL 47 HG11 VAL 14 -14.598 -9.165 -5.574 128 HG12 VAL 47 HG12 VAL 14 -15.766 -8.721 -4.333 129 HG13 VAL 47 HG13 VAL 14 -15.349 -7.549 -5.601 130 HG21 VAL 47 HG21 VAL 14 -12.439 -8.104 -5.752 131 HG22 VAL 47 HG22 VAL 14 -13.071 -6.460 -5.627 132 HG23 VAL 47 HG23 VAL 14 -11.830 -7.035 -4.501 133 H LEU 48 H LEU 15 -14.287 -8.230 -1.097 134 HA LEU 48 HA LEU 15 -17.062 -8.833 -0.985 135 HB2 LEU 48 HB2 LEU 15 -14.892 -8.915 1.184 136 HB3 LEU 48 HB3 LEU 15 -16.476 -9.630 1.353 137 HG LEU 48 HG LEU 15 -14.695 -10.456 -0.970 138 HD11 LEU 48 HD11 LEU 15 -14.744 -11.528 1.877 139 HD12 LEU 48 HD12 LEU 15 -13.933 -12.316 0.504 140 HD13 LEU 48 HD13 LEU 15 -13.387 -10.720 1.069 141 HD21 LEU 48 HD21 LEU 15 -16.031 -12.477 -0.873 142 HD22 LEU 48 HD22 LEU 15 -16.828 -11.930 0.609 143 HD23 LEU 48 HD23 LEU 15 -17.148 -11.097 -0.918 144 H GLN 49 H GLN 16 -15.161 -6.247 0.658 145 HA GLN 49 HA GLN 16 -17.278 -5.412 2.384 146 HB2 GLN 49 HB2 GLN 16 -14.749 -4.076 1.349 147 HB3 GLN 49 HB3 GLN 16 -15.901 -3.180 2.324 148 HG2 GLN 49 HG2 GLN 16 -14.553 -5.757 3.223 149 HG3 GLN 49 HG3 GLN 16 -14.003 -4.138 3.629 150 HE21 GLN 49 HE22 GLN 16 -14.423 -5.678 5.770 151 HE22 GLN 49 HE21 GLN 16 -15.942 -5.284 6.570 152 H SER 50 H SER 17 -16.370 -4.354 -0.968 153 HA SER 50 HA SER 17 -18.493 -2.434 -1.191 154 HB2 SER 50 HB2 SER 17 -17.137 -4.140 -3.335 155 HB3 SER 50 HB3 SER 17 -18.112 -2.688 -3.613 156 HG SER 50 HG SER 17 -15.866 -2.180 -3.572 157 H HIS 51 H HIS 18 -18.270 -5.941 -1.910 158 HA HIS 51 HA HIS 18 -20.996 -5.999 -2.943 159 HB2 HIS 51 HB2 HIS 18 -18.834 -8.109 -2.766 160 HB3 HIS 51 HB3 HIS 18 -20.413 -8.327 -3.519 161 HD2 HIS 51 HD2 HIS 18 -18.787 -8.884 -5.709 162 HE1 HIS 51 HE1 HIS 18 -18.171 -4.823 -6.756 163 HE2 HIS 51 HE2 HIS 18 -18.024 -7.210 -7.596 164 H LYS 52 H LYS 19 -21.659 -5.319 -0.577 165 HA LYS 52 HA LYS 19 -21.607 -7.149 1.568 166 HB2 LYS 52 HB2 LYS 19 -23.705 -5.075 0.768 167 HB3 LYS 52 HB3 LYS 19 -23.748 -5.939 2.299 168 HG2 LYS 52 HG2 LYS 19 -21.599 -3.984 1.410 169 HG3 LYS 52 HG3 LYS 19 -22.809 -3.780 2.685 170 HD2 LYS 52 HD2 LYS 19 -21.734 -5.904 3.772 171 HD3 LYS 52 HD3 LYS 19 -20.391 -5.632 2.672 172 HE2 LYS 52 HE2 LYS 19 -21.413 -3.764 4.863 173 HE3 LYS 52 HE3 LYS 19 -19.886 -4.647 4.830 174 HZ1 LYS 52 HZ1 LYS 19 -19.308 -3.250 2.818 175 HZ2 LYS 52 HZ2 LYS 19 -20.625 -2.328 3.149 176 HZ3 LYS 52 HZ3 LYS 19 -19.411 -2.431 4.244 177 H ASN 53 H ASN 20 -23.743 -7.197 -1.214 178 HA ASN 53 HA ASN 20 -25.707 -9.036 -0.343 179 HB2 ASN 53 HB2 ASN 20 -25.855 -7.859 -2.472 180 HB3 ASN 53 HB3 ASN 20 -24.318 -8.543 -3.024 181 HD21 ASN 53 HD22 ASN 20 -24.232 -10.767 -3.717 182 HD22 ASN 53 HD21 ASN 20 -25.701 -11.604 -4.174 183 H GLY 54 H GLY 21 -22.289 -9.557 -0.806 184 HA2 GLY 54 HA2 GLY 21 -21.045 -11.400 -0.442 185 HA3 GLY 54 HA3 GLY 21 -22.478 -12.444 -0.360 186 H ILE 55 H ILE 22 -20.408 -13.340 -1.806 187 HA ILE 55 HA ILE 22 -21.413 -13.317 -4.591 188 HB ILE 55 HB ILE 22 -18.807 -13.307 -5.175 189 HG12 ILE 55 HG12 ILE 22 -18.840 -11.517 -2.691 190 HG13 ILE 55 HG13 ILE 22 -17.911 -12.988 -2.927 191 HG21 ILE 55 HG21 ILE 22 -20.659 -11.711 -5.961 192 HG22 ILE 55 HG22 ILE 22 -20.097 -10.616 -4.677 193 HG23 ILE 55 HG23 ILE 22 -18.990 -11.137 -5.987 194 HD11 ILE 55 HD11 ILE 22 -16.739 -11.692 -4.872 195 HD12 ILE 55 HD12 ILE 22 -17.583 -10.259 -4.260 196 HD13 ILE 55 HD13 ILE 22 -16.423 -11.098 -3.232 197 H VAL 56 H VAL 23 -21.665 -15.288 -5.262 198 HA VAL 56 HA VAL 23 -21.077 -17.565 -3.663 199 HB VAL 56 HB VAL 23 -21.778 -18.805 -5.732 200 HG11 VAL 56 HG11 VAL 23 -24.110 -18.017 -5.704 201 HG12 VAL 56 HG12 VAL 23 -23.426 -18.154 -4.083 202 HG13 VAL 56 HG13 VAL 23 -23.615 -16.550 -4.833 203 HG21 VAL 56 HG21 VAL 23 -20.961 -17.237 -7.465 204 HG22 VAL 56 HG22 VAL 23 -22.674 -17.603 -7.663 205 HG23 VAL 56 HG23 VAL 23 -22.187 -16.040 -6.983 206 H LEU 57 H LEU 24 -19.410 -19.200 -3.904 207 HA LEU 57 HA LEU 24 -16.961 -18.244 -4.271 208 HB2 LEU 57 HB2 LEU 24 -15.924 -20.269 -4.131 209 HB3 LEU 57 HB3 LEU 24 -17.340 -20.315 -3.146 210 HG LEU 57 HG LEU 24 -17.132 -21.583 -5.929 211 HD11 LEU 57 HD11 LEU 24 -16.858 -22.899 -3.192 212 HD12 LEU 57 HD12 LEU 24 -16.897 -23.738 -4.761 213 HD13 LEU 57 HD13 LEU 24 -15.567 -22.651 -4.382 214 HD21 LEU 57 HD21 LEU 24 -19.522 -21.171 -5.185 215 HD22 LEU 57 HD22 LEU 24 -19.112 -22.880 -5.347 216 HD23 LEU 57 HD23 LEU 24 -19.191 -22.132 -3.742 217 HA PRO 58 HA PRO 25 -16.118 -19.174 -8.836 218 HB2 PRO 58 HB2 PRO 25 -18.129 -19.113 -10.699 219 HB3 PRO 58 HB3 PRO 25 -17.602 -20.608 -9.869 220 HG2 PRO 58 HG2 PRO 25 -19.956 -18.826 -9.153 221 HG3 PRO 58 HG3 PRO 25 -19.928 -20.603 -9.345 222 HD2 PRO 58 HD2 PRO 25 -19.729 -19.488 -6.906 223 HD3 PRO 58 HD3 PRO 25 -18.762 -20.918 -7.344 224 H ARG 59 H ARG 26 -18.933 -17.108 -8.069 225 HA ARG 59 HA ARG 26 -18.165 -14.900 -9.791 226 HB2 ARG 59 HB2 ARG 26 -20.484 -15.392 -8.981 227 HB3 ARG 59 HB3 ARG 26 -19.983 -14.973 -7.326 228 HG2 ARG 59 HG2 ARG 26 -19.553 -12.674 -7.997 229 HG3 ARG 59 HG3 ARG 26 -19.830 -13.056 -9.699 230 HD2 ARG 59 HD2 ARG 26 -21.948 -13.375 -7.533 231 HD3 ARG 59 HD3 ARG 26 -21.748 -11.899 -8.507 232 HE ARG 59 HE ARG 26 -21.931 -14.057 -10.304 233 HH11 ARG 59 HH11 ARG 26 -24.060 -12.354 -8.013 234 HH12 ARG 59 HH12 ARG 26 -25.512 -12.791 -8.830 235 HH21 ARG 59 HH21 ARG 26 -23.872 -14.643 -11.381 236 HH22 ARG 59 HH22 ARG 26 -25.400 -14.115 -10.784 237 H LEU 60 H LEU 27 -17.444 -15.928 -6.466 238 HA LEU 60 HA LEU 27 -16.155 -13.627 -5.550 239 HB2 LEU 60 HB2 LEU 27 -16.637 -15.644 -4.158 240 HB3 LEU 60 HB3 LEU 27 -15.395 -16.555 -4.981 241 HG LEU 60 HG LEU 27 -14.759 -15.755 -2.756 242 HD11 LEU 60 HD11 LEU 27 -12.496 -15.232 -3.243 243 HD12 LEU 60 HD12 LEU 27 -13.056 -16.378 -4.472 244 HD13 LEU 60 HD13 LEU 27 -12.870 -14.642 -4.851 245 HD21 LEU 60 HD21 LEU 27 -15.843 -13.518 -2.967 246 HD22 LEU 60 HD22 LEU 27 -14.229 -13.493 -2.290 247 HD23 LEU 60 HD23 LEU 27 -14.471 -12.987 -3.977 248 H GLN 61 H GLN 28 -14.713 -16.459 -7.365 249 HA GLN 61 HA GLN 28 -12.150 -15.323 -7.735 250 HB2 GLN 61 HB2 GLN 28 -13.768 -17.317 -9.360 251 HB3 GLN 61 HB3 GLN 28 -12.256 -16.690 -9.983 252 HG2 GLN 61 HG2 GLN 28 -11.104 -17.466 -7.895 253 HG3 GLN 61 HG3 GLN 28 -12.605 -18.251 -7.401 254 HE21 GLN 61 HE22 GLN 28 -9.644 -18.657 -9.272 255 HE22 GLN 61 HE21 GLN 28 -10.129 -20.107 -10.081 256 H GLY 62 H GLY 29 -15.083 -14.927 -9.795 257 HA2 GLY 62 HA2 GLY 29 -13.863 -13.472 -11.865 258 HA3 GLY 62 HA3 GLY 29 -15.572 -13.349 -11.391 259 H GLU 63 H GLU 30 -15.661 -12.107 -9.016 260 HA GLU 63 HA GLU 30 -15.034 -9.399 -9.781 261 HB2 GLU 63 HB2 GLU 30 -16.061 -10.577 -7.163 262 HB3 GLU 63 HB3 GLU 30 -15.986 -8.851 -7.534 263 HG2 GLU 63 HG2 GLU 30 -17.626 -10.907 -9.079 264 HG3 GLU 63 HG3 GLU 30 -18.252 -9.794 -7.870 265 H TYR 64 H TYR 31 -13.586 -11.682 -7.457 266 HA TYR 64 HA TYR 31 -11.622 -10.052 -6.230 267 HB2 TYR 64 HB2 TYR 31 -11.957 -12.296 -5.469 268 HB3 TYR 64 HB3 TYR 31 -11.703 -12.948 -7.080 269 HD1 TYR 64 HD2 TYR 31 -9.539 -13.237 -8.098 270 HD2 TYR 64 HD1 TYR 31 -9.979 -11.668 -4.100 271 HE1 TYR 64 HE2 TYR 31 -7.143 -13.547 -7.711 272 HE2 TYR 64 HE1 TYR 31 -7.568 -12.077 -3.681 273 HH TYR 64 HH TYR 31 -5.400 -13.428 -6.257 274 H ARG 65 H ARG 32 -11.436 -11.964 -9.308 275 HA ARG 65 HA ARG 32 -8.856 -11.053 -10.002 276 HB2 ARG 65 HB2 ARG 32 -9.629 -13.004 -11.063 277 HB3 ARG 65 HB3 ARG 32 -11.139 -12.255 -11.586 278 HG2 ARG 65 HG2 ARG 32 -10.134 -10.930 -13.257 279 HG3 ARG 65 HG3 ARG 32 -8.492 -11.178 -12.626 280 HD2 ARG 65 HD2 ARG 32 -10.102 -13.520 -13.647 281 HD3 ARG 65 HD3 ARG 32 -9.309 -12.438 -14.783 282 HE ARG 65 HE ARG 32 -8.017 -14.099 -12.692 283 HH11 ARG 65 HH11 ARG 32 -7.532 -11.856 -15.403 284 HH12 ARG 65 HH12 ARG 32 -5.916 -12.360 -15.728 285 HH21 ARG 65 HH22 ARG 32 -5.918 -14.931 -13.281 286 HH22 ARG 65 HH21 ARG 32 -4.963 -14.101 -14.451 287 H SER 66 H SER 33 -12.116 -9.646 -10.782 288 HA SER 66 HA SER 33 -11.137 -7.735 -12.548 289 HB2 SER 66 HB2 SER 33 -13.415 -7.372 -10.549 290 HB3 SER 66 HB3 SER 33 -13.125 -6.389 -11.995 291 HG SER 66 HG SER 33 -14.647 -7.998 -12.477 292 H LEU 67 H LEU 34 -11.013 -7.700 -8.940 293 HA LEU 67 HA LEU 34 -9.787 -5.029 -9.027 294 HB2 LEU 67 HB2 LEU 34 -11.182 -5.685 -7.122 295 HB3 LEU 67 HB3 LEU 34 -10.020 -6.954 -6.697 296 HG LEU 67 HG LEU 34 -8.285 -5.266 -6.244 297 HD11 LEU 67 HD11 LEU 34 -8.796 -3.480 -7.844 298 HD12 LEU 67 HD12 LEU 34 -10.369 -3.189 -7.061 299 HD13 LEU 67 HD13 LEU 34 -8.842 -2.822 -6.217 300 HD21 LEU 67 HD21 LEU 34 -10.924 -4.513 -4.923 301 HD22 LEU 67 HD22 LEU 34 -9.861 -5.850 -4.452 302 HD23 LEU 67 HD23 LEU 34 -9.290 -4.179 -4.289 303 H THR 68 H THR 35 -8.476 -8.405 -8.312 304 HA THR 68 HA THR 35 -5.856 -7.321 -7.722 305 HB THR 68 HB THR 35 -5.266 -9.806 -7.775 306 HG1 THR 68 HG1 THR 35 -7.220 -11.165 -7.843 307 HG21 THR 68 HG21 THR 35 -5.921 -8.674 -5.698 308 HG22 THR 68 HG22 THR 35 -7.645 -9.038 -6.039 309 HG23 THR 68 HG23 THR 35 -6.464 -10.332 -5.732 310 H GLY 69 H GLY 36 -7.346 -8.704 -10.638 311 HA2 GLY 69 HA2 GLY 36 -6.546 -8.889 -12.783 312 HA3 GLY 69 HA3 GLY 36 -4.996 -8.176 -12.298 313 H ASP 70 H ASP 37 -6.355 -10.887 -10.392 314 HA ASP 70 HA ASP 37 -4.636 -12.870 -11.750 315 HB2 ASP 70 HB2 ASP 37 -3.345 -11.696 -9.859 316 HB3 ASP 70 HB3 ASP 37 -4.501 -12.425 -8.737 317 H TRP 71 H TRP 38 -5.157 -15.120 -10.725 318 HA TRP 71 HA TRP 38 -8.037 -15.282 -10.035 319 HB2 TRP 71 HB2 TRP 38 -5.968 -17.391 -10.764 320 HB3 TRP 71 HB3 TRP 38 -7.590 -17.765 -10.213 321 HD1 TRP 71 HD1 TRP 38 -5.762 -17.538 -13.240 322 HE1 TRP 71 HE1 TRP 38 -7.258 -17.259 -15.314 323 HE3 TRP 71 HE3 TRP 38 -10.085 -16.062 -10.916 324 HZ2 TRP 71 HZ2 TRP 38 -10.005 -16.498 -15.877 325 HZ3 TRP 71 HZ3 TRP 38 -12.112 -15.552 -12.241 326 HH2 TRP 71 HH2 TRP 38 -12.092 -15.774 -14.714 327 H ILE 72 H ILE 39 -8.545 -16.631 -8.141 328 HA ILE 72 HA ILE 39 -7.224 -15.902 -5.768 329 HB ILE 72 HB ILE 39 -9.085 -18.180 -6.492 330 HG12 ILE 72 HG12 ILE 39 -9.900 -15.757 -6.513 331 HG13 ILE 72 HG13 ILE 39 -10.831 -16.915 -5.579 332 HG21 ILE 72 HG21 ILE 39 -7.992 -17.575 -3.722 333 HG22 ILE 72 HG22 ILE 39 -9.455 -18.537 -4.021 334 HG23 ILE 72 HG23 ILE 39 -7.904 -19.087 -4.653 335 HD11 ILE 72 HD11 ILE 39 -10.106 -16.039 -3.517 336 HD12 ILE 72 HD12 ILE 39 -8.783 -15.102 -4.283 337 HD13 ILE 72 HD13 ILE 39 -10.478 -14.646 -4.549 338 HA PRO 73 HA PRO 40 -3.798 -18.730 -6.299 339 HB2 PRO 73 HB2 PRO 40 -2.142 -17.970 -4.318 340 HB3 PRO 73 HB3 PRO 40 -2.613 -16.833 -5.593 341 HG2 PRO 73 HG2 PRO 40 -3.934 -17.165 -2.874 342 HG3 PRO 73 HG3 PRO 40 -3.257 -15.676 -3.616 343 HD2 PRO 73 HD2 PRO 40 -5.917 -16.341 -3.787 344 HD3 PRO 73 HD3 PRO 40 -5.047 -15.511 -5.124 345 H PHE 74 H PHE 41 -6.115 -20.095 -5.254 346 HA PHE 74 HA PHE 41 -5.819 -20.925 -2.526 347 HB2 PHE 74 HB2 PHE 41 -7.549 -22.501 -2.905 348 HB3 PHE 74 HB3 PHE 41 -8.005 -21.002 -3.639 349 HD1 PHE 74 HD1 PHE 41 -7.713 -20.833 -6.287 350 HD2 PHE 74 HD2 PHE 41 -7.569 -24.521 -4.061 351 HE1 PHE 74 HE1 PHE 41 -8.214 -22.093 -8.348 352 HE2 PHE 74 HE2 PHE 41 -8.133 -25.779 -6.122 353 HZ PHE 74 HZ PHE 41 -8.438 -24.574 -8.274 354 H LYS 75 H LYS 42 -5.276 -22.854 -5.506 355 HA LYS 75 HA LYS 42 -4.015 -24.997 -4.053 356 HB2 LYS 75 HB2 LYS 42 -5.365 -25.022 -6.221 357 HB3 LYS 75 HB3 LYS 42 -3.952 -24.372 -7.040 358 HG2 LYS 75 HG2 LYS 42 -2.648 -26.392 -6.384 359 HG3 LYS 75 HG3 LYS 42 -4.038 -26.998 -5.454 360 HD2 LYS 75 HD2 LYS 42 -5.392 -27.058 -7.538 361 HD3 LYS 75 HD3 LYS 42 -3.993 -26.532 -8.475 362 HE2 LYS 75 HE2 LYS 42 -4.154 -29.095 -6.809 363 HE3 LYS 75 HE3 LYS 42 -4.461 -29.006 -8.544 364 HZ1 LYS 75 HZ1 LYS 42 -2.160 -28.258 -8.855 365 HZ2 LYS 75 HZ2 LYS 42 -1.855 -28.413 -7.247 366 HZ3 LYS 75 HZ3 LYS 42 -2.217 -29.723 -8.144 367 H GLN 76 H GLN 43 -2.949 -22.067 -5.536 368 HA GLN 76 HA GLN 43 -0.186 -22.672 -5.930 369 HB2 GLN 76 HB2 GLN 43 -1.584 -19.969 -5.649 370 HB3 GLN 76 HB3 GLN 43 -0.005 -20.276 -6.346 371 HG2 GLN 76 HG2 GLN 43 -1.224 -20.071 -8.265 372 HG3 GLN 76 HG3 GLN 43 -1.336 -21.806 -8.064 373 HE21 GLN 76 HE22 GLN 43 -3.212 -19.500 -9.310 374 HE22 GLN 76 HE21 GLN 43 -4.769 -19.875 -8.584 375 H LEU 77 H LEU 44 -2.067 -21.135 -3.251 376 HA LEU 77 HA LEU 44 0.283 -20.901 -1.505 377 HB2 LEU 77 HB2 LEU 44 -2.670 -20.455 -1.089 378 HB3 LEU 77 HB3 LEU 44 -1.468 -20.303 0.196 379 HG LEU 77 HG LEU 44 -1.456 -18.665 -2.366 380 HD11 LEU 77 HD11 LEU 44 -3.406 -18.152 -0.882 381 HD12 LEU 77 HD12 LEU 44 -2.277 -17.785 0.436 382 HD13 LEU 77 HD13 LEU 44 -2.287 -16.793 -1.040 383 HD21 LEU 77 HD21 LEU 44 0.804 -18.785 -1.442 384 HD22 LEU 77 HD22 LEU 44 0.133 -17.192 -1.126 385 HD23 LEU 77 HD23 LEU 44 0.197 -18.394 0.183 386 H GLY 78 H GLY 45 -2.297 -23.272 -2.119 387 HA2 GLY 78 HA2 GLY 45 -1.522 -25.568 -1.789 388 HA3 GLY 78 HA3 GLY 45 -0.910 -25.112 -0.198 389 H TYR 79 H TYR 46 -3.965 -23.667 -1.008 390 HA TYR 79 HA TYR 46 -5.426 -25.325 0.928 391 HB2 TYR 79 HB2 TYR 46 -6.377 -23.080 -0.902 392 HB3 TYR 79 HB3 TYR 46 -7.250 -23.775 0.452 393 HD1 TYR 79 HD2 TYR 46 -6.293 -23.531 2.810 394 HD2 TYR 79 HD1 TYR 46 -4.797 -21.303 -0.564 395 HE1 TYR 79 HE2 TYR 46 -5.187 -21.979 4.336 396 HE2 TYR 79 HE1 TYR 46 -3.688 -19.718 0.955 397 HH TYR 79 HH TYR 46 -3.801 -20.055 4.545 398 HA PRO 80 HA PRO 47 -6.364 -27.995 -2.454 399 HB2 PRO 80 HB2 PRO 47 -8.604 -29.397 -1.615 400 HB3 PRO 80 HB3 PRO 47 -6.970 -29.626 -0.915 401 HG2 PRO 80 HG2 PRO 47 -9.200 -27.829 0.124 402 HG3 PRO 80 HG3 PRO 47 -8.252 -29.060 1.034 403 HD2 PRO 80 HD2 PRO 47 -7.503 -26.467 1.135 404 HD3 PRO 80 HD3 PRO 47 -6.262 -27.731 0.936 405 H THR 81 H THR 48 -9.030 -25.858 -1.374 406 HA THR 81 HA THR 48 -10.094 -25.787 -4.146 407 HB THR 81 HB THR 48 -12.368 -25.944 -2.963 408 HG1 THR 81 HG1 THR 48 -12.112 -27.019 -0.815 409 HG21 THR 81 HG21 THR 48 -10.699 -28.437 -2.461 410 HG22 THR 81 HG22 THR 48 -12.442 -28.330 -2.769 411 HG23 THR 81 HG23 THR 48 -11.296 -27.964 -4.072 412 H LEU 82 H LEU 49 -11.667 -23.997 -4.400 413 HA LEU 82 HA LEU 49 -10.721 -21.472 -3.421 414 HB2 LEU 82 HB2 LEU 49 -13.402 -22.360 -4.626 415 HB3 LEU 82 HB3 LEU 49 -13.085 -20.704 -4.170 416 HG LEU 82 HG LEU 49 -12.847 -20.884 -6.519 417 HD11 LEU 82 HD11 LEU 49 -10.073 -20.677 -5.274 418 HD12 LEU 82 HD12 LEU 49 -10.544 -20.076 -6.861 419 HD13 LEU 82 HD13 LEU 49 -11.284 -19.373 -5.396 420 HD21 LEU 82 HD21 LEU 49 -12.351 -23.306 -6.720 421 HD22 LEU 82 HD22 LEU 49 -11.282 -22.291 -7.693 422 HD23 LEU 82 HD23 LEU 49 -10.671 -22.985 -6.190 423 H GLU 83 H GLU 50 -13.401 -23.631 -2.353 424 HA GLU 83 HA GLU 50 -14.273 -21.850 -0.327 425 HB2 GLU 83 HB2 GLU 50 -15.501 -23.625 0.619 426 HB3 GLU 83 HB3 GLU 50 -15.596 -23.772 -1.131 427 HG2 GLU 83 HG2 GLU 50 -13.944 -25.603 -1.083 428 HG3 GLU 83 HG3 GLU 50 -13.803 -25.439 0.673 429 H ALA 84 H ALA 51 -11.737 -24.468 -0.176 430 HA ALA 84 HA ALA 51 -11.264 -24.179 2.601 431 HB1 ALA 84 HB1 ALA 51 -9.359 -25.054 0.409 432 HB2 ALA 84 HB2 ALA 51 -9.138 -25.299 2.161 433 HB3 ALA 84 HB3 ALA 51 -10.481 -26.093 1.326 434 H TYR 85 H TYR 52 -9.751 -22.473 -0.174 435 HA TYR 85 HA TYR 52 -7.954 -20.852 1.315 436 HB2 TYR 85 HB2 TYR 52 -7.786 -20.893 -1.038 437 HB3 TYR 85 HB3 TYR 52 -9.468 -20.426 -1.276 438 HD1 TYR 85 HD1 TYR 52 -6.167 -19.205 -0.024 439 HD2 TYR 85 HD2 TYR 52 -10.112 -18.131 -1.421 440 HE1 TYR 85 HE1 TYR 52 -5.491 -16.835 -0.027 441 HE2 TYR 85 HE2 TYR 52 -9.464 -15.753 -1.406 442 HH TYR 85 HH TYR 52 -6.211 -14.627 -0.337 443 H LEU 86 H LEU 53 -11.433 -20.256 0.460 444 HA LEU 86 HA LEU 53 -11.553 -17.777 1.884 445 HB2 LEU 86 HB2 LEU 53 -13.706 -19.727 0.968 446 HB3 LEU 86 HB3 LEU 53 -14.037 -18.115 1.615 447 HG LEU 86 HG LEU 53 -12.220 -18.406 -0.777 448 HD11 LEU 86 HD11 LEU 53 -14.264 -18.038 -2.197 449 HD12 LEU 86 HD12 LEU 53 -14.163 -19.637 -1.463 450 HD13 LEU 86 HD13 LEU 53 -15.250 -18.446 -0.751 451 HD21 LEU 86 HD21 LEU 53 -12.956 -16.137 -1.217 452 HD22 LEU 86 HD22 LEU 53 -14.123 -16.197 0.123 453 HD23 LEU 86 HD23 LEU 53 -12.375 -16.229 0.449 454 H ARG 87 H ARG 54 -12.285 -21.112 2.964 455 HA ARG 87 HA ARG 54 -13.229 -20.488 5.619 456 HB2 ARG 87 HB2 ARG 54 -11.558 -22.842 4.591 457 HB3 ARG 87 HB3 ARG 54 -11.862 -22.630 6.288 458 HG2 ARG 87 HG2 ARG 54 -13.382 -24.229 5.663 459 HG3 ARG 87 HG3 ARG 54 -14.333 -22.755 5.866 460 HD2 ARG 87 HD2 ARG 54 -14.541 -22.526 3.425 461 HD3 ARG 87 HD3 ARG 54 -13.229 -23.678 3.214 462 HE ARG 87 HE ARG 54 -14.688 -25.226 2.877 463 HH11 ARG 87 HH12 ARG 54 -16.094 -23.500 5.689 464 HH12 ARG 87 HH11 ARG 54 -17.503 -24.492 5.712 465 HH21 ARG 87 HH21 ARG 54 -16.583 -26.350 2.823 466 HH22 ARG 87 HH22 ARG 54 -17.741 -26.239 4.123 467 H SER 88 H SER 55 -9.938 -20.537 4.272 468 HA SER 88 HA SER 55 -8.667 -20.421 6.839 469 HB2 SER 88 HB2 SER 55 -7.532 -20.130 4.039 470 HB3 SER 88 HB3 SER 55 -6.624 -20.413 5.535 471 HG SER 88 HG SER 55 -8.476 -22.135 4.232 472 H VAL 89 H VAL 56 -10.367 -17.910 5.723 473 HA VAL 89 HA VAL 56 -8.431 -15.940 6.838 474 HB VAL 89 HB VAL 56 -8.276 -15.744 4.484 475 HG11 VAL 89 HG11 VAL 56 -10.096 -16.746 3.487 476 HG12 VAL 89 HG12 VAL 56 -11.281 -15.806 4.405 477 HG13 VAL 89 HG13 VAL 56 -10.346 -15.045 3.096 478 HG21 VAL 89 HG21 VAL 56 -10.008 -13.393 5.236 479 HG22 VAL 89 HG22 VAL 56 -8.327 -13.613 5.781 480 HG23 VAL 89 HG23 VAL 56 -8.698 -13.482 4.056 481 HA PRO 90 HA PRO 57 -12.883 -16.078 8.469 482 HB2 PRO 90 HB2 PRO 57 -12.673 -17.091 10.981 483 HB3 PRO 90 HB3 PRO 57 -12.687 -18.130 9.525 484 HG2 PRO 90 HG2 PRO 57 -10.271 -17.182 11.096 485 HG3 PRO 90 HG3 PRO 57 -10.659 -18.837 10.520 486 HD2 PRO 90 HD2 PRO 57 -8.996 -17.122 9.141 487 HD3 PRO 90 HD3 PRO 57 -10.028 -18.346 8.359 488 H ALA 91 H ALA 58 -9.914 -14.689 9.752 489 HA ALA 91 HA ALA 58 -11.255 -12.968 11.687 490 HB1 ALA 91 HB1 ALA 58 -8.931 -13.786 12.017 491 HB2 ALA 91 HB2 ALA 58 -8.415 -12.912 10.565 492 HB3 ALA 91 HB3 ALA 58 -8.996 -12.019 11.985 493 H VAL 92 H VAL 59 -10.986 -12.845 8.288 494 HA VAL 92 HA VAL 59 -11.406 -9.882 8.281 495 HB VAL 92 HB VAL 59 -9.680 -11.402 6.303 496 HG11 VAL 92 HG11 VAL 59 -10.648 -9.309 5.436 497 HG12 VAL 92 HG12 VAL 59 -9.992 -8.413 6.816 498 HG13 VAL 92 HG13 VAL 59 -8.902 -9.159 5.626 499 HG21 VAL 92 HG21 VAL 59 -8.461 -11.460 8.423 500 HG22 VAL 92 HG22 VAL 59 -7.715 -10.279 7.354 501 HG23 VAL 92 HG23 VAL 59 -8.765 -9.729 8.679 502 H VAL 93 H VAL 60 -12.314 -13.037 7.082 503 HA VAL 93 HA VAL 60 -14.362 -11.885 5.267 504 HB VAL 93 HB VAL 60 -12.209 -13.958 4.800 505 HG11 VAL 93 HG11 VAL 60 -14.172 -15.054 3.878 506 HG12 VAL 93 HG12 VAL 60 -14.569 -13.598 2.934 507 HG13 VAL 93 HG13 VAL 60 -13.095 -14.516 2.594 508 HG21 VAL 93 HG21 VAL 60 -11.811 -12.558 2.720 509 HG22 VAL 93 HG22 VAL 60 -12.960 -11.381 3.396 510 HG23 VAL 93 HG23 VAL 60 -11.454 -11.764 4.251 511 H ARG 94 H ARG 61 -16.009 -13.577 4.801 512 HA ARG 94 HA ARG 61 -16.539 -15.492 7.005 513 HB2 ARG 94 HB2 ARG 61 -17.522 -13.464 7.837 514 HB3 ARG 94 HB3 ARG 61 -18.200 -13.041 6.269 515 HG2 ARG 94 HG2 ARG 61 -19.787 -14.983 6.459 516 HG3 ARG 94 HG3 ARG 61 -19.053 -15.397 8.020 517 HD2 ARG 94 HD2 ARG 61 -21.075 -14.216 8.476 518 HD3 ARG 94 HD3 ARG 61 -19.757 -13.117 8.851 519 HE ARG 94 HE ARG 61 -20.208 -11.851 6.860 520 HH11 ARG 94 HH11 ARG 61 -22.537 -14.563 7.118 521 HH12 ARG 94 HH12 ARG 61 -23.805 -13.687 6.331 522 HH21 ARG 94 HH21 ARG 61 -21.978 -10.683 5.920 523 HH22 ARG 94 HH22 ARG 61 -23.417 -11.525 5.497 524 H ILE 95 H ILE 62 -18.168 -17.063 6.294 525 HA ILE 95 HA ILE 62 -19.000 -16.876 3.484 526 HB ILE 95 HB ILE 62 -18.277 -19.195 3.048 527 HG12 ILE 95 HG12 ILE 62 -16.678 -18.972 5.613 528 HG13 ILE 95 HG13 ILE 62 -18.049 -20.055 5.322 529 HG21 ILE 95 HG21 ILE 62 -16.053 -18.700 2.398 530 HG22 ILE 95 HG22 ILE 62 -16.903 -17.163 2.357 531 HG23 ILE 95 HG23 ILE 62 -15.824 -17.522 3.723 532 HD11 ILE 95 HD11 ILE 62 -16.733 -21.185 3.519 533 HD12 ILE 95 HD12 ILE 62 -15.324 -20.191 3.980 534 HD13 ILE 95 HD13 ILE 62 -16.029 -21.314 5.147 535 H GLU 96 H GLU 63 -20.839 -18.109 3.029 536 HA GLU 96 HA GLU 63 -22.125 -19.581 5.285 537 HB2 GLU 96 HB2 GLU 63 -23.524 -17.762 3.287 538 HB3 GLU 96 HB3 GLU 63 -24.283 -18.690 4.568 539 HG2 GLU 96 HG2 GLU 63 -22.394 -16.322 4.908 540 HG3 GLU 96 HG3 GLU 63 -24.134 -16.302 5.097 541 H ALA 97 H ALA 64 -21.662 -21.614 4.523 542 HA ALA 97 HA ALA 64 -21.991 -22.378 1.718 543 HB1 ALA 97 HB1 ALA 64 -20.359 -23.541 3.118 544 HB2 ALA 97 HB2 ALA 64 -21.648 -24.048 4.239 545 HB3 ALA 97 HB3 ALA 64 -21.631 -24.654 2.571 546 H SER 98 H SER 65 -23.920 -22.780 0.807 547 HA SER 98 HA SER 65 -26.397 -22.728 2.379 548 HB2 SER 98 HB2 SER 65 -26.129 -21.478 0.231 549 HB3 SER 98 HB3 SER 65 -25.889 -23.018 -0.617 550 HG SER 98 HG SER 65 -28.090 -22.184 -0.647 551 H ARG 99 H ARG 66 -27.941 -24.420 2.157 552 HA ARG 99 HA ARG 66 -26.966 -27.062 2.503 553 HB2 ARG 99 HB2 ARG 66 -29.164 -27.778 2.727 554 HB3 ARG 99 HB3 ARG 66 -29.162 -26.144 3.356 555 HG2 ARG 99 HG2 ARG 66 -30.268 -27.065 0.657 556 HG3 ARG 99 HG3 ARG 66 -31.186 -26.683 2.105 557 HD2 ARG 99 HD2 ARG 66 -30.261 -24.310 1.955 558 HD3 ARG 99 HD3 ARG 66 -29.707 -24.711 0.331 559 HE ARG 99 HE ARG 66 -32.452 -24.378 1.315 560 HH11 ARG 99 HH12 ARG 66 -30.455 -25.182 -1.553 561 HH12 ARG 99 HH11 ARG 66 -31.809 -25.269 -2.603 562 HH21 ARG 99 HH21 ARG 66 -34.210 -24.412 -0.133 563 HH22 ARG 99 HH22 ARG 66 -33.980 -24.754 -1.808 564 H SER 100 H SER 67 -27.649 -25.339 -0.445 565 HA SER 100 HA SER 67 -28.045 -27.502 -2.213 566 HB2 SER 100 HB2 SER 67 -26.696 -24.858 -2.846 567 HB3 SER 100 HB3 SER 67 -27.741 -25.832 -3.895 568 HG SER 100 HG SER 67 -28.817 -23.996 -2.961 569 H GLY 101 H GLY 68 -25.180 -26.693 -0.432 570 HA2 GLY 101 HA2 GLY 68 -23.041 -27.512 -0.580 571 HA3 GLY 101 HA3 GLY 68 -23.476 -28.466 -2.013 572 H GLU 102 H GLU 69 -23.911 -24.957 -1.486 573 HA GLU 102 HA GLU 69 -21.714 -24.276 -3.334 574 HB2 GLU 102 HB2 GLU 69 -24.527 -23.069 -3.329 575 HB3 GLU 102 HB3 GLU 69 -23.127 -22.368 -4.150 576 HG2 GLU 102 HG2 GLU 69 -22.912 -24.437 -5.531 577 HG3 GLU 102 HG3 GLU 69 -24.365 -25.087 -4.761 578 H ILE 103 H ILE 70 -21.127 -21.859 -2.744 579 HA ILE 103 HA ILE 70 -21.788 -21.232 0.035 580 HB ILE 103 HB ILE 70 -20.009 -22.541 0.546 581 HG12 ILE 103 HG12 ILE 70 -19.816 -20.164 1.416 582 HG13 ILE 103 HG13 ILE 70 -18.450 -21.242 1.613 583 HG21 ILE 103 HG21 ILE 70 -18.296 -21.603 -1.730 584 HG22 ILE 103 HG22 ILE 70 -17.807 -22.698 -0.431 585 HG23 ILE 103 HG23 ILE 70 -19.072 -23.199 -1.542 586 HD11 ILE 103 HD11 ILE 70 -17.971 -18.816 0.838 587 HD12 ILE 103 HD12 ILE 70 -17.133 -20.144 0.020 588 HD13 ILE 103 HD13 ILE 70 -18.503 -19.332 -0.752 589 H VAL 104 H VAL 71 -21.763 -19.174 0.547 590 HA VAL 104 HA VAL 71 -21.250 -17.216 -1.633 591 HB VAL 104 HB VAL 71 -23.083 -16.850 0.773 592 HG11 VAL 104 HG11 VAL 71 -22.420 -14.834 -0.482 593 HG12 VAL 104 HG12 VAL 71 -23.005 -15.566 -2.002 594 HG13 VAL 104 HG13 VAL 71 -24.146 -15.162 -0.702 595 HG21 VAL 104 HG21 VAL 71 -25.027 -17.412 -0.692 596 HG22 VAL 104 HG22 VAL 71 -23.899 -18.056 -1.903 597 HG23 VAL 104 HG23 VAL 71 -24.036 -18.813 -0.310 598 H CYS 105 H CYS 72 -19.792 -15.599 -1.159 599 HA CYS 105 HA CYS 72 -18.309 -15.862 1.399 600 HB2 CYS 105 HB2 CYS 72 -17.419 -14.383 -1.089 601 HB3 CYS 105 HB3 CYS 72 -16.414 -15.120 0.177 602 HG CYS 105 HG CYS 72 -18.209 -16.463 -2.268 603 H TYR 106 H TYR 73 -17.788 -13.989 2.604 604 HA TYR 106 HA TYR 73 -19.065 -11.388 1.893 605 HB2 TYR 106 HB2 TYR 73 -19.447 -13.066 4.408 606 HB3 TYR 106 HB3 TYR 73 -19.896 -11.372 4.302 607 HD1 TYR 106 HD1 TYR 73 -21.619 -10.646 2.557 608 HD2 TYR 106 HD2 TYR 73 -20.879 -14.783 3.603 609 HE1 TYR 106 HE1 TYR 73 -23.911 -11.208 1.864 610 HE2 TYR 106 HE2 TYR 73 -23.129 -15.388 2.767 611 HH TYR 106 HH TYR 73 -25.192 -14.596 1.961 612 H ALA 107 H ALA 74 -18.323 -9.678 3.521 613 HA ALA 107 HA ALA 74 -15.450 -10.074 4.160 614 HB1 ALA 107 HB1 ALA 74 -16.168 -7.982 2.995 615 HB2 ALA 107 HB2 ALA 74 -17.203 -7.582 4.383 616 HB3 ALA 107 HB3 ALA 74 -15.428 -7.681 4.569 617 H VAL 108 H VAL 75 -14.730 -9.263 6.282 618 HA VAL 108 HA VAL 75 -16.773 -9.020 8.408 619 HB VAL 108 HB VAL 75 -15.108 -11.344 8.056 620 HG11 VAL 108 HG11 VAL 75 -14.186 -11.702 10.255 621 HG12 VAL 108 HG12 VAL 75 -13.427 -10.285 9.522 622 HG13 VAL 108 HG13 VAL 75 -14.665 -10.075 10.777 623 HG21 VAL 108 HG21 VAL 75 -17.070 -10.620 10.269 624 HG22 VAL 108 HG22 VAL 75 -17.520 -11.292 8.689 625 HG23 VAL 108 HG23 VAL 75 -16.544 -12.262 9.811 626 H ALA 109 H ALA 76 -13.527 -8.205 7.208 627 HA ALA 109 HA ALA 76 -13.535 -5.879 8.975 628 HB1 ALA 109 HB1 ALA 76 -11.131 -7.758 8.892 629 HB2 ALA 109 HB2 ALA 76 -11.269 -6.244 9.791 630 HB3 ALA 109 HB3 ALA 76 -12.259 -7.641 10.266 Start of MODEL 8 1 H1 GLY -2 H1 GLY -2 6.025 1.585 -2.446 2 H2 GLY -2 H2 GLY -2 7.197 1.432 -1.309 3 H3 GLY -2 H3 GLY -2 6.835 0.173 -2.294 4 HA2 GLY -2 HA2 GLY -2 5.904 -0.199 -0.102 5 HA3 GLY -2 HA3 GLY -2 5.042 1.336 -0.268 6 H HIS -1 H HIS -1 4.876 -2.036 -0.785 7 HA HIS -1 HA HIS -1 2.250 -1.857 -2.062 8 HB2 HIS -1 HB2 HIS -1 2.840 -3.420 -3.861 9 HB3 HIS -1 HB3 HIS -1 3.715 -1.910 -4.019 10 HD2 HIS -1 HD2 HIS -1 4.228 -5.628 -3.651 11 HE1 HIS -1 HE1 HIS -1 8.146 -3.952 -3.492 12 HE2 HIS -1 HE2 HIS -1 6.819 -6.116 -3.677 13 H MET 34 H MET 1 1.130 -3.946 -1.902 14 HA MET 34 HA MET 1 1.654 -5.219 0.629 15 HB2 MET 34 HB2 MET 1 -0.270 -5.917 -1.633 16 HB3 MET 34 HB3 MET 1 -0.225 -6.715 -0.057 17 HG2 MET 34 HG2 MET 1 -1.762 -5.242 0.585 18 HG3 MET 34 HG3 MET 1 -0.431 -4.112 0.726 19 HE1 MET 34 HE1 MET 1 -3.750 -5.083 -0.904 20 HE2 MET 34 HE2 MET 1 -3.893 -4.073 -2.352 21 HE3 MET 34 HE3 MET 1 -2.831 -5.476 -2.368 22 H LEU 35 H LEU 2 2.209 -7.399 1.044 23 HA LEU 35 HA LEU 2 4.027 -8.741 -0.875 24 HB2 LEU 35 HB2 LEU 2 2.919 -9.648 1.831 25 HB3 LEU 35 HB3 LEU 2 4.174 -10.463 0.906 26 HG LEU 35 HG LEU 2 4.404 -7.695 2.176 27 HD11 LEU 35 HD11 LEU 2 4.432 -9.565 3.779 28 HD12 LEU 35 HD12 LEU 2 5.748 -10.336 2.867 29 HD13 LEU 35 HD13 LEU 2 6.016 -8.774 3.676 30 HD21 LEU 35 HD21 LEU 2 6.473 -9.286 0.597 31 HD22 LEU 35 HD22 LEU 2 5.757 -7.715 0.144 32 HD23 LEU 35 HD23 LEU 2 6.813 -7.829 1.548 33 H GLU 36 H GLU 3 3.443 -11.175 -1.416 34 HA GLU 36 HA GLU 3 1.131 -11.029 -2.959 35 HB2 GLU 36 HB2 GLU 3 2.991 -12.562 -3.447 36 HB3 GLU 36 HB3 GLU 3 2.558 -13.566 -2.054 37 HG2 GLU 36 HG2 GLU 3 0.425 -14.158 -3.055 38 HG3 GLU 36 HG3 GLU 3 0.691 -13.033 -4.384 39 H ALA 37 H ALA 4 1.435 -12.934 0.049 40 HA ALA 37 HA ALA 4 -1.281 -13.755 -0.071 41 HB1 ALA 37 HB1 ALA 4 -1.041 -14.556 2.207 42 HB2 ALA 37 HB2 ALA 4 0.370 -14.996 1.235 43 HB3 ALA 37 HB3 ALA 4 0.481 -13.651 2.401 44 H ASP 38 H ASP 5 0.229 -10.871 1.327 45 HA ASP 38 HA ASP 5 -2.085 -9.996 2.838 46 HB2 ASP 38 HB2 ASP 5 0.269 -9.324 3.309 47 HB3 ASP 38 HB3 ASP 5 0.293 -8.406 1.802 48 H LEU 39 H LEU 6 -0.816 -9.384 -0.443 49 HA LEU 39 HA LEU 6 -2.612 -7.342 -1.254 50 HB2 LEU 39 HB2 LEU 6 -0.529 -7.944 -2.457 51 HB3 LEU 39 HB3 LEU 6 -1.180 -9.498 -2.893 52 HG LEU 39 HG LEU 6 -2.729 -7.058 -3.759 53 HD11 LEU 39 HD11 LEU 6 -1.305 -6.824 -5.758 54 HD12 LEU 39 HD12 LEU 6 -0.393 -6.492 -4.288 55 HD13 LEU 39 HD13 LEU 6 -0.187 -8.051 -5.115 56 HD21 LEU 39 HD21 LEU 6 -3.717 -9.201 -4.374 57 HD22 LEU 39 HD22 LEU 6 -3.089 -8.415 -5.810 58 HD23 LEU 39 HD23 LEU 6 -2.171 -9.745 -5.077 59 H VAL 40 H VAL 7 -2.704 -10.909 -1.819 60 HA VAL 40 HA VAL 7 -5.213 -10.761 -3.122 61 HB VAL 40 HB VAL 7 -5.220 -13.200 -3.012 62 HG11 VAL 40 HG11 VAL 7 -2.376 -12.242 -3.503 63 HG12 VAL 40 HG12 VAL 7 -3.225 -13.588 -4.264 64 HG13 VAL 40 HG13 VAL 7 -3.719 -11.934 -4.602 65 HG21 VAL 40 HG21 VAL 7 -2.915 -12.943 -1.082 66 HG22 VAL 40 HG22 VAL 7 -4.505 -13.631 -0.720 67 HG23 VAL 40 HG23 VAL 7 -3.427 -14.448 -1.842 68 H SER 41 H SER 8 -4.418 -11.338 0.352 69 HA SER 41 HA SER 8 -7.093 -11.806 1.172 70 HB2 SER 41 HB2 SER 8 -4.793 -10.591 2.768 71 HB3 SER 41 HB3 SER 8 -6.290 -11.274 3.429 72 HG SER 41 HG SER 8 -4.119 -12.565 2.176 73 H LYS 42 H LYS 9 -5.256 -8.629 1.137 74 HA LYS 42 HA LYS 9 -7.526 -7.179 2.209 75 HB2 LYS 42 HB2 LYS 9 -4.981 -6.347 0.764 76 HB3 LYS 42 HB3 LYS 9 -6.213 -5.167 1.243 77 HG2 LYS 42 HG2 LYS 9 -6.053 -5.814 3.590 78 HG3 LYS 42 HG3 LYS 9 -4.896 -7.105 3.185 79 HD2 LYS 42 HD2 LYS 9 -3.289 -5.473 2.334 80 HD3 LYS 42 HD3 LYS 9 -4.390 -4.132 2.710 81 HE2 LYS 42 HE2 LYS 9 -4.198 -4.496 5.068 82 HE3 LYS 42 HE3 LYS 9 -3.511 -6.110 4.843 83 HZ1 LYS 42 HZ1 LYS 9 -2.110 -3.599 4.133 84 HZ2 LYS 42 HZ2 LYS 9 -1.808 -4.532 5.444 85 HZ3 LYS 42 HZ3 LYS 9 -1.522 -5.138 3.947 86 H MET 43 H MET 10 -6.425 -7.779 -1.214 87 HA MET 43 HA MET 10 -8.507 -6.054 -2.259 88 HB2 MET 43 HB2 MET 10 -6.807 -8.220 -3.551 89 HB3 MET 43 HB3 MET 10 -7.978 -7.223 -4.428 90 HG2 MET 43 HG2 MET 10 -6.782 -5.170 -3.476 91 HG3 MET 43 HG3 MET 10 -5.489 -6.265 -2.973 92 HE1 MET 43 HE1 MET 10 -3.585 -4.904 -4.477 93 HE2 MET 43 HE2 MET 10 -3.990 -4.306 -6.094 94 HE3 MET 43 HE3 MET 10 -4.920 -3.741 -4.682 95 H LEU 44 H LEU 11 -8.352 -9.634 -1.723 96 HA LEU 44 HA LEU 11 -10.934 -10.377 -2.561 97 HB2 LEU 44 HB2 LEU 11 -9.297 -12.000 -1.753 98 HB3 LEU 44 HB3 LEU 11 -9.177 -11.186 -0.204 99 HG LEU 44 HG LEU 11 -11.549 -11.842 0.295 100 HD11 LEU 44 HD11 LEU 11 -11.082 -13.591 -2.163 101 HD12 LEU 44 HD12 LEU 11 -12.404 -13.792 -0.981 102 HD13 LEU 44 HD13 LEU 11 -12.329 -12.326 -1.983 103 HD21 LEU 44 HD21 LEU 11 -9.458 -13.992 -0.126 104 HD22 LEU 44 HD22 LEU 11 -9.683 -12.998 1.312 105 HD23 LEU 44 HD23 LEU 11 -10.924 -14.178 0.858 106 H ARG 45 H ARG 12 -9.942 -9.238 0.669 107 HA ARG 45 HA ARG 12 -12.468 -8.968 1.856 108 HB2 ARG 45 HB2 ARG 12 -10.576 -8.953 3.174 109 HB3 ARG 45 HB3 ARG 12 -9.730 -7.771 2.216 110 HG2 ARG 45 HG2 ARG 12 -12.183 -6.857 3.677 111 HG3 ARG 45 HG3 ARG 12 -10.706 -7.203 4.573 112 HD2 ARG 45 HD2 ARG 12 -9.527 -5.640 2.797 113 HD3 ARG 45 HD3 ARG 12 -11.180 -5.020 2.550 114 HE ARG 45 HE ARG 12 -10.407 -5.349 5.328 115 HH11 ARG 45 HH11 ARG 12 -9.943 -2.967 2.709 116 HH12 ARG 45 HH12 ARG 12 -9.929 -1.620 3.795 117 HH21 ARG 45 HH21 ARG 12 -10.519 -3.710 6.654 118 HH22 ARG 45 HH22 ARG 12 -10.184 -2.050 6.190 119 H ALA 46 H ALA 13 -10.682 -6.469 -0.082 120 HA ALA 46 HA ALA 13 -12.671 -4.526 0.431 121 HB1 ALA 46 HB1 ALA 13 -11.581 -3.251 -1.396 122 HB2 ALA 46 HB2 ALA 13 -10.359 -3.998 -0.353 123 HB3 ALA 46 HB3 ALA 13 -10.738 -4.718 -1.943 124 H VAL 47 H VAL 14 -12.390 -6.892 -2.273 125 HA VAL 47 HA VAL 14 -14.665 -5.903 -3.734 126 HB VAL 47 HB VAL 14 -13.478 -8.715 -3.529 127 HG11 VAL 47 HG11 VAL 14 -15.438 -7.625 -5.593 128 HG12 VAL 47 HG12 VAL 14 -14.648 -9.226 -5.603 129 HG13 VAL 47 HG13 VAL 14 -15.816 -8.825 -4.345 130 HG21 VAL 47 HG21 VAL 14 -11.902 -7.101 -4.505 131 HG22 VAL 47 HG22 VAL 14 -12.545 -8.101 -5.803 132 HG23 VAL 47 HG23 VAL 14 -13.159 -6.458 -5.578 133 H LEU 48 H LEU 15 -14.329 -8.297 -1.062 134 HA LEU 48 HA LEU 15 -17.092 -8.987 -0.964 135 HB2 LEU 48 HB2 LEU 15 -14.926 -9.005 1.195 136 HB3 LEU 48 HB3 LEU 15 -16.499 -9.749 1.386 137 HG LEU 48 HG LEU 15 -14.741 -10.556 -0.961 138 HD11 LEU 48 HD11 LEU 15 -13.387 -10.791 1.042 139 HD12 LEU 48 HD12 LEU 15 -14.715 -11.581 1.907 140 HD13 LEU 48 HD13 LEU 15 -13.944 -12.408 0.530 141 HD21 LEU 48 HD21 LEU 15 -16.017 -12.601 -0.818 142 HD22 LEU 48 HD22 LEU 15 -16.801 -12.064 0.674 143 HD23 LEU 48 HD23 LEU 15 -17.175 -11.252 -0.856 144 H GLN 49 H GLN 16 -15.282 -6.364 0.755 145 HA GLN 49 HA GLN 16 -17.539 -5.505 2.303 146 HB2 GLN 49 HB2 GLN 16 -14.994 -4.085 1.401 147 HB3 GLN 49 HB3 GLN 16 -16.194 -3.323 2.444 148 HG2 GLN 49 HG2 GLN 16 -14.692 -5.873 3.162 149 HG3 GLN 49 HG3 GLN 16 -14.236 -4.252 3.664 150 HE21 GLN 49 HE22 GLN 16 -14.456 -5.690 5.797 151 HE22 GLN 49 HE21 GLN 16 -16.008 -5.514 6.600 152 H SER 50 H SER 17 -16.415 -4.682 -0.995 153 HA SER 50 HA SER 17 -18.334 -2.581 -1.437 154 HB2 SER 50 HB2 SER 17 -16.947 -4.435 -3.425 155 HB3 SER 50 HB3 SER 17 -17.774 -2.920 -3.800 156 HG SER 50 HG SER 17 -15.392 -3.282 -2.255 157 H HIS 51 H HIS 18 -18.406 -6.116 -1.792 158 HA HIS 51 HA HIS 18 -21.070 -6.034 -3.061 159 HB2 HIS 51 HB2 HIS 18 -18.943 -8.188 -2.858 160 HB3 HIS 51 HB3 HIS 18 -20.507 -8.373 -3.653 161 HD2 HIS 51 HD2 HIS 18 -18.858 -8.949 -5.798 162 HE1 HIS 51 HE1 HIS 18 -18.088 -4.906 -6.809 163 HE2 HIS 51 HE2 HIS 18 -17.997 -7.287 -7.662 164 H LYS 52 H LYS 19 -21.779 -5.370 -0.716 165 HA LYS 52 HA LYS 19 -21.699 -7.157 1.443 166 HB2 LYS 52 HB2 LYS 19 -23.785 -5.072 0.665 167 HB3 LYS 52 HB3 LYS 19 -23.821 -5.923 2.201 168 HG2 LYS 52 HG2 LYS 19 -21.549 -4.127 1.257 169 HG3 LYS 52 HG3 LYS 19 -22.819 -3.712 2.404 170 HD2 LYS 52 HD2 LYS 19 -22.012 -5.701 3.833 171 HD3 LYS 52 HD3 LYS 19 -20.577 -5.741 2.793 172 HE2 LYS 52 HE2 LYS 19 -20.166 -3.304 3.288 173 HE3 LYS 52 HE3 LYS 19 -21.598 -3.283 4.318 174 HZ1 LYS 52 HZ1 LYS 19 -19.741 -3.520 5.712 175 HZ2 LYS 52 HZ2 LYS 19 -20.436 -4.987 5.729 176 HZ3 LYS 52 HZ3 LYS 19 -19.059 -4.713 4.847 177 H ASN 53 H ASN 20 -23.832 -7.359 -1.361 178 HA ASN 53 HA ASN 20 -25.755 -9.146 -0.243 179 HB2 ASN 53 HB2 ASN 20 -26.015 -7.937 -2.415 180 HB3 ASN 53 HB3 ASN 20 -24.736 -8.941 -3.114 181 HD21 ASN 53 HD22 ASN 20 -27.984 -9.214 -1.475 182 HD22 ASN 53 HD21 ASN 20 -28.468 -10.638 -2.361 183 H GLY 54 H GLY 21 -22.397 -9.670 -0.868 184 HA2 GLY 54 HA2 GLY 21 -21.132 -11.501 -0.505 185 HA3 GLY 54 HA3 GLY 21 -22.553 -12.544 -0.398 186 H ILE 55 H ILE 22 -20.427 -13.425 -1.827 187 HA ILE 55 HA ILE 22 -21.394 -13.449 -4.630 188 HB ILE 55 HB ILE 22 -18.797 -13.388 -5.191 189 HG12 ILE 55 HG12 ILE 22 -18.859 -11.628 -2.686 190 HG13 ILE 55 HG13 ILE 22 -17.902 -13.081 -2.935 191 HG21 ILE 55 HG21 ILE 22 -20.122 -10.717 -4.669 192 HG22 ILE 55 HG22 ILE 22 -19.004 -11.208 -5.980 193 HG23 ILE 55 HG23 ILE 22 -20.664 -11.804 -5.958 194 HD11 ILE 55 HD11 ILE 22 -16.730 -11.751 -4.845 195 HD12 ILE 55 HD12 ILE 22 -17.605 -10.337 -4.242 196 HD13 ILE 55 HD13 ILE 22 -16.456 -11.160 -3.194 197 H VAL 56 H VAL 23 -21.601 -15.438 -5.281 198 HA VAL 56 HA VAL 23 -20.957 -17.655 -3.650 199 HB VAL 56 HB VAL 23 -21.571 -18.964 -5.717 200 HG11 VAL 56 HG11 VAL 23 -23.242 -18.441 -4.069 201 HG12 VAL 56 HG12 VAL 23 -23.510 -16.821 -4.767 202 HG13 VAL 56 HG13 VAL 23 -23.943 -18.282 -5.684 203 HG21 VAL 56 HG21 VAL 23 -22.162 -16.235 -6.968 204 HG22 VAL 56 HG22 VAL 23 -20.855 -17.331 -7.453 205 HG23 VAL 56 HG23 VAL 23 -22.529 -17.827 -7.647 206 H LEU 57 H LEU 24 -19.248 -19.378 -3.969 207 HA LEU 57 HA LEU 24 -16.833 -18.244 -4.319 208 HB2 LEU 57 HB2 LEU 24 -15.670 -20.137 -4.039 209 HB3 LEU 57 HB3 LEU 24 -17.154 -20.385 -3.219 210 HG LEU 57 HG LEU 24 -17.894 -21.866 -5.211 211 HD11 LEU 57 HD11 LEU 24 -15.823 -22.901 -6.425 212 HD12 LEU 57 HD12 LEU 24 -16.420 -21.400 -7.060 213 HD13 LEU 57 HD13 LEU 24 -14.992 -21.390 -6.015 214 HD21 LEU 57 HD21 LEU 24 -17.078 -22.822 -3.101 215 HD22 LEU 57 HD22 LEU 24 -16.474 -23.774 -4.443 216 HD23 LEU 57 HD23 LEU 24 -15.402 -22.621 -3.610 217 HA PRO 58 HA PRO 25 -16.098 -19.176 -8.898 218 HB2 PRO 58 HB2 PRO 25 -18.203 -19.203 -10.682 219 HB3 PRO 58 HB3 PRO 25 -17.542 -20.667 -9.885 220 HG2 PRO 58 HG2 PRO 25 -19.976 -19.052 -9.101 221 HG3 PRO 58 HG3 PRO 25 -19.813 -20.824 -9.229 222 HD2 PRO 58 HD2 PRO 25 -19.631 -19.527 -6.854 223 HD3 PRO 58 HD3 PRO 25 -18.650 -20.961 -7.202 224 H ARG 59 H ARG 26 -18.941 -17.168 -8.059 225 HA ARG 59 HA ARG 26 -18.250 -14.936 -9.778 226 HB2 ARG 59 HB2 ARG 26 -20.542 -15.449 -8.879 227 HB3 ARG 59 HB3 ARG 26 -19.971 -14.991 -7.250 228 HG2 ARG 59 HG2 ARG 26 -19.552 -12.712 -8.047 229 HG3 ARG 59 HG3 ARG 26 -19.981 -13.193 -9.702 230 HD2 ARG 59 HD2 ARG 26 -22.282 -13.705 -8.963 231 HD3 ARG 59 HD3 ARG 26 -21.873 -13.200 -7.307 232 HE ARG 59 HE ARG 26 -21.192 -11.091 -9.076 233 HH11 ARG 59 HH11 ARG 26 -24.164 -12.690 -7.906 234 HH12 ARG 59 HH12 ARG 26 -25.136 -11.279 -8.056 235 HH21 ARG 59 HH21 ARG 26 -22.512 -9.224 -9.297 236 HH22 ARG 59 HH22 ARG 26 -24.177 -9.269 -8.871 237 H LEU 60 H LEU 27 -17.403 -15.970 -6.490 238 HA LEU 60 HA LEU 27 -16.139 -13.666 -5.553 239 HB2 LEU 60 HB2 LEU 27 -16.554 -15.735 -4.193 240 HB3 LEU 60 HB3 LEU 27 -15.309 -16.585 -5.068 241 HG LEU 60 HG LEU 27 -14.603 -15.926 -2.893 242 HD11 LEU 60 HD11 LEU 27 -12.929 -16.211 -4.721 243 HD12 LEU 60 HD12 LEU 27 -12.863 -14.431 -4.854 244 HD13 LEU 60 HD13 LEU 27 -12.421 -15.228 -3.345 245 HD21 LEU 60 HD21 LEU 27 -14.604 -13.024 -3.825 246 HD22 LEU 60 HD22 LEU 27 -15.890 -13.778 -2.834 247 HD23 LEU 60 HD23 LEU 27 -14.258 -13.668 -2.208 248 H GLN 61 H GLN 28 -14.682 -16.485 -7.300 249 HA GLN 61 HA GLN 28 -12.136 -15.434 -7.772 250 HB2 GLN 61 HB2 GLN 28 -13.908 -17.452 -9.123 251 HB3 GLN 61 HB3 GLN 28 -12.543 -16.883 -10.059 252 HG2 GLN 61 HG2 GLN 28 -12.081 -17.828 -7.215 253 HG3 GLN 61 HG3 GLN 28 -12.348 -19.003 -8.495 254 HE21 GLN 61 HE22 GLN 28 -10.312 -19.836 -9.197 255 HE22 GLN 61 HE21 GLN 28 -8.897 -18.849 -9.416 256 H GLY 62 H GLY 29 -15.043 -15.009 -9.892 257 HA2 GLY 62 HA2 GLY 29 -13.751 -13.549 -11.909 258 HA3 GLY 62 HA3 GLY 29 -15.472 -13.433 -11.501 259 H GLU 63 H GLU 30 -15.612 -12.206 -9.074 260 HA GLU 63 HA GLU 30 -15.043 -9.491 -9.847 261 HB2 GLU 63 HB2 GLU 30 -16.086 -10.709 -7.251 262 HB3 GLU 63 HB3 GLU 30 -16.018 -8.978 -7.574 263 HG2 GLU 63 HG2 GLU 30 -17.615 -10.993 -9.205 264 HG3 GLU 63 HG3 GLU 30 -18.264 -9.911 -7.987 265 H TYR 64 H TYR 31 -13.592 -11.699 -7.469 266 HA TYR 64 HA TYR 31 -11.685 -10.009 -6.230 267 HB2 TYR 64 HB2 TYR 31 -11.963 -12.232 -5.414 268 HB3 TYR 64 HB3 TYR 31 -11.730 -12.925 -7.016 269 HD1 TYR 64 HD2 TYR 31 -9.588 -13.250 -8.050 270 HD2 TYR 64 HD1 TYR 31 -9.962 -11.560 -4.098 271 HE1 TYR 64 HE2 TYR 31 -7.199 -13.565 -7.683 272 HE2 TYR 64 HE1 TYR 31 -7.555 -11.983 -3.689 273 HH TYR 64 HH TYR 31 -5.427 -13.439 -6.232 274 H ARG 65 H ARG 32 -11.476 -11.944 -9.271 275 HA ARG 65 HA ARG 32 -8.867 -11.064 -9.899 276 HB2 ARG 65 HB2 ARG 32 -9.810 -13.094 -10.772 277 HB3 ARG 65 HB3 ARG 32 -11.043 -12.202 -11.694 278 HG2 ARG 65 HG2 ARG 32 -9.439 -11.252 -13.189 279 HG3 ARG 65 HG3 ARG 32 -8.101 -11.580 -12.081 280 HD2 ARG 65 HD2 ARG 32 -8.574 -14.036 -12.386 281 HD3 ARG 65 HD3 ARG 32 -9.641 -13.603 -13.737 282 HE ARG 65 HE ARG 32 -6.712 -13.217 -13.437 283 HH11 ARG 65 HH11 ARG 32 -9.500 -13.152 -15.645 284 HH12 ARG 65 HH12 ARG 32 -8.550 -13.012 -17.080 285 HH21 ARG 65 HH21 ARG 32 -5.430 -13.059 -15.365 286 HH22 ARG 65 HH22 ARG 32 -6.192 -12.976 -16.912 287 H SER 66 H SER 33 -12.091 -9.673 -10.813 288 HA SER 66 HA SER 33 -11.085 -7.770 -12.599 289 HB2 SER 66 HB2 SER 33 -13.374 -7.382 -10.622 290 HB3 SER 66 HB3 SER 33 -13.071 -6.437 -12.077 291 HG SER 66 HG SER 33 -14.610 -8.052 -12.524 292 H LEU 67 H LEU 34 -11.049 -7.721 -8.982 293 HA LEU 67 HA LEU 34 -9.858 -5.041 -9.038 294 HB2 LEU 67 HB2 LEU 34 -11.260 -5.756 -7.147 295 HB3 LEU 67 HB3 LEU 34 -10.062 -6.981 -6.712 296 HG LEU 67 HG LEU 34 -8.383 -5.244 -6.254 297 HD11 LEU 67 HD11 LEU 34 -8.971 -3.451 -7.815 298 HD12 LEU 67 HD12 LEU 34 -10.554 -3.237 -7.027 299 HD13 LEU 67 HD13 LEU 34 -9.053 -2.826 -6.172 300 HD21 LEU 67 HD21 LEU 34 -11.035 -4.600 -4.902 301 HD22 LEU 67 HD22 LEU 34 -9.937 -5.919 -4.457 302 HD23 LEU 67 HD23 LEU 34 -9.412 -4.243 -4.278 303 H THR 68 H THR 35 -8.480 -8.385 -8.322 304 HA THR 68 HA THR 35 -5.902 -7.243 -7.715 305 HB THR 68 HB THR 35 -5.229 -9.721 -7.825 306 HG1 THR 68 HG1 THR 35 -7.132 -11.130 -7.924 307 HG21 THR 68 HG21 THR 35 -6.386 -10.347 -5.807 308 HG22 THR 68 HG22 THR 35 -5.934 -8.656 -5.712 309 HG23 THR 68 HG23 THR 35 -7.633 -9.099 -6.070 310 H GLY 69 H GLY 36 -7.340 -8.661 -10.645 311 HA2 GLY 69 HA2 GLY 36 -6.524 -8.816 -12.794 312 HA3 GLY 69 HA3 GLY 36 -4.997 -8.041 -12.292 313 H ASP 70 H ASP 37 -6.272 -10.764 -10.369 314 HA ASP 70 HA ASP 37 -4.478 -12.721 -11.668 315 HB2 ASP 70 HB2 ASP 37 -3.275 -11.476 -9.752 316 HB3 ASP 70 HB3 ASP 37 -4.431 -12.256 -8.658 317 H TRP 71 H TRP 38 -4.918 -14.920 -10.663 318 HA TRP 71 HA TRP 38 -7.800 -15.298 -10.046 319 HB2 TRP 71 HB2 TRP 38 -5.542 -17.265 -10.620 320 HB3 TRP 71 HB3 TRP 38 -7.206 -17.710 -10.254 321 HD1 TRP 71 HD1 TRP 38 -5.008 -17.133 -13.094 322 HE1 TRP 71 HE1 TRP 38 -6.310 -16.940 -15.298 323 HE3 TRP 71 HE3 TRP 38 -9.678 -16.390 -11.172 324 HZ2 TRP 71 HZ2 TRP 38 -9.071 -16.438 -16.116 325 HZ3 TRP 71 HZ3 TRP 38 -11.579 -15.902 -12.651 326 HH2 TRP 71 HH2 TRP 38 -11.319 -15.963 -15.119 327 H ILE 72 H ILE 39 -8.336 -16.511 -8.118 328 HA ILE 72 HA ILE 39 -7.012 -15.840 -5.730 329 HB ILE 72 HB ILE 39 -8.897 -18.085 -6.484 330 HG12 ILE 72 HG12 ILE 39 -9.668 -15.613 -6.457 331 HG13 ILE 72 HG13 ILE 39 -10.648 -16.822 -5.647 332 HG21 ILE 72 HG21 ILE 39 -7.760 -19.014 -4.648 333 HG22 ILE 72 HG22 ILE 39 -7.792 -17.506 -3.717 334 HG23 ILE 72 HG23 ILE 39 -9.291 -18.424 -4.008 335 HD11 ILE 72 HD11 ILE 39 -10.344 -14.623 -4.446 336 HD12 ILE 72 HD12 ILE 39 -10.033 -16.088 -3.504 337 HD13 ILE 72 HD13 ILE 39 -8.670 -15.103 -4.122 338 HA PRO 73 HA PRO 40 -3.653 -18.702 -6.368 339 HB2 PRO 73 HB2 PRO 40 -1.954 -18.034 -4.369 340 HB3 PRO 73 HB3 PRO 40 -2.406 -16.847 -5.605 341 HG2 PRO 73 HG2 PRO 40 -3.725 -17.210 -2.895 342 HG3 PRO 73 HG3 PRO 40 -3.006 -15.724 -3.597 343 HD2 PRO 73 HD2 PRO 40 -5.681 -16.308 -3.772 344 HD3 PRO 73 HD3 PRO 40 -4.814 -15.488 -5.105 345 H PHE 74 H PHE 41 -6.082 -19.892 -5.105 346 HA PHE 74 HA PHE 41 -5.677 -20.889 -2.508 347 HB2 PHE 74 HB2 PHE 41 -7.482 -22.372 -2.865 348 HB3 PHE 74 HB3 PHE 41 -7.888 -20.881 -3.646 349 HD1 PHE 74 HD2 PHE 41 -7.679 -20.770 -6.273 350 HD2 PHE 74 HD1 PHE 41 -7.459 -24.429 -3.993 351 HE1 PHE 74 HE2 PHE 41 -8.203 -22.068 -8.307 352 HE2 PHE 74 HE1 PHE 41 -8.080 -25.721 -6.028 353 HZ PHE 74 HZ PHE 41 -8.433 -24.540 -8.186 354 H LYS 75 H LYS 42 -5.236 -22.798 -5.527 355 HA LYS 75 HA LYS 42 -3.995 -24.894 -4.059 356 HB2 LYS 75 HB2 LYS 42 -5.343 -24.843 -6.301 357 HB3 LYS 75 HB3 LYS 42 -3.817 -24.482 -7.071 358 HG2 LYS 75 HG2 LYS 42 -4.345 -26.843 -7.237 359 HG3 LYS 75 HG3 LYS 42 -2.899 -26.652 -6.237 360 HD2 LYS 75 HD2 LYS 42 -4.199 -27.031 -4.196 361 HD3 LYS 75 HD3 LYS 42 -5.713 -27.038 -5.096 362 HE2 LYS 75 HE2 LYS 42 -3.434 -29.041 -5.502 363 HE3 LYS 75 HE3 LYS 42 -4.780 -29.304 -4.395 364 HZ1 LYS 75 HZ1 LYS 42 -5.025 -29.015 -7.338 365 HZ2 LYS 75 HZ2 LYS 42 -5.212 -30.386 -6.480 366 HZ3 LYS 75 HZ3 LYS 42 -6.302 -29.184 -6.314 367 H GLN 76 H GLN 43 -2.718 -21.995 -5.396 368 HA GLN 76 HA GLN 43 0.026 -22.927 -5.779 369 HB2 GLN 76 HB2 GLN 43 -1.181 -20.128 -5.689 370 HB3 GLN 76 HB3 GLN 43 0.451 -20.524 -6.197 371 HG2 GLN 76 HG2 GLN 43 -0.234 -20.932 -8.304 372 HG3 GLN 76 HG3 GLN 43 -1.359 -22.163 -7.773 373 HE21 GLN 76 HE22 GLN 43 -3.613 -21.708 -8.053 374 HE22 GLN 76 HE21 GLN 43 -4.246 -20.111 -8.345 375 H LEU 77 H LEU 44 -1.822 -21.092 -3.283 376 HA LEU 77 HA LEU 44 0.409 -20.913 -1.410 377 HB2 LEU 77 HB2 LEU 44 -2.566 -20.462 -1.150 378 HB3 LEU 77 HB3 LEU 44 -1.432 -20.304 0.193 379 HG LEU 77 HG LEU 44 -1.355 -18.649 -2.353 380 HD11 LEU 77 HD11 LEU 44 -2.161 -17.801 0.464 381 HD12 LEU 77 HD12 LEU 44 -2.155 -16.788 -0.994 382 HD13 LEU 77 HD13 LEU 44 -3.297 -18.134 -0.860 383 HD21 LEU 77 HD21 LEU 44 0.315 -18.410 0.183 384 HD22 LEU 77 HD22 LEU 44 0.903 -18.797 -1.458 385 HD23 LEU 77 HD23 LEU 44 0.243 -17.199 -1.119 386 H GLY 78 H GLY 45 -2.181 -23.265 -2.100 387 HA2 GLY 78 HA2 GLY 45 -1.420 -25.560 -1.781 388 HA3 GLY 78 HA3 GLY 45 -0.807 -25.126 -0.186 389 H TYR 79 H TYR 46 -3.866 -23.680 -1.016 390 HA TYR 79 HA TYR 46 -5.310 -25.332 0.938 391 HB2 TYR 79 HB2 TYR 46 -6.269 -23.086 -0.878 392 HB3 TYR 79 HB3 TYR 46 -7.146 -23.784 0.475 393 HD1 TYR 79 HD2 TYR 46 -6.183 -23.551 2.829 394 HD2 TYR 79 HD1 TYR 46 -4.676 -21.327 -0.542 395 HE1 TYR 79 HE2 TYR 46 -5.067 -21.990 4.364 396 HE2 TYR 79 HE1 TYR 46 -3.585 -19.722 0.981 397 HH TYR 79 HH TYR 46 -3.698 -20.063 4.566 398 HA PRO 80 HA PRO 47 -6.271 -27.985 -2.434 399 HB2 PRO 80 HB2 PRO 47 -8.520 -29.385 -1.603 400 HB3 PRO 80 HB3 PRO 47 -6.888 -29.622 -0.906 401 HG2 PRO 80 HG2 PRO 47 -9.109 -27.820 0.134 402 HG3 PRO 80 HG3 PRO 47 -8.162 -29.045 1.046 403 HD2 PRO 80 HD2 PRO 47 -7.409 -26.459 1.154 404 HD3 PRO 80 HD3 PRO 47 -6.174 -27.729 0.958 405 H THR 81 H THR 48 -8.946 -25.848 -1.360 406 HA THR 81 HA THR 48 -9.945 -25.724 -4.156 407 HB THR 81 HB THR 48 -12.262 -25.957 -3.085 408 HG1 THR 81 HG1 THR 48 -12.088 -27.068 -0.945 409 HG21 THR 81 HG21 THR 48 -12.294 -28.337 -2.987 410 HG22 THR 81 HG22 THR 48 -11.059 -27.920 -4.189 411 HG23 THR 81 HG23 THR 48 -10.581 -28.433 -2.555 412 H LEU 82 H LEU 49 -11.583 -23.942 -4.369 413 HA LEU 82 HA LEU 49 -10.645 -21.433 -3.343 414 HB2 LEU 82 HB2 LEU 49 -13.331 -22.322 -4.544 415 HB3 LEU 82 HB3 LEU 49 -13.047 -20.680 -4.027 416 HG LEU 82 HG LEU 49 -12.792 -20.740 -6.381 417 HD11 LEU 82 HD11 LEU 49 -11.232 -19.279 -5.177 418 HD12 LEU 82 HD12 LEU 49 -10.011 -20.579 -5.163 419 HD13 LEU 82 HD13 LEU 49 -10.531 -19.884 -6.693 420 HD21 LEU 82 HD21 LEU 49 -12.276 -23.160 -6.678 421 HD22 LEU 82 HD22 LEU 49 -11.221 -22.098 -7.614 422 HD23 LEU 82 HD23 LEU 49 -10.613 -22.848 -6.131 423 H GLU 83 H GLU 50 -13.309 -23.626 -2.291 424 HA GLU 83 HA GLU 50 -14.184 -21.860 -0.251 425 HB2 GLU 83 HB2 GLU 50 -15.395 -23.654 0.703 426 HB3 GLU 83 HB3 GLU 50 -15.544 -23.744 -1.050 427 HG2 GLU 83 HG2 GLU 50 -13.914 -25.601 -1.106 428 HG3 GLU 83 HG3 GLU 50 -13.696 -25.485 0.646 429 H ALA 84 H ALA 51 -11.659 -24.485 -0.145 430 HA ALA 84 HA ALA 51 -11.182 -24.212 2.633 431 HB1 ALA 84 HB1 ALA 51 -9.074 -25.357 2.185 432 HB2 ALA 84 HB2 ALA 51 -10.417 -26.118 1.309 433 HB3 ALA 84 HB3 ALA 51 -9.273 -25.072 0.435 434 H TYR 85 H TYR 52 -9.649 -22.481 -0.134 435 HA TYR 85 HA TYR 52 -7.863 -20.875 1.385 436 HB2 TYR 85 HB2 TYR 52 -7.668 -20.923 -0.975 437 HB3 TYR 85 HB3 TYR 52 -9.337 -20.453 -1.234 438 HD1 TYR 85 HD1 TYR 52 -6.030 -19.206 -0.023 439 HD2 TYR 85 HD2 TYR 52 -10.005 -18.168 -1.341 440 HE1 TYR 85 HE1 TYR 52 -5.333 -16.842 -0.180 441 HE2 TYR 85 HE2 TYR 52 -9.361 -15.806 -1.437 442 HH TYR 85 HH TYR 52 -7.568 -14.254 -1.336 443 H LEU 86 H LEU 53 -11.324 -20.246 0.459 444 HA LEU 86 HA LEU 53 -11.496 -17.792 1.883 445 HB2 LEU 86 HB2 LEU 53 -13.604 -19.791 0.990 446 HB3 LEU 86 HB3 LEU 53 -13.973 -18.188 1.617 447 HG LEU 86 HG LEU 53 -12.137 -18.474 -0.772 448 HD11 LEU 86 HD11 LEU 53 -14.202 -18.145 -2.194 449 HD12 LEU 86 HD12 LEU 53 -14.027 -19.745 -1.477 450 HD13 LEU 86 HD13 LEU 53 -15.166 -18.610 -0.756 451 HD21 LEU 86 HD21 LEU 53 -12.332 -16.269 0.396 452 HD22 LEU 86 HD22 LEU 53 -12.916 -16.240 -1.263 453 HD23 LEU 86 HD23 LEU 53 -14.085 -16.288 0.075 454 H ARG 87 H ARG 54 -12.153 -21.130 3.010 455 HA ARG 87 HA ARG 54 -13.134 -20.474 5.655 456 HB2 ARG 87 HB2 ARG 54 -11.493 -22.853 4.652 457 HB3 ARG 87 HB3 ARG 54 -11.820 -22.617 6.348 458 HG2 ARG 87 HG2 ARG 54 -13.343 -24.197 5.741 459 HG3 ARG 87 HG3 ARG 54 -14.284 -22.705 5.889 460 HD2 ARG 87 HD2 ARG 54 -14.461 -22.542 3.457 461 HD3 ARG 87 HD3 ARG 54 -13.146 -23.694 3.280 462 HE ARG 87 HE ARG 54 -14.614 -25.222 2.910 463 HH11 ARG 87 HH11 ARG 54 -15.989 -23.562 5.784 464 HH12 ARG 87 HH12 ARG 54 -17.394 -24.564 5.804 465 HH21 ARG 87 HH21 ARG 54 -16.502 -26.359 2.872 466 HH22 ARG 87 HH22 ARG 54 -17.641 -26.273 4.195 467 H SER 88 H SER 55 -9.856 -20.575 4.306 468 HA SER 88 HA SER 55 -8.562 -20.463 6.868 469 HB2 SER 88 HB2 SER 55 -7.438 -20.228 4.064 470 HB3 SER 88 HB3 SER 55 -6.521 -20.508 5.560 471 HG SER 88 HG SER 55 -8.399 -22.203 4.270 472 H VAL 89 H VAL 56 -10.222 -17.957 5.712 473 HA VAL 89 HA VAL 56 -8.279 -15.995 6.812 474 HB VAL 89 HB VAL 56 -8.120 -15.816 4.460 475 HG11 VAL 89 HG11 VAL 56 -9.957 -16.812 3.470 476 HG12 VAL 89 HG12 VAL 56 -11.132 -15.854 4.364 477 HG13 VAL 89 HG13 VAL 56 -10.181 -15.115 3.056 478 HG21 VAL 89 HG21 VAL 56 -8.190 -13.660 5.744 479 HG22 VAL 89 HG22 VAL 56 -8.533 -13.551 4.014 480 HG23 VAL 89 HG23 VAL 56 -9.867 -13.458 5.173 481 HA PRO 90 HA PRO 57 -12.710 -16.129 8.470 482 HB2 PRO 90 HB2 PRO 57 -12.476 -17.129 10.990 483 HB3 PRO 90 HB3 PRO 57 -12.502 -18.168 9.535 484 HG2 PRO 90 HG2 PRO 57 -10.080 -17.201 11.087 485 HG3 PRO 90 HG3 PRO 57 -10.455 -18.862 10.517 486 HD2 PRO 90 HD2 PRO 57 -8.816 -17.135 9.124 487 HD3 PRO 90 HD3 PRO 57 -9.839 -18.378 8.358 488 H ALA 91 H ALA 58 -9.740 -14.724 9.719 489 HA ALA 91 HA ALA 58 -11.079 -12.988 11.644 490 HB1 ALA 91 HB1 ALA 58 -8.221 -12.946 10.560 491 HB2 ALA 91 HB2 ALA 58 -8.832 -12.071 11.986 492 HB3 ALA 91 HB3 ALA 58 -8.775 -13.842 11.998 493 H VAL 92 H VAL 59 -10.855 -12.905 8.250 494 HA VAL 92 HA VAL 59 -11.262 -9.948 8.212 495 HB VAL 92 HB VAL 59 -9.578 -11.472 6.208 496 HG11 VAL 92 HG11 VAL 59 -8.787 -9.255 5.506 497 HG12 VAL 92 HG12 VAL 59 -10.546 -9.368 5.375 498 HG13 VAL 92 HG13 VAL 59 -9.818 -8.484 6.731 499 HG21 VAL 92 HG21 VAL 59 -8.589 -9.825 8.575 500 HG22 VAL 92 HG22 VAL 59 -8.311 -11.558 8.297 501 HG23 VAL 92 HG23 VAL 59 -7.574 -10.372 7.226 502 H VAL 93 H VAL 60 -12.192 -13.117 7.050 503 HA VAL 93 HA VAL 60 -14.248 -11.977 5.244 504 HB VAL 93 HB VAL 60 -12.092 -14.027 4.738 505 HG11 VAL 93 HG11 VAL 60 -14.479 -13.646 2.898 506 HG12 VAL 93 HG12 VAL 60 -12.996 -14.545 2.525 507 HG13 VAL 93 HG13 VAL 60 -14.055 -15.118 3.802 508 HG21 VAL 93 HG21 VAL 60 -11.719 -12.591 2.677 509 HG22 VAL 93 HG22 VAL 60 -12.866 -11.422 3.381 510 HG23 VAL 93 HG23 VAL 60 -11.348 -11.811 4.204 511 H ARG 94 H ARG 61 -15.889 -13.706 4.755 512 HA ARG 94 HA ARG 61 -16.398 -15.598 6.982 513 HB2 ARG 94 HB2 ARG 61 -17.221 -13.412 7.749 514 HB3 ARG 94 HB3 ARG 61 -18.106 -13.168 6.252 515 HG2 ARG 94 HG2 ARG 61 -19.566 -15.166 6.869 516 HG3 ARG 94 HG3 ARG 61 -18.656 -15.272 8.387 517 HD2 ARG 94 HD2 ARG 61 -20.565 -14.046 8.974 518 HD3 ARG 94 HD3 ARG 61 -19.349 -12.806 8.764 519 HE ARG 94 HE ARG 61 -20.384 -12.062 6.790 520 HH11 ARG 94 HH22 ARG 61 -22.069 -14.975 8.020 521 HH12 ARG 94 HH21 ARG 61 -23.454 -14.736 6.992 522 HH21 ARG 94 HH11 ARG 61 -22.408 -11.654 5.670 523 HH22 ARG 94 HH12 ARG 61 -23.665 -12.844 5.745 524 H ILE 95 H ILE 62 -18.153 -17.138 6.297 525 HA ILE 95 HA ILE 62 -19.033 -16.913 3.500 526 HB ILE 95 HB ILE 62 -18.345 -19.234 3.006 527 HG12 ILE 95 HG12 ILE 62 -16.750 -19.109 5.585 528 HG13 ILE 95 HG13 ILE 62 -18.150 -20.141 5.256 529 HG21 ILE 95 HG21 ILE 62 -16.087 -18.758 2.389 530 HG22 ILE 95 HG22 ILE 62 -16.898 -17.194 2.387 531 HG23 ILE 95 HG23 ILE 62 -15.853 -17.633 3.749 532 HD11 ILE 95 HD11 ILE 62 -15.415 -20.306 3.934 533 HD12 ILE 95 HD12 ILE 62 -16.168 -21.456 5.041 534 HD13 ILE 95 HD13 ILE 62 -16.849 -21.246 3.411 535 H GLU 96 H GLU 63 -20.895 -18.122 3.034 536 HA GLU 96 HA GLU 63 -22.139 -19.704 5.247 537 HB2 GLU 96 HB2 GLU 63 -23.481 -17.700 3.379 538 HB3 GLU 96 HB3 GLU 63 -24.340 -18.953 4.285 539 HG2 GLU 96 HG2 GLU 63 -23.468 -18.007 6.418 540 HG3 GLU 96 HG3 GLU 63 -22.665 -16.726 5.503 541 H ALA 97 H ALA 64 -21.623 -21.705 4.458 542 HA ALA 97 HA ALA 64 -22.034 -22.430 1.639 543 HB1 ALA 97 HB1 ALA 64 -21.548 -24.706 2.419 544 HB2 ALA 97 HB2 ALA 64 -20.276 -23.562 2.897 545 HB3 ALA 97 HB3 ALA 64 -21.472 -24.133 4.099 546 H SER 98 H SER 65 -24.007 -22.761 0.847 547 HA SER 98 HA SER 65 -26.359 -22.678 2.551 548 HB2 SER 98 HB2 SER 65 -26.284 -21.469 0.426 549 HB3 SER 98 HB3 SER 65 -25.918 -22.958 -0.460 550 HG SER 98 HG SER 65 -28.215 -22.204 -0.404 551 H ARG 99 H ARG 66 -27.977 -24.285 2.473 552 HA ARG 99 HA ARG 66 -27.128 -27.045 2.616 553 HB2 ARG 99 HB2 ARG 66 -29.535 -27.571 2.850 554 HB3 ARG 99 HB3 ARG 66 -28.908 -26.399 3.990 555 HG2 ARG 99 HG2 ARG 66 -31.093 -25.711 3.409 556 HG3 ARG 99 HG3 ARG 66 -29.976 -24.546 2.726 557 HD2 ARG 99 HD2 ARG 66 -31.844 -25.008 1.213 558 HD3 ARG 99 HD3 ARG 66 -30.319 -25.480 0.486 559 HE ARG 99 HE ARG 66 -31.806 -27.588 1.922 560 HH11 ARG 99 HH21 ARG 66 -31.055 -26.179 -1.286 561 HH12 ARG 99 HH22 ARG 66 -31.696 -27.535 -2.151 562 HH21 ARG 99 HH11 ARG 66 -32.572 -29.391 0.751 563 HH22 ARG 99 HH12 ARG 66 -32.522 -29.417 -0.971 564 H SER 100 H SER 67 -28.069 -25.018 -0.079 565 HA SER 100 HA SER 67 -28.691 -27.224 -1.861 566 HB2 SER 100 HB2 SER 67 -27.948 -24.340 -2.480 567 HB3 SER 100 HB3 SER 67 -28.793 -25.484 -3.544 568 HG SER 100 HG SER 67 -30.199 -24.000 -2.395 569 H GLY 101 H GLY 68 -25.706 -26.205 -0.529 570 HA2 GLY 101 HA2 GLY 68 -23.721 -27.306 -0.906 571 HA3 GLY 101 HA3 GLY 68 -24.236 -27.783 -2.528 572 H GLU 102 H GLU 69 -24.982 -24.548 -2.441 573 HA GLU 102 HA GLU 69 -22.481 -23.669 -3.719 574 HB2 GLU 102 HB2 GLU 69 -25.183 -22.423 -3.084 575 HB3 GLU 102 HB3 GLU 69 -23.834 -21.397 -3.541 576 HG2 GLU 102 HG2 GLU 69 -24.713 -23.736 -5.270 577 HG3 GLU 102 HG3 GLU 69 -25.447 -22.144 -5.380 578 H ILE 103 H ILE 70 -21.458 -21.633 -2.809 579 HA ILE 103 HA ILE 70 -21.905 -21.182 0.042 580 HB ILE 103 HB ILE 70 -20.093 -22.628 0.298 581 HG12 ILE 103 HG12 ILE 70 -19.894 -20.275 1.366 582 HG13 ILE 103 HG13 ILE 70 -18.562 -21.405 1.467 583 HG21 ILE 103 HG21 ILE 70 -19.263 -23.044 -1.852 584 HG22 ILE 103 HG22 ILE 70 -18.701 -21.367 -2.031 585 HG23 ILE 103 HG23 ILE 70 -17.914 -22.460 -0.862 586 HD11 ILE 103 HD11 ILE 70 -18.013 -18.943 0.871 587 HD12 ILE 103 HD12 ILE 70 -17.228 -20.220 -0.074 588 HD13 ILE 103 HD13 ILE 70 -18.594 -19.307 -0.739 589 H VAL 104 H VAL 71 -21.892 -19.112 0.528 590 HA VAL 104 HA VAL 71 -21.273 -17.160 -1.632 591 HB VAL 104 HB VAL 71 -23.164 -16.848 0.741 592 HG11 VAL 104 HG11 VAL 71 -24.057 -14.961 -0.591 593 HG12 VAL 104 HG12 VAL 71 -22.336 -14.742 -0.255 594 HG13 VAL 104 HG13 VAL 71 -22.867 -15.278 -1.868 595 HG21 VAL 104 HG21 VAL 71 -24.113 -18.647 -0.679 596 HG22 VAL 104 HG22 VAL 71 -25.055 -17.162 -0.822 597 HG23 VAL 104 HG23 VAL 71 -23.930 -17.613 -2.111 598 H CYS 105 H CYS 72 -19.587 -15.821 -1.193 599 HA CYS 105 HA CYS 72 -18.304 -15.918 1.457 600 HB2 CYS 105 HB2 CYS 72 -17.411 -14.389 -1.010 601 HB3 CYS 105 HB3 CYS 72 -16.400 -15.027 0.308 602 HG CYS 105 HG CYS 72 -16.920 -17.569 -0.268 603 H TYR 106 H TYR 73 -17.803 -14.052 2.650 604 HA TYR 106 HA TYR 73 -19.049 -11.452 1.954 605 HB2 TYR 106 HB2 TYR 73 -19.424 -13.074 4.504 606 HB3 TYR 106 HB3 TYR 73 -19.865 -11.377 4.360 607 HD1 TYR 106 HD1 TYR 73 -21.542 -10.706 2.511 608 HD2 TYR 106 HD2 TYR 73 -20.949 -14.762 3.930 609 HE1 TYR 106 HE1 TYR 73 -23.817 -11.256 1.812 610 HE2 TYR 106 HE2 TYR 73 -23.172 -15.392 3.014 611 HH TYR 106 HH TYR 73 -25.399 -13.000 1.481 612 H ALA 107 H ALA 74 -18.267 -9.788 3.642 613 HA ALA 107 HA ALA 74 -15.374 -10.243 4.186 614 HB1 ALA 107 HB1 ALA 74 -15.276 -7.847 4.527 615 HB2 ALA 107 HB2 ALA 74 -16.115 -8.138 3.001 616 HB3 ALA 107 HB3 ALA 74 -17.054 -7.710 4.440 617 H VAL 108 H VAL 75 -14.592 -9.355 6.274 618 HA VAL 108 HA VAL 75 -16.579 -9.057 8.436 619 HB VAL 108 HB VAL 75 -15.033 -11.445 8.083 620 HG11 VAL 108 HG11 VAL 75 -14.005 -11.820 10.206 621 HG12 VAL 108 HG12 VAL 75 -13.243 -10.412 9.458 622 HG13 VAL 108 HG13 VAL 75 -14.413 -10.189 10.773 623 HG21 VAL 108 HG21 VAL 75 -16.401 -12.266 9.906 624 HG22 VAL 108 HG22 VAL 75 -16.853 -10.606 10.361 625 HG23 VAL 108 HG23 VAL 75 -17.394 -11.281 8.817 626 H ALA 109 H ALA 76 -13.355 -8.289 7.157 627 HA ALA 109 HA ALA 76 -13.301 -5.971 8.932 628 HB1 ALA 109 HB1 ALA 76 -11.033 -6.339 9.720 629 HB2 ALA 109 HB2 ALA 76 -11.995 -7.748 10.188 630 HB3 ALA 109 HB3 ALA 76 -10.886 -7.840 8.800 Start of MODEL 9 1 H1 GLY -2 H1 GLY -2 5.468 1.295 -0.319 2 H2 GLY -2 H2 GLY -2 7.081 1.456 -0.586 3 H3 GLY -2 H3 GLY -2 6.047 1.343 -1.854 4 HA2 GLY -2 HA2 GLY -2 7.217 -0.738 -1.548 5 HA3 GLY -2 HA3 GLY -2 6.613 -0.778 0.117 6 H HIS -1 H HIS -1 6.094 -2.065 -2.896 7 HA HIS -1 HA HIS -1 3.202 -2.073 -3.074 8 HB2 HIS -1 HB2 HIS -1 4.788 -2.473 -4.969 9 HB3 HIS -1 HB3 HIS -1 5.213 -4.025 -4.240 10 HD2 HIS -1 HD2 HIS -1 3.948 -5.919 -5.421 11 HE1 HIS -1 HE1 HIS -1 0.241 -3.988 -6.281 12 HE2 HIS -1 HE2 HIS -1 1.550 -6.158 -6.518 13 H MET 34 H MET 1 1.823 -3.944 -2.697 14 HA MET 34 HA MET 1 2.197 -5.183 -0.132 15 HB2 MET 34 HB2 MET 1 0.269 -5.710 -2.428 16 HB3 MET 34 HB3 MET 1 0.191 -6.542 -0.866 17 HG2 MET 34 HG2 MET 1 -0.997 -4.884 0.003 18 HG3 MET 34 HG3 MET 1 0.320 -3.765 -0.277 19 HE1 MET 34 HE1 MET 1 -3.609 -4.130 -2.683 20 HE2 MET 34 HE2 MET 1 -2.493 -5.491 -2.806 21 HE3 MET 34 HE3 MET 1 -3.165 -5.020 -1.221 22 H LEU 35 H LEU 2 2.625 -7.341 0.386 23 HA LEU 35 HA LEU 2 4.321 -8.913 -1.447 24 HB2 LEU 35 HB2 LEU 2 3.119 -9.590 1.287 25 HB3 LEU 35 HB3 LEU 2 4.292 -10.572 0.418 26 HG LEU 35 HG LEU 2 4.793 -7.778 1.527 27 HD11 LEU 35 HD11 LEU 2 6.272 -8.935 3.119 28 HD12 LEU 35 HD12 LEU 2 4.609 -9.517 3.257 29 HD13 LEU 35 HD13 LEU 2 5.818 -10.507 2.413 30 HD21 LEU 35 HD21 LEU 2 6.157 -8.077 -0.468 31 HD22 LEU 35 HD22 LEU 2 7.187 -8.224 0.958 32 HD23 LEU 35 HD23 LEU 2 6.681 -9.687 0.077 33 H GLU 36 H GLU 3 3.608 -11.301 -1.887 34 HA GLU 36 HA GLU 3 1.264 -11.145 -3.404 35 HB2 GLU 36 HB2 GLU 3 3.062 -12.735 -3.860 36 HB3 GLU 36 HB3 GLU 3 2.655 -13.651 -2.403 37 HG2 GLU 36 HG2 GLU 3 0.460 -14.237 -3.330 38 HG3 GLU 36 HG3 GLU 3 0.734 -13.200 -4.727 39 H ALA 37 H ALA 4 1.623 -12.957 -0.342 40 HA ALA 37 HA ALA 4 -1.126 -13.672 -0.333 41 HB1 ALA 37 HB1 ALA 4 0.707 -13.600 2.080 42 HB2 ALA 37 HB2 ALA 4 -0.839 -14.475 1.913 43 HB3 ALA 37 HB3 ALA 4 0.547 -14.950 0.923 44 H ASP 38 H ASP 5 0.555 -10.821 0.890 45 HA ASP 38 HA ASP 5 -1.593 -9.813 2.540 46 HB2 ASP 38 HB2 ASP 5 0.782 -9.148 2.780 47 HB3 ASP 38 HB3 ASP 5 0.730 -8.376 1.194 48 H LEU 39 H LEU 6 -0.551 -9.294 -0.853 49 HA LEU 39 HA LEU 6 -2.398 -7.264 -1.529 50 HB2 LEU 39 HB2 LEU 6 -0.444 -7.815 -2.901 51 HB3 LEU 39 HB3 LEU 6 -1.046 -9.418 -3.239 52 HG LEU 39 HG LEU 6 -2.871 -7.169 -4.033 53 HD11 LEU 39 HD11 LEU 6 -0.289 -7.757 -5.532 54 HD12 LEU 39 HD12 LEU 6 -1.610 -6.713 -6.107 55 HD13 LEU 39 HD13 LEU 6 -0.687 -6.249 -4.675 56 HD21 LEU 39 HD21 LEU 6 -3.130 -8.561 -6.089 57 HD22 LEU 39 HD22 LEU 6 -1.992 -9.739 -5.419 58 HD23 LEU 39 HD23 LEU 6 -3.554 -9.436 -4.626 59 H VAL 40 H VAL 7 -2.545 -10.819 -2.040 60 HA VAL 40 HA VAL 7 -5.121 -10.693 -3.235 61 HB VAL 40 HB VAL 7 -5.133 -13.126 -3.055 62 HG11 VAL 40 HG11 VAL 7 -2.309 -12.180 -3.717 63 HG12 VAL 40 HG12 VAL 7 -3.173 -13.568 -4.379 64 HG13 VAL 40 HG13 VAL 7 -3.707 -11.935 -4.763 65 HG21 VAL 40 HG21 VAL 7 -3.262 -14.344 -1.944 66 HG22 VAL 40 HG22 VAL 7 -2.747 -12.809 -1.247 67 HG23 VAL 40 HG23 VAL 7 -4.308 -13.498 -0.799 68 H SER 41 H SER 8 -4.149 -11.179 0.212 69 HA SER 41 HA SER 8 -6.809 -11.630 1.144 70 HB2 SER 41 HB2 SER 8 -4.431 -10.424 2.619 71 HB3 SER 41 HB3 SER 8 -5.899 -11.087 3.356 72 HG SER 41 HG SER 8 -3.790 -12.407 2.041 73 H LYS 42 H LYS 9 -4.923 -8.508 0.896 74 HA LYS 42 HA LYS 9 -7.043 -6.909 2.011 75 HB2 LYS 42 HB2 LYS 9 -4.647 -6.309 0.235 76 HB3 LYS 42 HB3 LYS 9 -5.808 -5.045 0.695 77 HG2 LYS 42 HG2 LYS 9 -5.424 -5.392 3.045 78 HG3 LYS 42 HG3 LYS 9 -4.388 -6.801 2.730 79 HD2 LYS 42 HD2 LYS 9 -2.738 -5.407 1.585 80 HD3 LYS 42 HD3 LYS 9 -3.751 -3.960 1.807 81 HE2 LYS 42 HE2 LYS 9 -3.480 -4.009 4.195 82 HE3 LYS 42 HE3 LYS 9 -2.835 -5.654 4.156 83 HZ1 LYS 42 HZ1 LYS 9 -1.420 -3.299 3.050 84 HZ2 LYS 42 HZ2 LYS 9 -1.072 -4.050 4.465 85 HZ3 LYS 42 HZ3 LYS 9 -0.873 -4.870 3.054 86 H MET 43 H MET 10 -6.258 -7.734 -1.436 87 HA MET 43 HA MET 10 -8.429 -6.076 -2.389 88 HB2 MET 43 HB2 MET 10 -6.774 -8.240 -3.729 89 HB3 MET 43 HB3 MET 10 -8.005 -7.267 -4.558 90 HG2 MET 43 HG2 MET 10 -6.782 -5.193 -3.700 91 HG3 MET 43 HG3 MET 10 -5.459 -6.262 -3.217 92 HE1 MET 43 HE1 MET 10 -3.606 -4.909 -4.812 93 HE2 MET 43 HE2 MET 10 -4.110 -4.281 -6.387 94 HE3 MET 43 HE3 MET 10 -4.970 -3.763 -4.917 95 H LEU 44 H LEU 11 -8.214 -9.595 -1.643 96 HA LEU 44 HA LEU 11 -10.831 -10.383 -2.311 97 HB2 LEU 44 HB2 LEU 11 -9.162 -11.979 -1.523 98 HB3 LEU 44 HB3 LEU 11 -8.967 -11.122 -0.007 99 HG LEU 44 HG LEU 11 -11.317 -11.718 0.623 100 HD11 LEU 44 HD11 LEU 11 -12.208 -12.165 -1.628 101 HD12 LEU 44 HD12 LEU 11 -11.051 -13.504 -1.846 102 HD13 LEU 44 HD13 LEU 11 -12.340 -13.627 -0.627 103 HD21 LEU 44 HD21 LEU 11 -10.749 -14.103 1.130 104 HD22 LEU 44 HD22 LEU 11 -9.305 -13.910 0.108 105 HD23 LEU 44 HD23 LEU 11 -9.483 -12.936 1.572 106 H ARG 45 H ARG 12 -9.664 -9.109 0.828 107 HA ARG 45 HA ARG 12 -12.133 -8.766 2.123 108 HB2 ARG 45 HB2 ARG 12 -10.190 -8.671 3.347 109 HB3 ARG 45 HB3 ARG 12 -9.381 -7.545 2.298 110 HG2 ARG 45 HG2 ARG 12 -11.750 -6.533 3.877 111 HG3 ARG 45 HG3 ARG 12 -10.208 -6.838 4.671 112 HD2 ARG 45 HD2 ARG 12 -9.112 -5.397 2.814 113 HD3 ARG 45 HD3 ARG 12 -10.756 -4.831 2.476 114 HE ARG 45 HE ARG 12 -9.488 -4.732 5.191 115 HH11 ARG 45 HH11 ARG 12 -10.901 -2.841 2.513 116 HH12 ARG 45 HH12 ARG 12 -11.184 -1.448 3.484 117 HH21 ARG 45 HH21 ARG 12 -9.844 -2.859 6.454 118 HH22 ARG 45 HH22 ARG 12 -10.521 -1.437 5.742 119 H ALA 46 H ALA 13 -10.442 -6.392 -0.035 120 HA ALA 46 HA ALA 13 -12.404 -4.433 0.399 121 HB1 ALA 46 HB1 ALA 13 -11.417 -3.305 -1.587 122 HB2 ALA 46 HB2 ALA 13 -10.135 -3.982 -0.563 123 HB3 ALA 46 HB3 ALA 13 -10.613 -4.813 -2.060 124 H VAL 47 H VAL 14 -12.249 -6.896 -2.247 125 HA VAL 47 HA VAL 14 -14.550 -5.907 -3.626 126 HB VAL 47 HB VAL 14 -13.371 -8.720 -3.459 127 HG11 VAL 47 HG11 VAL 14 -15.750 -8.843 -4.178 128 HG12 VAL 47 HG12 VAL 14 -15.419 -7.646 -5.450 129 HG13 VAL 47 HG13 VAL 14 -14.627 -9.244 -5.474 130 HG21 VAL 47 HG21 VAL 14 -12.568 -8.077 -5.785 131 HG22 VAL 47 HG22 VAL 14 -13.160 -6.439 -5.495 132 HG23 VAL 47 HG23 VAL 14 -11.851 -7.113 -4.500 133 H LEU 48 H LEU 15 -14.212 -8.274 -0.934 134 HA LEU 48 HA LEU 15 -16.982 -8.961 -0.842 135 HB2 LEU 48 HB2 LEU 15 -14.865 -8.934 1.368 136 HB3 LEU 48 HB3 LEU 15 -16.418 -9.729 1.489 137 HG LEU 48 HG LEU 15 -14.526 -10.510 -0.762 138 HD11 LEU 48 HD11 LEU 15 -13.282 -10.638 1.328 139 HD12 LEU 48 HD12 LEU 15 -14.633 -11.483 2.122 140 HD13 LEU 48 HD13 LEU 15 -13.730 -12.287 0.809 141 HD21 LEU 48 HD21 LEU 15 -15.748 -12.604 -0.638 142 HD22 LEU 48 HD22 LEU 15 -16.650 -12.054 0.780 143 HD23 LEU 48 HD23 LEU 15 -16.937 -11.284 -0.793 144 H GLN 49 H GLN 16 -15.112 -6.386 0.844 145 HA GLN 49 HA GLN 16 -17.211 -5.573 2.603 146 HB2 GLN 49 HB2 GLN 16 -14.769 -4.137 1.475 147 HB3 GLN 49 HB3 GLN 16 -15.859 -3.369 2.618 148 HG2 GLN 49 HG2 GLN 16 -14.488 -6.025 3.225 149 HG3 GLN 49 HG3 GLN 16 -13.748 -4.468 3.563 150 HE21 GLN 49 HE22 GLN 16 -13.934 -6.042 5.680 151 HE22 GLN 49 HE21 GLN 16 -15.195 -5.507 6.773 152 H SER 50 H SER 17 -16.383 -4.484 -0.767 153 HA SER 50 HA SER 17 -18.509 -2.569 -0.890 154 HB2 SER 50 HB2 SER 17 -17.121 -4.150 -3.101 155 HB3 SER 50 HB3 SER 17 -18.105 -2.696 -3.324 156 HG SER 50 HG SER 17 -15.872 -2.172 -3.233 157 H HIS 51 H HIS 18 -18.263 -6.028 -1.830 158 HA HIS 51 HA HIS 18 -20.943 -6.035 -2.947 159 HB2 HIS 51 HB2 HIS 18 -18.818 -8.175 -2.704 160 HB3 HIS 51 HB3 HIS 18 -20.361 -8.372 -3.523 161 HD2 HIS 51 HD2 HIS 18 -18.598 -8.919 -5.613 162 HE1 HIS 51 HE1 HIS 18 -17.990 -4.858 -6.649 163 HE2 HIS 51 HE2 HIS 18 -17.769 -7.236 -7.474 164 H LYS 52 H LYS 19 -21.742 -5.388 -0.621 165 HA LYS 52 HA LYS 19 -21.776 -7.178 1.534 166 HB2 LYS 52 HB2 LYS 19 -23.863 -5.165 0.571 167 HB3 LYS 52 HB3 LYS 19 -23.997 -6.005 2.108 168 HG2 LYS 52 HG2 LYS 19 -21.793 -4.063 1.329 169 HG3 LYS 52 HG3 LYS 19 -23.099 -3.806 2.500 170 HD2 LYS 52 HD2 LYS 19 -22.134 -5.901 3.739 171 HD3 LYS 52 HD3 LYS 19 -20.703 -5.682 2.745 172 HE2 LYS 52 HE2 LYS 19 -21.885 -3.691 4.738 173 HE3 LYS 52 HE3 LYS 19 -20.383 -4.607 4.904 174 HZ1 LYS 52 HZ1 LYS 19 -20.891 -2.390 3.000 175 HZ2 LYS 52 HZ2 LYS 19 -19.827 -2.413 4.235 176 HZ3 LYS 52 HZ3 LYS 19 -19.558 -3.343 2.905 177 H ASN 53 H ASN 20 -23.821 -7.336 -1.329 178 HA ASN 53 HA ASN 20 -25.774 -9.188 -0.428 179 HB2 ASN 53 HB2 ASN 20 -25.910 -8.050 -2.591 180 HB3 ASN 53 HB3 ASN 20 -24.390 -8.778 -3.129 181 HD21 ASN 53 HD22 ASN 20 -24.354 -11.024 -3.745 182 HD22 ASN 53 HD21 ASN 20 -25.848 -11.844 -4.151 183 H GLY 54 H GLY 21 -22.339 -9.676 -0.880 184 HA2 GLY 54 HA2 GLY 21 -21.074 -11.506 -0.471 185 HA3 GLY 54 HA3 GLY 21 -22.509 -12.542 -0.325 186 H ILE 55 H ILE 22 -20.384 -13.408 -1.767 187 HA ILE 55 HA ILE 22 -21.360 -13.425 -4.574 188 HB ILE 55 HB ILE 22 -18.796 -13.319 -5.151 189 HG12 ILE 55 HG12 ILE 22 -18.761 -11.770 -2.497 190 HG13 ILE 55 HG13 ILE 22 -17.777 -13.153 -2.956 191 HG21 ILE 55 HG21 ILE 22 -19.014 -11.096 -5.765 192 HG22 ILE 55 HG22 ILE 22 -20.673 -11.698 -5.778 193 HG23 ILE 55 HG23 ILE 22 -20.131 -10.696 -4.421 194 HD11 ILE 55 HD11 ILE 22 -16.422 -11.153 -3.094 195 HD12 ILE 55 HD12 ILE 22 -16.763 -11.626 -4.777 196 HD13 ILE 55 HD13 ILE 22 -17.650 -10.295 -4.006 197 H VAL 56 H VAL 23 -21.659 -15.377 -5.222 198 HA VAL 56 HA VAL 23 -21.067 -17.691 -3.739 199 HB VAL 56 HB VAL 23 -21.608 -18.861 -5.911 200 HG11 VAL 56 HG11 VAL 23 -23.966 -18.122 -5.970 201 HG12 VAL 56 HG12 VAL 23 -23.357 -18.385 -4.333 202 HG13 VAL 56 HG13 VAL 23 -23.549 -16.728 -4.958 203 HG21 VAL 56 HG21 VAL 23 -20.753 -17.154 -7.505 204 HG22 VAL 56 HG22 VAL 23 -22.435 -17.585 -7.821 205 HG23 VAL 56 HG23 VAL 23 -22.052 -16.045 -7.025 206 H LEU 57 H LEU 24 -19.297 -19.329 -3.969 207 HA LEU 57 HA LEU 24 -16.887 -18.157 -4.246 208 HB2 LEU 57 HB2 LEU 24 -15.715 -19.992 -3.879 209 HB3 LEU 57 HB3 LEU 24 -17.247 -20.325 -3.168 210 HG LEU 57 HG LEU 24 -17.766 -21.829 -5.187 211 HD11 LEU 57 HD11 LEU 24 -14.940 -21.020 -5.923 212 HD12 LEU 57 HD12 LEU 24 -15.482 -22.676 -6.275 213 HD13 LEU 57 HD13 LEU 24 -16.320 -21.332 -6.987 214 HD21 LEU 57 HD21 LEU 24 -16.187 -23.634 -4.394 215 HD22 LEU 57 HD22 LEU 24 -15.329 -22.398 -3.429 216 HD23 LEU 57 HD23 LEU 24 -17.015 -22.800 -3.098 217 HA PRO 58 HA PRO 25 -16.023 -19.098 -8.805 218 HB2 PRO 58 HB2 PRO 25 -18.070 -19.124 -10.638 219 HB3 PRO 58 HB3 PRO 25 -17.417 -20.586 -9.840 220 HG2 PRO 58 HG2 PRO 25 -19.887 -18.999 -9.088 221 HG3 PRO 58 HG3 PRO 25 -19.711 -20.774 -9.252 222 HD2 PRO 58 HD2 PRO 25 -19.579 -19.566 -6.834 223 HD3 PRO 58 HD3 PRO 25 -18.537 -20.953 -7.218 224 H ARG 59 H ARG 26 -18.900 -17.086 -8.022 225 HA ARG 59 HA ARG 26 -18.089 -14.866 -9.718 226 HB2 ARG 59 HB2 ARG 26 -20.450 -15.211 -8.976 227 HB3 ARG 59 HB3 ARG 26 -19.966 -14.874 -7.290 228 HG2 ARG 59 HG2 ARG 26 -19.306 -12.637 -7.862 229 HG3 ARG 59 HG3 ARG 26 -19.496 -12.961 -9.596 230 HD2 ARG 59 HD2 ARG 26 -21.945 -13.167 -9.258 231 HD3 ARG 59 HD3 ARG 26 -21.727 -12.749 -7.537 232 HE ARG 59 HE ARG 26 -20.407 -10.791 -9.143 233 HH11 ARG 59 HH11 ARG 26 -23.784 -11.716 -8.432 234 HH12 ARG 59 HH12 ARG 26 -24.375 -10.111 -8.691 235 HH21 ARG 59 HH21 ARG 26 -21.127 -8.827 -9.486 236 HH22 ARG 59 HH22 ARG 26 -22.815 -8.377 -9.342 237 H LEU 60 H LEU 27 -17.387 -15.910 -6.388 238 HA LEU 60 HA LEU 27 -16.130 -13.579 -5.491 239 HB2 LEU 60 HB2 LEU 27 -16.563 -15.531 -4.022 240 HB3 LEU 60 HB3 LEU 27 -15.362 -16.500 -4.845 241 HG LEU 60 HG LEU 27 -14.656 -15.620 -2.651 242 HD11 LEU 60 HD11 LEU 27 -12.397 -15.219 -3.200 243 HD12 LEU 60 HD12 LEU 27 -13.011 -16.385 -4.374 244 HD13 LEU 60 HD13 LEU 27 -12.762 -14.675 -4.824 245 HD21 LEU 60 HD21 LEU 27 -14.376 -12.919 -4.040 246 HD22 LEU 60 HD22 LEU 27 -15.634 -13.360 -2.855 247 HD23 LEU 60 HD23 LEU 27 -13.949 -13.351 -2.372 248 H GLN 61 H GLN 28 -14.683 -16.433 -7.232 249 HA GLN 61 HA GLN 28 -12.122 -15.312 -7.639 250 HB2 GLN 61 HB2 GLN 28 -13.746 -17.330 -9.240 251 HB3 GLN 61 HB3 GLN 28 -12.225 -16.704 -9.864 252 HG2 GLN 61 HG2 GLN 28 -11.079 -17.434 -7.762 253 HG3 GLN 61 HG3 GLN 28 -12.570 -18.240 -7.274 254 HE21 GLN 61 HE22 GLN 28 -9.616 -18.543 -9.219 255 HE22 GLN 61 HE21 GLN 28 -10.052 -20.041 -9.963 256 H GLY 62 H GLY 29 -15.047 -14.977 -9.759 257 HA2 GLY 62 HA2 GLY 29 -13.801 -13.545 -11.817 258 HA3 GLY 62 HA3 GLY 29 -15.516 -13.421 -11.378 259 H GLU 63 H GLU 30 -15.623 -12.168 -9.009 260 HA GLU 63 HA GLU 30 -15.159 -9.438 -9.760 261 HB2 GLU 63 HB2 GLU 30 -15.935 -10.721 -7.104 262 HB3 GLU 63 HB3 GLU 30 -16.047 -8.997 -7.436 263 HG2 GLU 63 HG2 GLU 30 -17.532 -11.055 -9.138 264 HG3 GLU 63 HG3 GLU 30 -18.159 -10.467 -7.621 265 H TYR 64 H TYR 31 -13.587 -11.626 -7.408 266 HA TYR 64 HA TYR 31 -11.626 -9.918 -6.282 267 HB2 TYR 64 HB2 TYR 31 -11.979 -12.102 -5.393 268 HB3 TYR 64 HB3 TYR 31 -11.727 -12.857 -6.965 269 HD1 TYR 64 HD2 TYR 31 -9.611 -13.254 -7.962 270 HD2 TYR 64 HD1 TYR 31 -9.963 -11.445 -4.051 271 HE1 TYR 64 HE2 TYR 31 -7.238 -13.687 -7.533 272 HE2 TYR 64 HE1 TYR 31 -7.565 -11.939 -3.623 273 HH TYR 64 HH TYR 31 -5.475 -13.479 -6.146 274 H ARG 65 H ARG 32 -11.491 -11.947 -9.278 275 HA ARG 65 HA ARG 32 -8.853 -11.120 -9.878 276 HB2 ARG 65 HB2 ARG 32 -9.984 -13.221 -10.612 277 HB3 ARG 65 HB3 ARG 32 -10.878 -12.294 -11.819 278 HG2 ARG 65 HG2 ARG 32 -7.961 -11.762 -11.848 279 HG3 ARG 65 HG3 ARG 32 -8.337 -13.466 -12.047 280 HD2 ARG 65 HD2 ARG 32 -9.774 -12.925 -13.966 281 HD3 ARG 65 HD3 ARG 32 -9.350 -11.196 -13.776 282 HE ARG 65 HE ARG 32 -6.995 -12.760 -13.800 283 HH11 ARG 65 HH21 ARG 32 -9.529 -11.765 -16.079 284 HH12 ARG 65 HH22 ARG 32 -8.513 -11.830 -17.481 285 HH21 ARG 65 HH11 ARG 32 -5.616 -12.828 -15.673 286 HH22 ARG 65 HH12 ARG 32 -6.240 -12.465 -17.239 287 H SER 66 H SER 33 -12.033 -9.736 -10.856 288 HA SER 66 HA SER 33 -11.003 -7.892 -12.745 289 HB2 SER 66 HB2 SER 33 -13.294 -7.511 -10.774 290 HB3 SER 66 HB3 SER 33 -12.955 -6.511 -12.194 291 HG SER 66 HG SER 33 -14.513 -8.085 -12.720 292 H LEU 67 H LEU 34 -11.032 -7.763 -9.114 293 HA LEU 67 HA LEU 34 -9.829 -5.112 -9.189 294 HB2 LEU 67 HB2 LEU 34 -11.221 -5.824 -7.299 295 HB3 LEU 67 HB3 LEU 34 -10.014 -7.044 -6.863 296 HG LEU 67 HG LEU 34 -8.355 -5.286 -6.407 297 HD11 LEU 67 HD11 LEU 34 -9.038 -2.871 -6.343 298 HD12 LEU 67 HD12 LEU 34 -8.966 -3.507 -7.985 299 HD13 LEU 67 HD13 LEU 34 -10.547 -3.302 -7.186 300 HD21 LEU 67 HD21 LEU 34 -9.919 -5.969 -4.609 301 HD22 LEU 67 HD22 LEU 34 -9.389 -4.291 -4.423 302 HD23 LEU 67 HD23 LEU 34 -11.017 -4.652 -5.051 303 H THR 68 H THR 35 -8.423 -8.419 -8.431 304 HA THR 68 HA THR 35 -5.822 -7.286 -7.908 305 HB THR 68 HB THR 35 -5.180 -9.769 -7.994 306 HG1 THR 68 HG1 THR 35 -7.007 -11.193 -8.130 307 HG21 THR 68 HG21 THR 35 -5.794 -8.700 -5.866 308 HG22 THR 68 HG22 THR 35 -7.524 -9.074 -6.188 309 HG23 THR 68 HG23 THR 35 -6.322 -10.366 -5.949 310 H GLY 69 H GLY 36 -7.300 -8.807 -10.785 311 HA2 GLY 69 HA2 GLY 36 -6.482 -9.004 -12.937 312 HA3 GLY 69 HA3 GLY 36 -4.968 -8.204 -12.463 313 H ASP 70 H ASP 37 -6.145 -10.825 -10.400 314 HA ASP 70 HA ASP 37 -4.450 -12.882 -11.665 315 HB2 ASP 70 HB2 ASP 37 -3.093 -11.620 -9.873 316 HB3 ASP 70 HB3 ASP 37 -4.267 -12.201 -8.686 317 H TRP 71 H TRP 38 -5.134 -15.081 -10.863 318 HA TRP 71 HA TRP 38 -7.943 -15.094 -9.955 319 HB2 TRP 71 HB2 TRP 38 -6.067 -17.327 -10.845 320 HB3 TRP 71 HB3 TRP 38 -7.770 -17.523 -10.440 321 HD1 TRP 71 HD1 TRP 38 -5.578 -16.946 -13.321 322 HE1 TRP 71 HE1 TRP 38 -6.900 -16.376 -15.424 323 HE3 TRP 71 HE3 TRP 38 -10.086 -15.838 -11.152 324 HZ2 TRP 71 HZ2 TRP 38 -9.595 -15.541 -16.100 325 HZ3 TRP 71 HZ3 TRP 38 -11.962 -15.033 -12.542 326 HH2 TRP 71 HH2 TRP 38 -11.762 -14.952 -15.023 327 H ILE 72 H ILE 39 -8.488 -16.548 -8.114 328 HA ILE 72 HA ILE 39 -7.110 -15.899 -5.772 329 HB ILE 72 HB ILE 39 -9.036 -18.130 -6.440 330 HG12 ILE 72 HG12 ILE 39 -9.772 -15.668 -6.364 331 HG13 ILE 72 HG13 ILE 39 -10.721 -16.847 -5.481 332 HG21 ILE 72 HG21 ILE 39 -7.838 -19.100 -4.637 333 HG22 ILE 72 HG22 ILE 39 -7.818 -17.593 -3.701 334 HG23 ILE 72 HG23 ILE 39 -9.334 -18.484 -3.945 335 HD11 ILE 72 HD11 ILE 39 -9.971 -16.102 -3.379 336 HD12 ILE 72 HD12 ILE 39 -8.615 -15.163 -4.086 337 HD13 ILE 72 HD13 ILE 39 -10.298 -14.637 -4.316 338 HA PRO 73 HA PRO 40 -3.734 -18.786 -6.328 339 HB2 PRO 73 HB2 PRO 40 -2.024 -18.005 -4.422 340 HB3 PRO 73 HB3 PRO 40 -2.530 -16.864 -5.685 341 HG2 PRO 73 HG2 PRO 40 -3.777 -17.175 -2.930 342 HG3 PRO 73 HG3 PRO 40 -3.109 -15.693 -3.675 343 HD2 PRO 73 HD2 PRO 40 -5.768 -16.339 -3.799 344 HD3 PRO 73 HD3 PRO 40 -4.937 -15.517 -5.155 345 H PHE 74 H PHE 41 -6.019 -20.086 -5.211 346 HA PHE 74 HA PHE 41 -5.722 -20.852 -2.460 347 HB2 PHE 74 HB2 PHE 41 -7.454 -22.454 -2.807 348 HB3 PHE 74 HB3 PHE 41 -7.911 -20.953 -3.541 349 HD1 PHE 74 HD2 PHE 41 -7.622 -20.786 -6.191 350 HD2 PHE 74 HD1 PHE 41 -7.499 -24.476 -3.965 351 HE1 PHE 74 HE2 PHE 41 -8.129 -22.046 -8.256 352 HE2 PHE 74 HE1 PHE 41 -8.098 -25.734 -6.031 353 HZ PHE 74 HZ PHE 41 -8.395 -24.515 -8.181 354 H LYS 75 H LYS 42 -5.203 -22.890 -5.377 355 HA LYS 75 HA LYS 42 -3.930 -24.942 -3.767 356 HB2 LYS 75 HB2 LYS 42 -5.406 -25.278 -5.755 357 HB3 LYS 75 HB3 LYS 42 -4.194 -24.550 -6.785 358 HG2 LYS 75 HG2 LYS 42 -4.272 -27.007 -6.934 359 HG3 LYS 75 HG3 LYS 42 -2.687 -26.433 -6.397 360 HD2 LYS 75 HD2 LYS 42 -3.236 -27.074 -4.063 361 HD3 LYS 75 HD3 LYS 42 -4.870 -27.558 -4.581 362 HE2 LYS 75 HE2 LYS 42 -3.858 -29.252 -6.120 363 HE3 LYS 75 HE3 LYS 42 -2.243 -28.750 -5.616 364 HZ1 LYS 75 HZ1 LYS 42 -2.777 -29.525 -3.367 365 HZ2 LYS 75 HZ2 LYS 42 -4.269 -30.017 -3.854 366 HZ3 LYS 75 HZ3 LYS 42 -2.934 -30.731 -4.454 367 H GLN 76 H GLN 43 -2.904 -22.135 -5.473 368 HA GLN 76 HA GLN 43 -0.153 -22.775 -5.925 369 HB2 GLN 76 HB2 GLN 43 -1.528 -20.053 -5.670 370 HB3 GLN 76 HB3 GLN 43 0.035 -20.391 -6.387 371 HG2 GLN 76 HG2 GLN 43 -1.209 -20.216 -8.279 372 HG3 GLN 76 HG3 GLN 43 -1.336 -21.948 -8.053 373 HE21 GLN 76 HE22 GLN 43 -3.208 -19.705 -9.353 374 HE22 GLN 76 HE21 GLN 43 -4.754 -20.010 -8.577 375 H LEU 77 H LEU 44 -1.968 -21.121 -3.269 376 HA LEU 77 HA LEU 44 0.400 -20.875 -1.550 377 HB2 LEU 77 HB2 LEU 44 -2.547 -20.411 -1.089 378 HB3 LEU 77 HB3 LEU 44 -1.320 -20.231 0.163 379 HG LEU 77 HG LEU 44 -1.377 -18.636 -2.422 380 HD11 LEU 77 HD11 LEU 44 -3.262 -18.082 -0.887 381 HD12 LEU 77 HD12 LEU 44 -2.089 -17.742 0.405 382 HD13 LEU 77 HD13 LEU 44 -2.120 -16.740 -1.064 383 HD21 LEU 77 HD21 LEU 44 0.273 -17.162 -1.262 384 HD22 LEU 77 HD22 LEU 44 0.378 -18.355 0.048 385 HD23 LEU 77 HD23 LEU 44 0.917 -18.763 -1.596 386 H GLY 78 H GLY 45 -2.212 -23.235 -2.075 387 HA2 GLY 78 HA2 GLY 45 -1.445 -25.536 -1.714 388 HA3 GLY 78 HA3 GLY 45 -0.802 -25.055 -0.145 389 H TYR 79 H TYR 46 -3.853 -23.592 -0.895 390 HA TYR 79 HA TYR 46 -5.301 -25.224 1.058 391 HB2 TYR 79 HB2 TYR 46 -6.282 -23.001 -0.779 392 HB3 TYR 79 HB3 TYR 46 -7.130 -23.692 0.602 393 HD1 TYR 79 HD2 TYR 46 -6.183 -23.389 2.933 394 HD2 TYR 79 HD1 TYR 46 -4.649 -21.262 -0.491 395 HE1 TYR 79 HE2 TYR 46 -5.064 -21.813 4.425 396 HE2 TYR 79 HE1 TYR 46 -3.510 -19.669 0.990 397 HH TYR 79 HH TYR 46 -3.655 -19.909 4.590 398 HA PRO 80 HA PRO 47 -6.223 -27.928 -2.296 399 HB2 PRO 80 HB2 PRO 47 -8.479 -29.319 -1.457 400 HB3 PRO 80 HB3 PRO 47 -6.844 -29.568 -0.783 401 HG2 PRO 80 HG2 PRO 47 -9.045 -27.774 0.308 402 HG3 PRO 80 HG3 PRO 47 -8.075 -29.001 1.196 403 HD2 PRO 80 HD2 PRO 47 -7.347 -26.409 1.292 404 HD3 PRO 80 HD3 PRO 47 -6.100 -27.663 1.066 405 H THR 81 H THR 48 -8.908 -25.800 -1.252 406 HA THR 81 HA THR 48 -9.937 -25.737 -4.044 407 HB THR 81 HB THR 48 -12.239 -25.966 -2.939 408 HG1 THR 81 HG1 THR 48 -12.038 -27.080 -0.814 409 HG21 THR 81 HG21 THR 48 -11.031 -27.904 -4.078 410 HG22 THR 81 HG22 THR 48 -10.524 -28.433 -2.457 411 HG23 THR 81 HG23 THR 48 -12.246 -28.351 -2.864 412 H LEU 82 H LEU 49 -11.582 -23.968 -4.276 413 HA LEU 82 HA LEU 49 -10.650 -21.442 -3.278 414 HB2 LEU 82 HB2 LEU 49 -13.335 -22.307 -4.481 415 HB3 LEU 82 HB3 LEU 49 -12.991 -20.654 -4.041 416 HG LEU 82 HG LEU 49 -12.728 -20.854 -6.394 417 HD11 LEU 82 HD11 LEU 49 -11.154 -19.359 -5.281 418 HD12 LEU 82 HD12 LEU 49 -9.972 -20.683 -5.129 419 HD13 LEU 82 HD13 LEU 49 -10.422 -20.087 -6.728 420 HD21 LEU 82 HD21 LEU 49 -10.598 -22.988 -6.049 421 HD22 LEU 82 HD22 LEU 49 -12.283 -23.300 -6.554 422 HD23 LEU 82 HD23 LEU 49 -11.221 -22.305 -7.554 423 H GLU 83 H GLU 50 -13.296 -23.637 -2.213 424 HA GLU 83 HA GLU 50 -14.192 -21.870 -0.178 425 HB2 GLU 83 HB2 GLU 50 -15.319 -23.723 0.832 426 HB3 GLU 83 HB3 GLU 50 -15.546 -23.758 -0.912 427 HG2 GLU 83 HG2 GLU 50 -13.926 -25.593 -1.123 428 HG3 GLU 83 HG3 GLU 50 -13.587 -25.523 0.611 429 H ALA 84 H ALA 51 -11.618 -24.451 -0.058 430 HA ALA 84 HA ALA 51 -11.133 -24.149 2.717 431 HB1 ALA 84 HB1 ALA 51 -9.219 -24.992 0.519 432 HB2 ALA 84 HB2 ALA 51 -9.009 -25.258 2.269 433 HB3 ALA 84 HB3 ALA 51 -10.348 -26.046 1.412 434 H TYR 85 H TYR 52 -9.621 -22.425 -0.062 435 HA TYR 85 HA TYR 52 -7.856 -20.787 1.432 436 HB2 TYR 85 HB2 TYR 52 -7.695 -20.845 -0.940 437 HB3 TYR 85 HB3 TYR 52 -9.373 -20.353 -1.165 438 HD1 TYR 85 HD1 TYR 52 -6.027 -19.156 -0.001 439 HD2 TYR 85 HD2 TYR 52 -10.008 -18.070 -1.267 440 HE1 TYR 85 HE1 TYR 52 -5.335 -16.796 -0.011 441 HE2 TYR 85 HE2 TYR 52 -9.350 -15.691 -1.269 442 HH TYR 85 HH TYR 52 -6.055 -14.587 -0.309 443 H LEU 86 H LEU 53 -11.334 -20.197 0.554 444 HA LEU 86 HA LEU 53 -11.490 -17.737 1.991 445 HB2 LEU 86 HB2 LEU 53 -13.611 -19.718 1.090 446 HB3 LEU 86 HB3 LEU 53 -13.966 -18.112 1.735 447 HG LEU 86 HG LEU 53 -12.167 -18.405 -0.681 448 HD11 LEU 86 HD11 LEU 53 -15.187 -18.454 -0.597 449 HD12 LEU 86 HD12 LEU 53 -14.250 -18.002 -2.057 450 HD13 LEU 86 HD13 LEU 53 -14.097 -19.617 -1.354 451 HD21 LEU 86 HD21 LEU 53 -12.272 -16.209 0.514 452 HD22 LEU 86 HD22 LEU 53 -12.908 -16.134 -1.128 453 HD23 LEU 86 HD23 LEU 53 -14.035 -16.179 0.249 454 H ARG 87 H ARG 54 -12.159 -21.083 3.068 455 HA ARG 87 HA ARG 54 -13.148 -20.474 5.707 456 HB2 ARG 87 HB2 ARG 54 -11.475 -22.824 4.684 457 HB3 ARG 87 HB3 ARG 54 -11.786 -22.607 6.382 458 HG2 ARG 87 HG2 ARG 54 -13.300 -24.186 5.794 459 HG3 ARG 87 HG3 ARG 54 -14.265 -22.708 5.915 460 HD2 ARG 87 HD2 ARG 54 -14.421 -22.568 3.473 461 HD3 ARG 87 HD3 ARG 54 -13.105 -23.717 3.318 462 HE ARG 87 HE ARG 54 -14.603 -25.245 2.951 463 HH11 ARG 87 HH21 ARG 54 -15.931 -23.609 5.855 464 HH12 ARG 87 HH22 ARG 54 -17.320 -24.627 5.899 465 HH21 ARG 87 HH11 ARG 54 -16.449 -26.410 2.950 466 HH22 ARG 87 HH12 ARG 54 -17.593 -26.316 4.266 467 H SER 88 H SER 55 -9.861 -20.484 4.376 468 HA SER 88 HA SER 55 -8.581 -20.394 6.946 469 HB2 SER 88 HB2 SER 55 -7.455 -20.079 4.151 470 HB3 SER 88 HB3 SER 55 -6.535 -20.349 5.641 471 HG SER 88 HG SER 55 -8.378 -22.087 4.359 472 H VAL 89 H VAL 56 -10.299 -17.891 5.821 473 HA VAL 89 HA VAL 56 -8.426 -15.910 7.015 474 HB VAL 89 HB VAL 56 -8.225 -15.666 4.666 475 HG11 VAL 89 HG11 VAL 56 -10.289 -14.990 3.253 476 HG12 VAL 89 HG12 VAL 56 -10.006 -16.691 3.605 477 HG13 VAL 89 HG13 VAL 56 -11.228 -15.799 4.522 478 HG21 VAL 89 HG21 VAL 56 -8.364 -13.544 5.992 479 HG22 VAL 89 HG22 VAL 56 -8.708 -13.401 4.256 480 HG23 VAL 89 HG23 VAL 56 -10.032 -13.370 5.417 481 HA PRO 90 HA PRO 57 -12.892 -16.188 8.565 482 HB2 PRO 90 HB2 PRO 57 -12.676 -17.197 11.084 483 HB3 PRO 90 HB3 PRO 57 -12.647 -18.225 9.619 484 HG2 PRO 90 HG2 PRO 57 -10.289 -17.203 11.233 485 HG3 PRO 90 HG3 PRO 57 -10.602 -18.867 10.635 486 HD2 PRO 90 HD2 PRO 57 -8.984 -17.082 9.294 487 HD3 PRO 90 HD3 PRO 57 -9.958 -18.342 8.488 488 H ALA 91 H ALA 58 -9.997 -14.694 9.923 489 HA ALA 91 HA ALA 58 -11.467 -13.042 11.822 490 HB1 ALA 91 HB1 ALA 58 -9.128 -13.803 12.222 491 HB2 ALA 91 HB2 ALA 58 -8.590 -12.862 10.807 492 HB3 ALA 91 HB3 ALA 58 -9.258 -12.034 12.234 493 H VAL 92 H VAL 59 -11.076 -12.852 8.436 494 HA VAL 92 HA VAL 59 -11.628 -9.902 8.456 495 HB VAL 92 HB VAL 59 -9.817 -11.396 6.522 496 HG11 VAL 92 HG11 VAL 59 -9.143 -9.199 5.713 497 HG12 VAL 92 HG12 VAL 59 -10.894 -9.380 5.540 498 HG13 VAL 92 HG13 VAL 59 -10.231 -8.403 6.864 499 HG21 VAL 92 HG21 VAL 59 -9.056 -9.573 8.835 500 HG22 VAL 92 HG22 VAL 59 -8.647 -11.296 8.654 501 HG23 VAL 92 HG23 VAL 59 -7.943 -10.114 7.559 502 H VAL 93 H VAL 60 -12.409 -13.099 7.206 503 HA VAL 93 HA VAL 60 -14.446 -11.991 5.347 504 HB VAL 93 HB VAL 60 -12.228 -14.004 4.937 505 HG11 VAL 93 HG11 VAL 60 -14.524 -13.614 3.000 506 HG12 VAL 93 HG12 VAL 60 -13.004 -14.452 2.651 507 HG13 VAL 93 HG13 VAL 60 -14.082 -15.100 3.875 508 HG21 VAL 93 HG21 VAL 60 -12.903 -11.354 3.642 509 HG22 VAL 93 HG22 VAL 60 -11.429 -11.804 4.492 510 HG23 VAL 93 HG23 VAL 60 -11.756 -12.506 2.918 511 H ARG 94 H ARG 61 -16.025 -13.734 4.778 512 HA ARG 94 HA ARG 61 -16.570 -15.742 6.889 513 HB2 ARG 94 HB2 ARG 61 -17.593 -13.773 7.788 514 HB3 ARG 94 HB3 ARG 61 -18.248 -13.287 6.225 515 HG2 ARG 94 HG2 ARG 61 -19.843 -15.221 6.323 516 HG3 ARG 94 HG3 ARG 61 -19.109 -15.716 7.862 517 HD2 ARG 94 HD2 ARG 61 -21.110 -14.553 8.400 518 HD3 ARG 94 HD3 ARG 61 -19.789 -13.469 8.801 519 HE ARG 94 HE ARG 61 -20.252 -12.136 6.863 520 HH11 ARG 94 HH11 ARG 61 -22.634 -14.799 7.123 521 HH12 ARG 94 HH12 ARG 61 -23.902 -13.881 6.378 522 HH21 ARG 94 HH21 ARG 61 -22.001 -10.921 5.965 523 HH22 ARG 94 HH22 ARG 61 -23.486 -11.702 5.586 524 H ILE 95 H ILE 62 -18.191 -17.269 6.135 525 HA ILE 95 HA ILE 62 -19.018 -17.036 3.337 526 HB ILE 95 HB ILE 62 -18.332 -19.382 2.878 527 HG12 ILE 95 HG12 ILE 62 -16.722 -19.158 5.447 528 HG13 ILE 95 HG13 ILE 62 -18.123 -20.205 5.174 529 HG21 ILE 95 HG21 ILE 62 -16.080 -18.897 2.254 530 HG22 ILE 95 HG22 ILE 62 -16.926 -17.361 2.177 531 HG23 ILE 95 HG23 ILE 62 -15.876 -17.705 3.563 532 HD11 ILE 95 HD11 ILE 62 -15.405 -20.424 3.828 533 HD12 ILE 95 HD12 ILE 62 -16.155 -21.537 4.984 534 HD13 ILE 95 HD13 ILE 62 -16.836 -21.373 3.352 535 H GLU 96 H GLU 63 -20.898 -18.242 2.904 536 HA GLU 96 HA GLU 63 -22.154 -19.728 5.168 537 HB2 GLU 96 HB2 GLU 63 -23.562 -17.863 3.210 538 HB3 GLU 96 HB3 GLU 63 -24.331 -18.824 4.457 539 HG2 GLU 96 HG2 GLU 63 -22.413 -16.494 4.880 540 HG3 GLU 96 HG3 GLU 63 -24.160 -16.448 5.048 541 H ALA 97 H ALA 64 -21.667 -21.755 4.358 542 HA ALA 97 HA ALA 64 -22.110 -22.470 1.544 543 HB1 ALA 97 HB1 ALA 64 -20.375 -23.632 2.805 544 HB2 ALA 97 HB2 ALA 64 -21.587 -24.188 3.994 545 HB3 ALA 97 HB3 ALA 64 -21.649 -24.753 2.307 546 H SER 98 H SER 65 -24.073 -22.817 0.732 547 HA SER 98 HA SER 65 -26.460 -22.770 2.411 548 HB2 SER 98 HB2 SER 65 -26.364 -21.526 0.297 549 HB3 SER 98 HB3 SER 65 -25.992 -23.012 -0.597 550 HG SER 98 HG SER 65 -28.285 -22.271 -0.553 551 H ARG 99 H ARG 66 -28.028 -24.430 2.317 552 HA ARG 99 HA ARG 66 -27.079 -27.163 2.369 553 HB2 ARG 99 HB2 ARG 66 -29.476 -27.792 2.517 554 HB3 ARG 99 HB3 ARG 66 -28.879 -26.732 3.770 555 HG2 ARG 99 HG2 ARG 66 -31.133 -26.166 3.173 556 HG3 ARG 99 HG3 ARG 66 -30.062 -24.809 2.828 557 HD2 ARG 99 HD2 ARG 66 -30.255 -25.110 0.476 558 HD3 ARG 99 HD3 ARG 66 -30.915 -26.759 0.653 559 HE ARG 99 HE ARG 66 -32.693 -25.050 1.971 560 HH11 ARG 99 HH11 ARG 66 -31.454 -25.181 -1.375 561 HH12 ARG 99 HH12 ARG 66 -32.973 -24.769 -2.083 562 HH21 ARG 99 HH21 ARG 66 -34.688 -24.445 1.010 563 HH22 ARG 99 HH22 ARG 66 -34.822 -24.278 -0.704 564 H SER 100 H SER 67 -28.118 -25.112 -0.273 565 HA SER 100 HA SER 67 -28.705 -27.243 -2.107 566 HB2 SER 100 HB2 SER 67 -27.740 -24.413 -2.679 567 HB3 SER 100 HB3 SER 67 -28.660 -25.473 -3.766 568 HG SER 100 HG SER 67 -29.940 -23.873 -2.646 569 H GLY 101 H GLY 68 -25.711 -26.260 -0.688 570 HA2 GLY 101 HA2 GLY 68 -23.705 -27.372 -1.001 571 HA3 GLY 101 HA3 GLY 68 -24.185 -27.866 -2.631 572 H GLU 102 H GLU 69 -24.974 -24.632 -2.551 573 HA GLU 102 HA GLU 69 -22.472 -23.744 -3.823 574 HB2 GLU 102 HB2 GLU 69 -25.082 -22.308 -3.118 575 HB3 GLU 102 HB3 GLU 69 -23.715 -21.546 -3.924 576 HG2 GLU 102 HG2 GLU 69 -25.421 -23.826 -5.009 577 HG3 GLU 102 HG3 GLU 69 -25.407 -22.155 -5.560 578 H ILE 103 H ILE 70 -21.485 -21.685 -2.902 579 HA ILE 103 HA ILE 70 -21.939 -21.238 -0.055 580 HB ILE 103 HB ILE 70 -20.151 -22.691 0.221 581 HG12 ILE 103 HG12 ILE 70 -19.891 -20.355 1.260 582 HG13 ILE 103 HG13 ILE 70 -18.568 -21.503 1.341 583 HG21 ILE 103 HG21 ILE 70 -18.756 -21.525 -2.170 584 HG22 ILE 103 HG22 ILE 70 -17.976 -22.593 -0.974 585 HG23 ILE 103 HG23 ILE 70 -19.344 -23.181 -1.924 586 HD11 ILE 103 HD11 ILE 70 -18.596 -19.430 -0.882 587 HD12 ILE 103 HD12 ILE 70 -17.997 -19.051 0.719 588 HD13 ILE 103 HD13 ILE 70 -17.234 -20.346 -0.215 589 H VAL 104 H VAL 71 -21.907 -19.176 0.455 590 HA VAL 104 HA VAL 71 -21.289 -17.221 -1.706 591 HB VAL 104 HB VAL 71 -23.222 -16.934 0.636 592 HG11 VAL 104 HG11 VAL 71 -24.116 -15.049 -0.686 593 HG12 VAL 104 HG12 VAL 71 -22.406 -14.814 -0.336 594 HG13 VAL 104 HG13 VAL 71 -22.910 -15.349 -1.961 595 HG21 VAL 104 HG21 VAL 71 -23.880 -17.721 -2.229 596 HG22 VAL 104 HG22 VAL 71 -24.122 -18.732 -0.788 597 HG23 VAL 104 HG23 VAL 71 -25.067 -17.257 -0.997 598 H CYS 105 H CYS 72 -19.734 -15.736 -1.224 599 HA CYS 105 HA CYS 72 -18.344 -15.966 1.381 600 HB2 CYS 105 HB2 CYS 72 -17.391 -14.466 -1.082 601 HB3 CYS 105 HB3 CYS 72 -16.430 -15.193 0.225 602 HG CYS 105 HG CYS 72 -18.157 -16.579 -2.249 603 H TYR 106 H TYR 73 -17.836 -14.084 2.599 604 HA TYR 106 HA TYR 73 -19.129 -11.502 1.883 605 HB2 TYR 106 HB2 TYR 73 -19.556 -13.177 4.399 606 HB3 TYR 106 HB3 TYR 73 -20.009 -11.490 4.268 607 HD1 TYR 106 HD1 TYR 73 -21.718 -10.782 2.504 608 HD2 TYR 106 HD2 TYR 73 -20.956 -14.916 3.562 609 HE1 TYR 106 HE1 TYR 73 -24.004 -11.340 1.831 610 HE2 TYR 106 HE2 TYR 73 -23.211 -15.529 2.739 611 HH TYR 106 HH TYR 73 -25.303 -14.731 1.967 612 H ALA 107 H ALA 74 -18.457 -9.821 3.563 613 HA ALA 107 HA ALA 74 -15.605 -10.161 4.307 614 HB1 ALA 107 HB1 ALA 74 -15.720 -7.781 4.814 615 HB2 ALA 107 HB2 ALA 74 -16.347 -8.063 3.186 616 HB3 ALA 107 HB3 ALA 74 -17.470 -7.746 4.521 617 H VAL 108 H VAL 75 -14.983 -9.479 6.495 618 HA VAL 108 HA VAL 75 -17.159 -9.474 8.534 619 HB VAL 108 HB VAL 75 -15.313 -11.596 8.088 620 HG11 VAL 108 HG11 VAL 75 -14.320 -12.056 10.218 621 HG12 VAL 108 HG12 VAL 75 -13.709 -10.504 9.625 622 HG13 VAL 108 HG13 VAL 75 -14.934 -10.539 10.904 623 HG21 VAL 108 HG21 VAL 75 -16.675 -12.739 9.769 624 HG22 VAL 108 HG22 VAL 75 -17.284 -11.187 10.379 625 HG23 VAL 108 HG23 VAL 75 -17.729 -11.730 8.755 626 H ALA 109 H ALA 76 -13.939 -8.277 7.657 627 HA ALA 109 HA ALA 76 -13.283 -7.169 10.168 628 HB1 ALA 109 HB1 ALA 76 -12.563 -6.076 7.416 629 HB2 ALA 109 HB2 ALA 76 -11.797 -5.639 8.952 630 HB3 ALA 109 HB3 ALA 76 -11.644 -7.292 8.345 Start of MODEL 10 1 H1 GLY -2 H1 GLY -2 6.992 1.671 -1.225 2 H2 GLY -2 H2 GLY -2 6.235 1.327 -2.637 3 H3 GLY -2 H3 GLY -2 5.371 1.867 -1.355 4 HA2 GLY -2 HA2 GLY -2 6.799 -0.704 -1.479 5 HA3 GLY -2 HA3 GLY -2 5.847 -0.123 -0.101 6 H HIS -1 H HIS -1 5.257 -2.563 -1.148 7 HA HIS -1 HA HIS -1 2.529 -2.203 -2.243 8 HB2 HIS -1 HB2 HIS -1 4.663 -4.059 -3.388 9 HB3 HIS -1 HB3 HIS -1 2.945 -4.229 -3.715 10 HD2 HIS -1 HD2 HIS -1 6.004 -2.412 -4.933 11 HE1 HIS -1 HE1 HIS -1 2.740 -0.552 -6.961 12 HE2 HIS -1 HE2 HIS -1 5.274 -0.763 -6.848 13 H MET 34 H MET 1 1.224 -4.167 -1.808 14 HA MET 34 HA MET 1 1.730 -5.354 0.763 15 HB2 MET 34 HB2 MET 1 -0.209 -6.078 -1.479 16 HB3 MET 34 HB3 MET 1 -0.188 -6.840 0.118 17 HG2 MET 34 HG2 MET 1 -1.712 -5.329 0.690 18 HG3 MET 34 HG3 MET 1 -0.362 -4.219 0.827 19 HE1 MET 34 HE1 MET 1 -3.694 -5.108 -0.782 20 HE2 MET 34 HE2 MET 1 -3.799 -4.129 -2.259 21 HE3 MET 34 HE3 MET 1 -2.807 -5.578 -2.251 22 H LEU 35 H LEU 2 2.206 -7.564 1.223 23 HA LEU 35 HA LEU 2 4.040 -8.958 -0.625 24 HB2 LEU 35 HB2 LEU 2 2.799 -9.838 2.031 25 HB3 LEU 35 HB3 LEU 2 4.072 -10.691 1.164 26 HG LEU 35 HG LEU 2 4.329 -7.933 2.434 27 HD11 LEU 35 HD11 LEU 2 5.832 -9.069 4.008 28 HD12 LEU 35 HD12 LEU 2 4.208 -9.778 4.045 29 HD13 LEU 35 HD13 LEU 2 5.528 -10.624 3.206 30 HD21 LEU 35 HD21 LEU 2 5.785 -8.009 0.468 31 HD22 LEU 35 HD22 LEU 2 6.767 -8.169 1.925 32 HD23 LEU 35 HD23 LEU 2 6.408 -9.610 0.953 33 H GLU 36 H GLU 3 3.434 -11.347 -1.259 34 HA GLU 36 HA GLU 3 1.153 -11.162 -2.825 35 HB2 GLU 36 HB2 GLU 3 2.992 -12.710 -3.298 36 HB3 GLU 36 HB3 GLU 3 2.516 -13.730 -1.927 37 HG2 GLU 36 HG2 GLU 3 0.378 -14.257 -2.989 38 HG3 GLU 36 HG3 GLU 3 0.722 -13.124 -4.306 39 H ALA 37 H ALA 4 1.380 -13.083 0.174 40 HA ALA 37 HA ALA 4 -1.346 -13.876 -0.001 41 HB1 ALA 37 HB1 ALA 4 0.367 -13.796 2.508 42 HB2 ALA 37 HB2 ALA 4 -1.149 -14.701 2.279 43 HB3 ALA 37 HB3 ALA 4 0.284 -15.138 1.333 44 H ASP 38 H ASP 5 0.167 -11.036 1.446 45 HA ASP 38 HA ASP 5 -2.153 -10.131 2.929 46 HB2 ASP 38 HB2 ASP 5 0.217 -9.481 3.409 47 HB3 ASP 38 HB3 ASP 5 0.246 -8.560 1.911 48 H LEU 39 H LEU 6 -0.820 -9.507 -0.324 49 HA LEU 39 HA LEU 6 -2.561 -7.442 -1.143 50 HB2 LEU 39 HB2 LEU 6 -0.470 -8.086 -2.321 51 HB3 LEU 39 HB3 LEU 6 -1.154 -9.615 -2.782 52 HG LEU 39 HG LEU 6 -2.634 -7.131 -3.640 53 HD11 LEU 39 HD11 LEU 6 -1.187 -6.899 -5.624 54 HD12 LEU 39 HD12 LEU 6 -0.288 -6.585 -4.136 55 HD13 LEU 39 HD13 LEU 6 -0.090 -8.137 -4.972 56 HD21 LEU 39 HD21 LEU 6 -2.099 -9.804 -5.005 57 HD22 LEU 39 HD22 LEU 6 -3.641 -9.261 -4.304 58 HD23 LEU 39 HD23 LEU 6 -3.007 -8.450 -5.714 59 H VAL 40 H VAL 7 -2.711 -10.991 -1.739 60 HA VAL 40 HA VAL 7 -5.200 -10.796 -3.079 61 HB VAL 40 HB VAL 7 -5.247 -13.224 -3.020 62 HG11 VAL 40 HG11 VAL 7 -3.713 -11.948 -4.557 63 HG12 VAL 40 HG12 VAL 7 -2.381 -12.286 -3.455 64 HG13 VAL 40 HG13 VAL 7 -3.230 -13.615 -4.242 65 HG21 VAL 40 HG21 VAL 7 -2.949 -13.040 -1.065 66 HG22 VAL 40 HG22 VAL 7 -4.552 -13.714 -0.724 67 HG23 VAL 40 HG23 VAL 7 -3.473 -14.527 -1.857 68 H SER 41 H SER 8 -4.457 -11.437 0.395 69 HA SER 41 HA SER 8 -7.159 -11.874 1.175 70 HB2 SER 41 HB2 SER 8 -4.857 -10.716 2.810 71 HB3 SER 41 HB3 SER 8 -6.381 -11.364 3.450 72 HG SER 41 HG SER 8 -4.215 -12.691 2.233 73 H LYS 42 H LYS 9 -5.275 -8.724 1.186 74 HA LYS 42 HA LYS 9 -7.533 -7.256 2.243 75 HB2 LYS 42 HB2 LYS 9 -4.965 -6.436 0.831 76 HB3 LYS 42 HB3 LYS 9 -6.198 -5.253 1.306 77 HG2 LYS 42 HG2 LYS 9 -6.061 -5.886 3.641 78 HG3 LYS 42 HG3 LYS 9 -4.924 -7.207 3.255 79 HD2 LYS 42 HD2 LYS 9 -3.277 -5.604 2.421 80 HD3 LYS 42 HD3 LYS 9 -4.363 -4.241 2.777 81 HE2 LYS 42 HE2 LYS 9 -4.215 -4.595 5.140 82 HE3 LYS 42 HE3 LYS 9 -3.551 -6.222 4.927 83 HZ1 LYS 42 HZ1 LYS 9 -2.086 -3.743 4.235 84 HZ2 LYS 42 HZ2 LYS 9 -1.828 -4.669 5.557 85 HZ3 LYS 42 HZ3 LYS 9 -1.536 -5.293 4.068 86 H MET 43 H MET 10 -6.415 -7.862 -1.165 87 HA MET 43 HA MET 10 -8.455 -6.085 -2.207 88 HB2 MET 43 HB2 MET 10 -6.783 -8.253 -3.532 89 HB3 MET 43 HB3 MET 10 -7.932 -7.223 -4.394 90 HG2 MET 43 HG2 MET 10 -6.699 -5.209 -3.402 91 HG3 MET 43 HG3 MET 10 -5.437 -6.336 -2.909 92 HE1 MET 43 HE1 MET 10 -4.787 -3.793 -4.592 93 HE2 MET 43 HE2 MET 10 -3.486 -4.991 -4.386 94 HE3 MET 43 HE3 MET 10 -3.870 -4.371 -6.002 95 H LEU 44 H LEU 11 -8.352 -9.676 -1.706 96 HA LEU 44 HA LEU 11 -10.932 -10.362 -2.591 97 HB2 LEU 44 HB2 LEU 11 -9.351 -12.034 -1.774 98 HB3 LEU 44 HB3 LEU 11 -9.214 -11.228 -0.222 99 HG LEU 44 HG LEU 11 -11.608 -11.839 0.267 100 HD11 LEU 44 HD11 LEU 11 -12.476 -13.778 -1.022 101 HD12 LEU 44 HD12 LEU 11 -12.354 -12.314 -2.030 102 HD13 LEU 44 HD13 LEU 11 -11.140 -13.605 -2.177 103 HD21 LEU 44 HD21 LEU 11 -9.540 -14.014 -0.116 104 HD22 LEU 44 HD22 LEU 11 -9.771 -12.998 1.313 105 HD23 LEU 44 HD23 LEU 11 -11.018 -14.172 0.854 106 H ARG 45 H ARG 12 -9.950 -9.284 0.660 107 HA ARG 45 HA ARG 12 -12.479 -8.942 1.832 108 HB2 ARG 45 HB2 ARG 12 -10.615 -8.978 3.170 109 HB3 ARG 45 HB3 ARG 12 -9.711 -7.831 2.220 110 HG2 ARG 45 HG2 ARG 12 -12.168 -6.837 3.632 111 HG3 ARG 45 HG3 ARG 12 -10.713 -7.205 4.551 112 HD2 ARG 45 HD2 ARG 12 -9.465 -5.686 2.797 113 HD3 ARG 45 HD3 ARG 12 -11.101 -5.033 2.503 114 HE ARG 45 HE ARG 12 -10.441 -5.363 5.302 115 HH11 ARG 45 HH11 ARG 12 -9.780 -3.035 2.684 116 HH12 ARG 45 HH12 ARG 12 -9.739 -1.678 3.761 117 HH21 ARG 45 HH21 ARG 12 -10.513 -3.717 6.615 118 HH22 ARG 45 HH22 ARG 12 -10.103 -2.076 6.153 119 H ALA 46 H ALA 13 -10.624 -6.510 -0.125 120 HA ALA 46 HA ALA 13 -12.546 -4.507 0.407 121 HB1 ALA 46 HB1 ALA 13 -10.646 -4.763 -1.985 122 HB2 ALA 46 HB2 ALA 13 -11.445 -3.272 -1.457 123 HB3 ALA 46 HB3 ALA 13 -10.227 -4.035 -0.413 124 H VAL 47 H VAL 14 -12.329 -6.861 -2.332 125 HA VAL 47 HA VAL 14 -14.572 -5.830 -3.786 126 HB VAL 47 HB VAL 14 -13.459 -8.664 -3.550 127 HG11 VAL 47 HG11 VAL 14 -15.379 -7.559 -5.641 128 HG12 VAL 47 HG12 VAL 14 -14.625 -9.177 -5.628 129 HG13 VAL 47 HG13 VAL 14 -15.792 -8.740 -4.383 130 HG21 VAL 47 HG21 VAL 14 -12.490 -8.107 -5.816 131 HG22 VAL 47 HG22 VAL 14 -13.073 -6.448 -5.620 132 HG23 VAL 47 HG23 VAL 14 -11.837 -7.105 -4.529 133 H LEU 48 H LEU 15 -14.330 -8.252 -1.126 134 HA LEU 48 HA LEU 15 -17.111 -8.841 -1.024 135 HB2 LEU 48 HB2 LEU 15 -14.949 -8.917 1.150 136 HB3 LEU 48 HB3 LEU 15 -16.536 -9.640 1.312 137 HG LEU 48 HG LEU 15 -14.732 -10.458 -0.994 138 HD11 LEU 48 HD11 LEU 15 -13.452 -10.735 1.062 139 HD12 LEU 48 HD12 LEU 15 -14.817 -11.542 1.849 140 HD13 LEU 48 HD13 LEU 15 -13.990 -12.328 0.481 141 HD21 LEU 48 HD21 LEU 15 -16.889 -11.936 0.541 142 HD22 LEU 48 HD22 LEU 15 -17.184 -11.085 -0.982 143 HD23 LEU 48 HD23 LEU 15 -16.060 -12.465 -0.939 144 H GLN 49 H GLN 16 -15.201 -6.261 0.614 145 HA GLN 49 HA GLN 16 -17.320 -5.401 2.325 146 HB2 GLN 49 HB2 GLN 16 -14.785 -4.079 1.298 147 HB3 GLN 49 HB3 GLN 16 -15.936 -3.177 2.268 148 HG2 GLN 49 HG2 GLN 16 -14.584 -5.754 3.176 149 HG3 GLN 49 HG3 GLN 16 -14.042 -4.129 3.580 150 HE21 GLN 49 HE22 GLN 16 -14.461 -5.668 5.736 151 HE22 GLN 49 HE21 GLN 16 -15.975 -5.265 6.531 152 H SER 50 H SER 17 -16.427 -4.403 -1.048 153 HA SER 50 HA SER 17 -18.530 -2.456 -1.237 154 HB2 SER 50 HB2 SER 17 -17.200 -4.144 -3.401 155 HB3 SER 50 HB3 SER 17 -18.166 -2.683 -3.660 156 HG SER 50 HG SER 17 -15.947 -2.147 -3.631 157 H HIS 51 H HIS 18 -18.318 -5.949 -1.997 158 HA HIS 51 HA HIS 18 -21.037 -6.018 -3.036 159 HB2 HIS 51 HB2 HIS 18 -18.871 -8.129 -2.821 160 HB3 HIS 51 HB3 HIS 18 -20.439 -8.345 -3.596 161 HD2 HIS 51 HD2 HIS 18 -18.788 -8.926 -5.743 162 HE1 HIS 51 HE1 HIS 18 -18.131 -4.878 -6.824 163 HE2 HIS 51 HE2 HIS 18 -17.993 -7.271 -7.642 164 H LYS 52 H LYS 19 -21.735 -5.330 -0.657 165 HA LYS 52 HA LYS 19 -21.641 -7.236 1.446 166 HB2 LYS 52 HB2 LYS 19 -23.672 -5.025 0.866 167 HB3 LYS 52 HB3 LYS 19 -23.662 -5.957 2.353 168 HG2 LYS 52 HG2 LYS 19 -21.488 -4.064 1.411 169 HG3 LYS 52 HG3 LYS 19 -22.609 -3.865 2.764 170 HD2 LYS 52 HD2 LYS 19 -21.545 -6.101 3.663 171 HD3 LYS 52 HD3 LYS 19 -20.241 -5.747 2.538 172 HE2 LYS 52 HE2 LYS 19 -21.190 -4.082 4.912 173 HE3 LYS 52 HE3 LYS 19 -19.643 -4.910 4.724 174 HZ1 LYS 52 HZ1 LYS 19 -19.244 -3.322 2.801 175 HZ2 LYS 52 HZ2 LYS 19 -20.536 -2.458 3.322 176 HZ3 LYS 52 HZ3 LYS 19 -19.237 -2.648 4.302 177 H ASN 53 H ASN 20 -23.745 -7.258 -1.357 178 HA ASN 53 HA ASN 20 -25.715 -9.067 -0.327 179 HB2 ASN 53 HB2 ASN 20 -25.914 -7.753 -2.453 180 HB3 ASN 53 HB3 ASN 20 -24.647 -8.753 -3.168 181 HD21 ASN 53 HD22 ASN 20 -27.916 -9.041 -1.576 182 HD22 ASN 53 HD21 ASN 20 -28.422 -10.405 -2.541 183 H GLY 54 H GLY 21 -22.354 -9.567 -0.842 184 HA2 GLY 54 HA2 GLY 21 -21.086 -11.404 -0.544 185 HA3 GLY 54 HA3 GLY 21 -22.510 -12.456 -0.457 186 H ILE 55 H ILE 22 -20.436 -13.371 -1.889 187 HA ILE 55 HA ILE 22 -21.409 -13.350 -4.681 188 HB ILE 55 HB ILE 22 -18.794 -13.348 -5.240 189 HG12 ILE 55 HG12 ILE 22 -18.839 -11.552 -2.754 190 HG13 ILE 55 HG13 ILE 22 -17.921 -13.031 -2.972 191 HG21 ILE 55 HG21 ILE 22 -18.963 -11.175 -6.044 192 HG22 ILE 55 HG22 ILE 22 -20.631 -11.745 -6.035 193 HG23 ILE 55 HG23 ILE 22 -20.088 -10.659 -4.743 194 HD11 ILE 55 HD11 ILE 22 -17.552 -10.315 -4.312 195 HD12 ILE 55 HD12 ILE 22 -16.413 -11.171 -3.276 196 HD13 ILE 55 HD13 ILE 22 -16.730 -11.758 -4.925 197 H VAL 56 H VAL 23 -21.649 -15.324 -5.355 198 HA VAL 56 HA VAL 23 -21.069 -17.607 -3.757 199 HB VAL 56 HB VAL 23 -21.743 -18.842 -5.832 200 HG11 VAL 56 HG11 VAL 23 -23.592 -16.583 -4.965 201 HG12 VAL 56 HG12 VAL 23 -24.075 -18.043 -5.861 202 HG13 VAL 56 HG13 VAL 23 -23.426 -18.199 -4.231 203 HG21 VAL 56 HG21 VAL 23 -22.589 -17.670 -7.786 204 HG22 VAL 56 HG22 VAL 23 -22.159 -16.092 -7.098 205 HG23 VAL 56 HG23 VAL 23 -20.890 -17.251 -7.543 206 H LEU 57 H LEU 24 -19.413 -19.274 -4.038 207 HA LEU 57 HA LEU 24 -16.958 -18.274 -4.358 208 HB2 LEU 57 HB2 LEU 24 -15.911 -20.301 -4.219 209 HB3 LEU 57 HB3 LEU 24 -17.330 -20.358 -3.239 210 HG LEU 57 HG LEU 24 -17.045 -21.617 -6.018 211 HD11 LEU 57 HD11 LEU 24 -16.852 -23.773 -4.842 212 HD12 LEU 57 HD12 LEU 24 -15.554 -22.678 -4.385 213 HD13 LEU 57 HD13 LEU 24 -16.908 -22.935 -3.274 214 HD21 LEU 57 HD21 LEU 24 -19.196 -22.223 -3.931 215 HD22 LEU 57 HD22 LEU 24 -19.477 -21.198 -5.333 216 HD23 LEU 57 HD23 LEU 24 -19.056 -22.894 -5.555 217 HA PRO 58 HA PRO 25 -16.117 -19.182 -8.951 218 HB2 PRO 58 HB2 PRO 25 -18.126 -19.140 -10.801 219 HB3 PRO 58 HB3 PRO 25 -17.609 -20.626 -9.953 220 HG2 PRO 58 HG2 PRO 25 -19.942 -18.811 -9.243 221 HG3 PRO 58 HG3 PRO 25 -19.944 -20.588 -9.440 222 HD2 PRO 58 HD2 PRO 25 -19.715 -19.482 -6.993 223 HD3 PRO 58 HD3 PRO 25 -18.754 -20.920 -7.448 224 H ARG 59 H ARG 26 -18.904 -17.114 -8.124 225 HA ARG 59 HA ARG 26 -18.177 -14.902 -9.868 226 HB2 ARG 59 HB2 ARG 26 -20.478 -15.416 -9.016 227 HB3 ARG 59 HB3 ARG 26 -19.954 -14.964 -7.385 228 HG2 ARG 59 HG2 ARG 26 -19.541 -12.676 -8.106 229 HG3 ARG 59 HG3 ARG 26 -19.869 -13.085 -9.794 230 HD2 ARG 59 HD2 ARG 26 -21.911 -13.358 -7.548 231 HD3 ARG 59 HD3 ARG 26 -21.748 -11.917 -8.581 232 HE ARG 59 HE ARG 26 -21.984 -14.110 -10.314 233 HH11 ARG 59 HH21 ARG 26 -24.036 -12.392 -7.973 234 HH12 ARG 59 HH22 ARG 26 -25.518 -12.883 -8.712 235 HH21 ARG 59 HH11 ARG 26 -23.957 -14.760 -11.296 236 HH22 ARG 59 HH12 ARG 26 -25.468 -14.236 -10.651 237 H LEU 60 H LEU 27 -17.429 -15.933 -6.554 238 HA LEU 60 HA LEU 27 -16.133 -13.667 -5.616 239 HB2 LEU 60 HB2 LEU 27 -16.572 -15.747 -4.276 240 HB3 LEU 60 HB3 LEU 27 -15.301 -16.591 -5.136 241 HG LEU 60 HG LEU 27 -14.660 -15.872 -2.911 242 HD11 LEU 60 HD11 LEU 27 -12.947 -16.252 -4.708 243 HD12 LEU 60 HD12 LEU 27 -12.869 -14.477 -4.913 244 HD13 LEU 60 HD13 LEU 27 -12.446 -15.207 -3.373 245 HD21 LEU 60 HD21 LEU 27 -14.591 -13.017 -3.956 246 HD22 LEU 60 HD22 LEU 27 -15.908 -13.715 -2.975 247 HD23 LEU 60 HD23 LEU 27 -14.293 -13.616 -2.304 248 H GLN 61 H GLN 28 -14.671 -16.466 -7.408 249 HA GLN 61 HA GLN 28 -12.102 -15.434 -7.842 250 HB2 GLN 61 HB2 GLN 28 -13.884 -17.388 -9.267 251 HB3 GLN 61 HB3 GLN 28 -12.511 -16.803 -10.175 252 HG2 GLN 61 HG2 GLN 28 -12.080 -17.898 -7.373 253 HG3 GLN 61 HG3 GLN 28 -12.359 -18.991 -8.721 254 HE21 GLN 61 HE22 GLN 28 -10.288 -19.838 -9.357 255 HE22 GLN 61 HE21 GLN 28 -8.880 -18.834 -9.574 256 H GLY 62 H GLY 29 -15.012 -14.965 -9.961 257 HA2 GLY 62 HA2 GLY 29 -13.732 -13.477 -11.957 258 HA3 GLY 62 HA3 GLY 29 -15.448 -13.358 -11.540 259 H GLU 63 H GLU 30 -15.617 -12.135 -9.131 260 HA GLU 63 HA GLU 30 -15.015 -9.420 -9.863 261 HB2 GLU 63 HB2 GLU 30 -16.067 -10.663 -7.280 262 HB3 GLU 63 HB3 GLU 30 -15.993 -8.924 -7.590 263 HG2 GLU 63 HG2 GLU 30 -17.605 -10.925 -9.223 264 HG3 GLU 63 HG3 GLU 30 -18.236 -9.847 -7.994 265 H TYR 64 H TYR 31 -13.573 -11.681 -7.515 266 HA TYR 64 HA TYR 31 -11.667 -10.027 -6.238 267 HB2 TYR 64 HB2 TYR 31 -11.958 -12.263 -5.493 268 HB3 TYR 64 HB3 TYR 31 -11.693 -12.922 -7.113 269 HD1 TYR 64 HD2 TYR 31 -9.538 -13.208 -8.108 270 HD2 TYR 64 HD1 TYR 31 -9.980 -11.610 -4.123 271 HE1 TYR 64 HE2 TYR 31 -7.146 -13.537 -7.706 272 HE2 TYR 64 HE1 TYR 31 -7.572 -12.031 -3.689 273 HH TYR 64 HH TYR 31 -5.405 -13.418 -6.237 274 H ARG 65 H ARG 32 -11.419 -11.899 -9.324 275 HA ARG 65 HA ARG 32 -8.827 -10.969 -9.936 276 HB2 ARG 65 HB2 ARG 32 -9.771 -12.984 -10.869 277 HB3 ARG 65 HB3 ARG 32 -10.996 -12.066 -11.770 278 HG2 ARG 65 HG2 ARG 32 -9.364 -11.070 -13.218 279 HG3 ARG 65 HG3 ARG 32 -8.041 -11.449 -12.109 280 HD2 ARG 65 HD2 ARG 32 -8.532 -13.887 -12.518 281 HD3 ARG 65 HD3 ARG 32 -9.563 -13.385 -13.870 282 HE ARG 65 HE ARG 32 -6.638 -13.009 -13.495 283 HH11 ARG 65 HH11 ARG 32 -9.381 -12.974 -15.757 284 HH12 ARG 65 HH12 ARG 32 -8.400 -12.791 -17.166 285 HH21 ARG 65 HH21 ARG 32 -5.325 -12.784 -15.386 286 HH22 ARG 65 HH22 ARG 32 -6.046 -12.714 -16.950 287 H SER 66 H SER 33 -12.074 -9.591 -10.798 288 HA SER 66 HA SER 33 -11.110 -7.646 -12.559 289 HB2 SER 66 HB2 SER 33 -13.380 -7.305 -10.556 290 HB3 SER 66 HB3 SER 33 -13.113 -6.352 -12.017 291 HG SER 66 HG SER 33 -14.621 -7.969 -12.462 292 H LEU 67 H LEU 34 -11.018 -7.659 -8.946 293 HA LEU 67 HA LEU 34 -9.806 -4.979 -8.991 294 HB2 LEU 67 HB2 LEU 34 -11.213 -5.673 -7.099 295 HB3 LEU 67 HB3 LEU 34 -10.037 -6.922 -6.679 296 HG LEU 67 HG LEU 34 -8.323 -5.209 -6.223 297 HD11 LEU 67 HD11 LEU 34 -8.915 -3.401 -7.761 298 HD12 LEU 67 HD12 LEU 34 -10.482 -3.174 -6.947 299 HD13 LEU 67 HD13 LEU 34 -8.961 -2.789 -6.113 300 HD21 LEU 67 HD21 LEU 34 -9.880 -5.898 -4.430 301 HD22 LEU 67 HD22 LEU 34 -9.323 -4.235 -4.213 302 HD23 LEU 67 HD23 LEU 34 -10.962 -4.553 -4.841 303 H THR 68 H THR 35 -8.463 -8.336 -8.287 304 HA THR 68 HA THR 35 -5.866 -7.222 -7.665 305 HB THR 68 HB THR 35 -5.221 -9.697 -7.808 306 HG1 THR 68 HG1 THR 35 -7.153 -11.085 -7.894 307 HG21 THR 68 HG21 THR 35 -6.368 -10.331 -5.789 308 HG22 THR 68 HG22 THR 35 -5.898 -8.648 -5.679 309 HG23 THR 68 HG23 THR 35 -7.606 -9.076 -6.030 310 H GLY 69 H GLY 36 -7.328 -8.579 -10.613 311 HA2 GLY 69 HA2 GLY 36 -6.496 -8.718 -12.766 312 HA3 GLY 69 HA3 GLY 36 -4.977 -7.974 -12.254 313 H ASP 70 H ASP 37 -6.247 -10.702 -10.348 314 HA ASP 70 HA ASP 37 -4.464 -12.660 -11.669 315 HB2 ASP 70 HB2 ASP 37 -3.260 -11.444 -9.736 316 HB3 ASP 70 HB3 ASP 37 -4.425 -12.220 -8.655 317 H TRP 71 H TRP 38 -4.908 -14.858 -10.705 318 HA TRP 71 HA TRP 38 -7.791 -15.253 -10.097 319 HB2 TRP 71 HB2 TRP 38 -5.543 -17.227 -10.672 320 HB3 TRP 71 HB3 TRP 38 -7.217 -17.646 -10.353 321 HD1 TRP 71 HD1 TRP 38 -4.984 -17.080 -13.150 322 HE1 TRP 71 HE1 TRP 38 -6.252 -16.809 -15.362 323 HE3 TRP 71 HE3 TRP 38 -9.660 -16.251 -11.273 324 HZ2 TRP 71 HZ2 TRP 38 -8.981 -16.206 -16.201 325 HZ3 TRP 71 HZ3 TRP 38 -11.527 -15.681 -12.764 326 HH2 TRP 71 HH2 TRP 38 -11.232 -15.703 -15.232 327 H ILE 72 H ILE 39 -8.336 -16.490 -8.205 328 HA ILE 72 HA ILE 39 -7.057 -15.852 -5.787 329 HB ILE 72 HB ILE 39 -8.926 -18.096 -6.603 330 HG12 ILE 72 HG12 ILE 39 -9.716 -15.638 -6.591 331 HG13 ILE 72 HG13 ILE 39 -10.695 -16.840 -5.772 332 HG21 ILE 72 HG21 ILE 39 -9.364 -18.457 -4.142 333 HG22 ILE 72 HG22 ILE 39 -7.816 -19.028 -4.760 334 HG23 ILE 72 HG23 ILE 39 -7.880 -17.530 -3.816 335 HD11 ILE 72 HD11 ILE 39 -8.711 -15.127 -4.251 336 HD12 ILE 72 HD12 ILE 39 -10.384 -14.639 -4.576 337 HD13 ILE 72 HD13 ILE 39 -10.089 -16.099 -3.630 338 HA PRO 73 HA PRO 40 -3.689 -18.726 -6.422 339 HB2 PRO 73 HB2 PRO 40 -2.005 -18.062 -4.416 340 HB3 PRO 73 HB3 PRO 40 -2.454 -16.874 -5.650 341 HG2 PRO 73 HG2 PRO 40 -3.779 -17.249 -2.937 342 HG3 PRO 73 HG3 PRO 40 -3.066 -15.759 -3.635 343 HD2 PRO 73 HD2 PRO 40 -5.737 -16.375 -3.810 344 HD3 PRO 73 HD3 PRO 40 -4.878 -15.510 -5.125 345 H PHE 74 H PHE 41 -6.126 -19.915 -5.180 346 HA PHE 74 HA PHE 41 -5.759 -20.907 -2.585 347 HB2 PHE 74 HB2 PHE 41 -7.558 -22.397 -2.976 348 HB3 PHE 74 HB3 PHE 41 -7.954 -20.892 -3.741 349 HD1 PHE 74 HD1 PHE 41 -7.718 -20.737 -6.358 350 HD2 PHE 74 HD2 PHE 41 -7.529 -24.434 -4.142 351 HE1 PHE 74 HE1 PHE 41 -8.248 -22.000 -8.420 352 HE2 PHE 74 HE2 PHE 41 -8.153 -25.685 -6.195 353 HZ PHE 74 HZ PHE 41 -8.502 -24.472 -8.332 354 H LYS 75 H LYS 42 -5.283 -22.839 -5.578 355 HA LYS 75 HA LYS 42 -4.037 -24.913 -4.044 356 HB2 LYS 75 HB2 LYS 42 -5.460 -25.135 -6.093 357 HB3 LYS 75 HB3 LYS 42 -4.174 -24.450 -7.062 358 HG2 LYS 75 HG2 LYS 42 -4.359 -26.905 -7.245 359 HG3 LYS 75 HG3 LYS 42 -2.770 -26.416 -6.657 360 HD2 LYS 75 HD2 LYS 42 -3.427 -27.063 -4.348 361 HD3 LYS 75 HD3 LYS 42 -5.063 -27.466 -4.927 362 HE2 LYS 75 HE2 LYS 42 -4.084 -29.165 -6.464 363 HE3 LYS 75 HE3 LYS 42 -2.457 -28.747 -5.913 364 HZ1 LYS 75 HZ1 LYS 42 -3.087 -29.542 -3.692 365 HZ2 LYS 75 HZ2 LYS 42 -4.589 -29.955 -4.223 366 HZ3 LYS 75 HZ3 LYS 42 -3.272 -30.720 -4.809 367 H GLN 76 H GLN 43 -2.788 -22.028 -5.461 368 HA GLN 76 HA GLN 43 -0.044 -22.950 -5.837 369 HB2 GLN 76 HB2 GLN 43 -1.242 -20.147 -5.732 370 HB3 GLN 76 HB3 GLN 43 0.402 -20.543 -6.214 371 HG2 GLN 76 HG2 GLN 43 -0.247 -20.914 -8.329 372 HG3 GLN 76 HG3 GLN 43 -1.368 -22.166 -7.834 373 HE21 GLN 76 HE22 GLN 43 -3.626 -21.710 -8.121 374 HE22 GLN 76 HE21 GLN 43 -4.262 -20.113 -8.415 375 H LEU 77 H LEU 44 -1.894 -21.125 -3.334 376 HA LEU 77 HA LEU 44 0.330 -20.969 -1.454 377 HB2 LEU 77 HB2 LEU 44 -2.640 -20.474 -1.208 378 HB3 LEU 77 HB3 LEU 44 -1.518 -20.353 0.149 379 HG LEU 77 HG LEU 44 -1.365 -18.682 -2.384 380 HD11 LEU 77 HD11 LEU 44 -2.183 -16.822 -1.041 381 HD12 LEU 77 HD12 LEU 44 -3.333 -18.160 -0.914 382 HD13 LEU 77 HD13 LEU 44 -2.206 -17.828 0.421 383 HD21 LEU 77 HD21 LEU 44 0.244 -18.510 0.207 384 HD22 LEU 77 HD22 LEU 44 0.873 -18.873 -1.419 385 HD23 LEU 77 HD23 LEU 44 0.236 -17.274 -1.075 386 H GLY 78 H GLY 45 -2.240 -23.314 -2.169 387 HA2 GLY 78 HA2 GLY 45 -1.500 -25.614 -1.801 388 HA3 GLY 78 HA3 GLY 45 -0.910 -25.153 -0.205 389 H TYR 79 H TYR 46 -3.933 -23.675 -1.043 390 HA TYR 79 HA TYR 46 -5.417 -25.315 0.881 391 HB2 TYR 79 HB2 TYR 46 -6.349 -23.067 -0.950 392 HB3 TYR 79 HB3 TYR 46 -7.235 -23.773 0.391 393 HD1 TYR 79 HD2 TYR 46 -6.282 -23.541 2.761 394 HD2 TYR 79 HD1 TYR 46 -4.759 -21.312 -0.601 395 HE1 TYR 79 HE2 TYR 46 -5.211 -21.964 4.295 396 HE2 TYR 79 HE1 TYR 46 -3.699 -19.699 0.925 397 HH TYR 79 HH TYR 46 -3.306 -19.098 3.185 398 HA PRO 80 HA PRO 47 -6.310 -27.997 -2.496 399 HB2 PRO 80 HB2 PRO 47 -8.589 -29.377 -1.686 400 HB3 PRO 80 HB3 PRO 47 -6.955 -29.647 -1.008 401 HG2 PRO 80 HG2 PRO 47 -9.151 -27.849 0.087 402 HG3 PRO 80 HG3 PRO 47 -8.191 -29.084 0.972 403 HD2 PRO 80 HD2 PRO 47 -7.453 -26.485 1.090 404 HD3 PRO 80 HD3 PRO 47 -6.216 -27.750 0.870 405 H THR 81 H THR 48 -8.995 -25.877 -1.455 406 HA THR 81 HA THR 48 -9.977 -25.743 -4.256 407 HB THR 81 HB THR 48 -12.292 -25.955 -3.148 408 HG1 THR 81 HG1 THR 48 -12.102 -27.116 -1.050 409 HG21 THR 81 HG21 THR 48 -10.605 -28.457 -2.742 410 HG22 THR 81 HG22 THR 48 -12.323 -28.344 -3.160 411 HG23 THR 81 HG23 THR 48 -11.084 -27.877 -4.341 412 H LEU 82 H LEU 49 -11.616 -23.979 -4.476 413 HA LEU 82 HA LEU 49 -10.707 -21.464 -3.468 414 HB2 LEU 82 HB2 LEU 49 -13.391 -22.365 -4.657 415 HB3 LEU 82 HB3 LEU 49 -13.111 -20.721 -4.146 416 HG LEU 82 HG LEU 49 -12.885 -20.820 -6.511 417 HD11 LEU 82 HD11 LEU 49 -10.094 -20.585 -5.296 418 HD12 LEU 82 HD12 LEU 49 -10.623 -19.917 -6.835 419 HD13 LEU 82 HD13 LEU 49 -11.335 -19.305 -5.326 420 HD21 LEU 82 HD21 LEU 49 -12.317 -23.227 -6.773 421 HD22 LEU 82 HD22 LEU 49 -11.289 -22.159 -7.732 422 HD23 LEU 82 HD23 LEU 49 -10.649 -22.865 -6.241 423 H GLU 83 H GLU 50 -13.370 -23.638 -2.418 424 HA GLU 83 HA GLU 50 -14.249 -21.890 -0.381 425 HB2 GLU 83 HB2 GLU 50 -15.469 -23.684 0.562 426 HB3 GLU 83 HB3 GLU 50 -15.561 -23.826 -1.192 427 HG2 GLU 83 HG2 GLU 50 -13.884 -25.634 -1.142 428 HG3 GLU 83 HG3 GLU 50 -13.740 -25.473 0.616 429 H ALA 84 H ALA 51 -11.692 -24.476 -0.251 430 HA ALA 84 HA ALA 51 -11.230 -24.189 2.529 431 HB1 ALA 84 HB1 ALA 51 -9.109 -25.323 2.080 432 HB2 ALA 84 HB2 ALA 51 -10.453 -26.091 1.215 433 HB3 ALA 84 HB3 ALA 51 -9.314 -25.054 0.330 434 H TYR 85 H TYR 52 -9.723 -22.451 -0.242 435 HA TYR 85 HA TYR 52 -7.925 -20.842 1.262 436 HB2 TYR 85 HB2 TYR 52 -7.740 -20.904 -1.088 437 HB3 TYR 85 HB3 TYR 52 -9.416 -20.440 -1.344 438 HD1 TYR 85 HD1 TYR 52 -6.107 -19.192 -0.174 439 HD2 TYR 85 HD2 TYR 52 -10.087 -18.146 -1.468 440 HE1 TYR 85 HE1 TYR 52 -5.406 -16.831 -0.323 441 HE2 TYR 85 HE2 TYR 52 -9.435 -15.777 -1.541 442 HH TYR 85 HH TYR 52 -7.670 -14.221 -1.397 443 H LEU 86 H LEU 53 -11.389 -20.270 0.396 444 HA LEU 86 HA LEU 53 -11.558 -17.772 1.777 445 HB2 LEU 86 HB2 LEU 53 -13.683 -19.763 0.882 446 HB3 LEU 86 HB3 LEU 53 -14.029 -18.131 1.465 447 HG LEU 86 HG LEU 53 -12.172 -18.503 -0.886 448 HD11 LEU 86 HD11 LEU 53 -14.063 -19.754 -1.590 449 HD12 LEU 86 HD12 LEU 53 -15.194 -18.578 -0.936 450 HD13 LEU 86 HD13 LEU 53 -14.191 -18.166 -2.359 451 HD21 LEU 86 HD21 LEU 53 -14.087 -16.262 -0.111 452 HD22 LEU 86 HD22 LEU 53 -12.340 -16.285 0.246 453 HD23 LEU 86 HD23 LEU 53 -12.889 -16.262 -1.426 454 H ARG 87 H ARG 54 -12.253 -21.103 2.876 455 HA ARG 87 HA ARG 54 -13.254 -20.482 5.524 456 HB2 ARG 87 HB2 ARG 54 -11.575 -22.827 4.502 457 HB3 ARG 87 HB3 ARG 54 -11.883 -22.610 6.199 458 HG2 ARG 87 HG2 ARG 54 -13.385 -24.203 5.605 459 HG3 ARG 87 HG3 ARG 54 -14.355 -22.741 5.771 460 HD2 ARG 87 HD2 ARG 54 -14.554 -22.560 3.327 461 HD3 ARG 87 HD3 ARG 54 -13.220 -23.688 3.143 462 HE ARG 87 HE ARG 54 -14.647 -25.283 2.838 463 HH11 ARG 87 HH21 ARG 54 -16.097 -23.522 5.603 464 HH12 ARG 87 HH22 ARG 54 -17.515 -24.503 5.604 465 HH21 ARG 87 HH11 ARG 54 -16.544 -26.399 2.762 466 HH22 ARG 87 HH12 ARG 54 -17.727 -26.271 4.033 467 H SER 88 H SER 55 -9.947 -20.565 4.222 468 HA SER 88 HA SER 55 -8.692 -20.439 6.797 469 HB2 SER 88 HB2 SER 55 -7.536 -20.173 4.006 470 HB3 SER 88 HB3 SER 55 -6.634 -20.454 5.509 471 HG SER 88 HG SER 55 -8.476 -22.163 4.187 472 H VAL 89 H VAL 56 -10.360 -17.922 5.679 473 HA VAL 89 HA VAL 56 -8.413 -15.965 6.780 474 HB VAL 89 HB VAL 56 -8.263 -15.775 4.439 475 HG11 VAL 89 HG11 VAL 56 -10.097 -16.756 3.442 476 HG12 VAL 89 HG12 VAL 56 -11.276 -15.800 4.348 477 HG13 VAL 89 HG13 VAL 56 -10.316 -15.053 3.047 478 HG21 VAL 89 HG21 VAL 56 -9.975 -13.400 5.175 479 HG22 VAL 89 HG22 VAL 56 -8.308 -13.633 5.748 480 HG23 VAL 89 HG23 VAL 56 -8.654 -13.502 4.013 481 HA PRO 90 HA PRO 57 -12.854 -16.041 8.431 482 HB2 PRO 90 HB2 PRO 57 -12.657 -17.077 10.941 483 HB3 PRO 90 HB3 PRO 57 -12.712 -18.101 9.479 484 HG2 PRO 90 HG2 PRO 57 -10.269 -17.220 11.041 485 HG3 PRO 90 HG3 PRO 57 -10.690 -18.865 10.451 486 HD2 PRO 90 HD2 PRO 57 -8.995 -17.186 9.087 487 HD3 PRO 90 HD3 PRO 57 -10.060 -18.367 8.295 488 H ALA 91 H ALA 58 -9.863 -14.710 9.695 489 HA ALA 91 HA ALA 58 -11.161 -12.982 11.658 490 HB1 ALA 91 HB1 ALA 58 -8.320 -12.957 10.514 491 HB2 ALA 91 HB2 ALA 58 -8.888 -12.067 11.935 492 HB3 ALA 91 HB3 ALA 58 -8.855 -13.832 11.968 493 H VAL 92 H VAL 59 -10.936 -12.854 8.259 494 HA VAL 92 HA VAL 59 -11.340 -9.890 8.255 495 HB VAL 92 HB VAL 59 -9.683 -11.415 6.226 496 HG11 VAL 92 HG11 VAL 59 -10.612 -9.274 5.447 497 HG12 VAL 92 HG12 VAL 59 -9.878 -8.430 6.825 498 HG13 VAL 92 HG13 VAL 59 -8.857 -9.192 5.580 499 HG21 VAL 92 HG21 VAL 59 -8.396 -11.566 8.305 500 HG22 VAL 92 HG22 VAL 59 -7.649 -10.380 7.249 501 HG23 VAL 92 HG23 VAL 59 -8.650 -9.829 8.615 502 H VAL 93 H VAL 60 -12.287 -13.039 7.081 503 HA VAL 93 HA VAL 60 -14.317 -11.867 5.259 504 HB VAL 93 HB VAL 60 -12.199 -13.963 4.795 505 HG11 VAL 93 HG11 VAL 60 -14.180 -15.059 3.891 506 HG12 VAL 93 HG12 VAL 60 -14.569 -13.607 2.939 507 HG13 VAL 93 HG13 VAL 60 -13.104 -14.544 2.610 508 HG21 VAL 93 HG21 VAL 60 -11.454 -11.753 4.212 509 HG22 VAL 93 HG22 VAL 60 -11.792 -12.606 2.708 510 HG23 VAL 93 HG23 VAL 60 -12.956 -11.419 3.340 511 H ARG 94 H ARG 61 -15.987 -13.550 4.789 512 HA ARG 94 HA ARG 61 -16.519 -15.460 6.981 513 HB2 ARG 94 HB2 ARG 61 -17.540 -13.453 7.810 514 HB3 ARG 94 HB3 ARG 61 -18.210 -13.037 6.238 515 HG2 ARG 94 HG2 ARG 61 -19.784 -14.977 6.405 516 HG3 ARG 94 HG3 ARG 61 -19.055 -15.414 7.962 517 HD2 ARG 94 HD2 ARG 61 -21.064 -14.244 8.459 518 HD3 ARG 94 HD3 ARG 61 -19.754 -13.134 8.817 519 HE ARG 94 HE ARG 61 -20.230 -11.869 6.842 520 HH11 ARG 94 HH22 ARG 61 -22.555 -14.587 7.137 521 HH12 ARG 94 HH21 ARG 61 -23.833 -13.714 6.362 522 HH21 ARG 94 HH11 ARG 61 -22.017 -10.709 5.911 523 HH22 ARG 94 HH12 ARG 61 -23.470 -11.546 5.529 524 H ILE 95 H ILE 62 -18.114 -17.055 6.240 525 HA ILE 95 HA ILE 62 -18.964 -16.844 3.441 526 HB ILE 95 HB ILE 62 -18.249 -19.158 2.964 527 HG12 ILE 95 HG12 ILE 62 -16.649 -18.983 5.532 528 HG13 ILE 95 HG13 ILE 62 -18.022 -20.059 5.209 529 HG21 ILE 95 HG21 ILE 62 -16.008 -18.650 2.338 530 HG22 ILE 95 HG22 ILE 62 -16.846 -17.110 2.316 531 HG23 ILE 95 HG23 ILE 62 -15.795 -17.501 3.689 532 HD11 ILE 95 HD11 ILE 62 -16.015 -21.322 5.023 533 HD12 ILE 95 HD12 ILE 62 -16.702 -21.151 3.391 534 HD13 ILE 95 HD13 ILE 62 -15.294 -20.170 3.889 535 H GLU 96 H GLU 63 -20.809 -18.092 3.001 536 HA GLU 96 HA GLU 63 -22.060 -19.554 5.289 537 HB2 GLU 96 HB2 GLU 63 -23.478 -17.773 3.271 538 HB3 GLU 96 HB3 GLU 63 -24.237 -18.726 4.541 539 HG2 GLU 96 HG2 GLU 63 -22.377 -16.334 4.909 540 HG3 GLU 96 HG3 GLU 63 -24.122 -16.330 5.078 541 H ALA 97 H ALA 64 -21.520 -21.593 4.553 542 HA ALA 97 HA ALA 64 -21.930 -22.405 1.760 543 HB1 ALA 97 HB1 ALA 64 -21.369 -24.023 4.281 544 HB2 ALA 97 HB2 ALA 64 -21.428 -24.655 2.618 545 HB3 ALA 97 HB3 ALA 64 -20.169 -23.492 3.077 546 H SER 98 H SER 65 -23.898 -22.836 0.966 547 HA SER 98 HA SER 65 -26.272 -22.836 2.667 548 HB2 SER 98 HB2 SER 65 -26.290 -21.723 0.478 549 HB3 SER 98 HB3 SER 65 -25.834 -23.236 -0.330 550 HG SER 98 HG SER 65 -28.169 -22.643 -0.273 551 H ARG 99 H ARG 66 -27.708 -24.607 2.746 552 HA ARG 99 HA ARG 66 -26.565 -27.256 2.937 553 HB2 ARG 99 HB2 ARG 66 -28.748 -28.017 3.502 554 HB3 ARG 99 HB3 ARG 66 -28.447 -26.491 4.289 555 HG2 ARG 99 HG2 ARG 66 -30.577 -26.138 3.674 556 HG3 ARG 99 HG3 ARG 66 -29.827 -25.461 2.241 557 HD2 ARG 99 HD2 ARG 66 -30.491 -28.406 2.192 558 HD3 ARG 99 HD3 ARG 66 -31.861 -27.296 2.302 559 HE ARG 99 HE ARG 66 -30.331 -26.298 0.195 560 HH11 ARG 99 HH11 ARG 66 -32.028 -29.356 0.902 561 HH12 ARG 99 HH12 ARG 66 -32.329 -29.719 -0.763 562 HH21 ARG 99 HH21 ARG 66 -30.753 -26.754 -1.951 563 HH22 ARG 99 HH22 ARG 66 -31.609 -28.190 -2.441 564 H SER 100 H SER 67 -27.858 -25.430 0.241 565 HA SER 100 HA SER 67 -28.342 -27.664 -1.508 566 HB2 SER 100 HB2 SER 67 -27.646 -24.764 -2.130 567 HB3 SER 100 HB3 SER 67 -28.451 -25.924 -3.215 568 HG SER 100 HG SER 67 -29.854 -24.404 -1.971 569 H GLY 101 H GLY 68 -25.377 -26.407 -0.242 570 HA2 GLY 101 HA2 GLY 68 -23.335 -27.443 -0.582 571 HA3 GLY 101 HA3 GLY 68 -23.836 -28.015 -2.182 572 H GLU 102 H GLU 69 -24.765 -24.814 -2.194 573 HA GLU 102 HA GLU 69 -22.340 -23.868 -3.572 574 HB2 GLU 102 HB2 GLU 69 -24.977 -22.528 -2.795 575 HB3 GLU 102 HB3 GLU 69 -23.681 -21.729 -3.678 576 HG2 GLU 102 HG2 GLU 69 -25.303 -24.121 -4.639 577 HG3 GLU 102 HG3 GLU 69 -25.427 -22.461 -5.208 578 H ILE 103 H ILE 70 -21.400 -21.739 -2.743 579 HA ILE 103 HA ILE 70 -21.816 -21.203 0.083 580 HB ILE 103 HB ILE 70 -20.026 -22.600 0.435 581 HG12 ILE 103 HG12 ILE 70 -19.796 -20.223 1.389 582 HG13 ILE 103 HG13 ILE 70 -18.445 -21.338 1.504 583 HG21 ILE 103 HG21 ILE 70 -18.509 -21.531 -1.906 584 HG22 ILE 103 HG22 ILE 70 -17.842 -22.617 -0.674 585 HG23 ILE 103 HG23 ILE 70 -19.186 -23.162 -1.691 586 HD11 ILE 103 HD11 ILE 70 -17.918 -18.911 0.799 587 HD12 ILE 103 HD12 ILE 70 -17.161 -20.216 -0.126 588 HD13 ILE 103 HD13 ILE 70 -18.541 -19.328 -0.784 589 H VAL 104 H VAL 71 -21.718 -19.110 0.553 590 HA VAL 104 HA VAL 71 -21.173 -17.213 -1.678 591 HB VAL 104 HB VAL 71 -23.122 -16.799 0.634 592 HG11 VAL 104 HG11 VAL 71 -22.370 -14.809 -0.641 593 HG12 VAL 104 HG12 VAL 71 -22.939 -15.556 -2.157 594 HG13 VAL 104 HG13 VAL 71 -24.092 -15.121 -0.879 595 HG21 VAL 104 HG21 VAL 71 -24.987 -17.390 -0.926 596 HG22 VAL 104 HG22 VAL 71 -23.796 -18.059 -2.062 597 HG23 VAL 104 HG23 VAL 71 -24.014 -18.787 -0.462 598 H CYS 105 H CYS 72 -19.607 -15.742 -1.233 599 HA CYS 105 HA CYS 72 -18.299 -15.844 1.400 600 HB2 CYS 105 HB2 CYS 72 -17.411 -14.320 -1.075 601 HB3 CYS 105 HB3 CYS 72 -16.398 -14.966 0.235 602 HG CYS 105 HG CYS 72 -16.911 -17.506 -0.350 603 H TYR 106 H TYR 73 -17.798 -13.954 2.596 604 HA TYR 106 HA TYR 73 -19.096 -11.375 1.878 605 HB2 TYR 106 HB2 TYR 73 -19.492 -13.036 4.403 606 HB3 TYR 106 HB3 TYR 73 -19.960 -11.339 4.272 607 HD1 TYR 106 HD1 TYR 73 -21.660 -10.654 2.516 608 HD2 TYR 106 HD2 TYR 73 -20.899 -14.778 3.612 609 HE1 TYR 106 HE1 TYR 73 -23.932 -11.254 1.781 610 HE2 TYR 106 HE2 TYR 73 -23.135 -15.415 2.746 611 HH TYR 106 HH TYR 73 -25.203 -14.645 1.891 612 H ALA 107 H ALA 74 -18.363 -9.667 3.542 613 HA ALA 107 HA ALA 74 -15.477 -10.062 4.135 614 HB1 ALA 107 HB1 ALA 74 -17.206 -7.560 4.403 615 HB2 ALA 107 HB2 ALA 74 -15.432 -7.670 4.488 616 HB3 ALA 107 HB3 ALA 74 -16.253 -7.983 2.962 617 H VAL 108 H VAL 75 -14.700 -9.257 6.218 618 HA VAL 108 HA VAL 75 -16.680 -8.995 8.397 619 HB VAL 108 HB VAL 75 -15.000 -11.322 8.022 620 HG11 VAL 108 HG11 VAL 75 -14.607 -10.066 10.759 621 HG12 VAL 108 HG12 VAL 75 -14.104 -11.678 10.232 622 HG13 VAL 108 HG13 VAL 75 -13.350 -10.251 9.517 623 HG21 VAL 108 HG21 VAL 75 -17.422 -11.277 8.636 624 HG22 VAL 108 HG22 VAL 75 -16.448 -12.259 9.744 625 HG23 VAL 108 HG23 VAL 75 -16.982 -10.636 10.227 626 H ALA 109 H ALA 76 -13.422 -8.261 7.154 627 HA ALA 109 HA ALA 76 -13.404 -5.873 8.832 628 HB1 ALA 109 HB1 ALA 76 -11.163 -6.226 9.703 629 HB2 ALA 109 HB2 ALA 76 -12.163 -7.599 10.208 630 HB3 ALA 109 HB3 ALA 76 -11.011 -7.769 8.856 Start of MODEL 11 1 H1 GLY -2 H1 GLY -2 8.132 1.262 -1.167 2 H2 GLY -2 H2 GLY -2 7.667 0.691 -2.637 3 H3 GLY -2 H3 GLY -2 6.643 1.619 -1.755 4 HA2 GLY -2 HA2 GLY -2 7.580 -1.067 -0.999 5 HA3 GLY -2 HA3 GLY -2 6.476 -0.063 -0.048 6 H HIS -1 H HIS -1 5.861 -2.699 -0.939 7 HA HIS -1 HA HIS -1 3.365 -2.185 -2.386 8 HB2 HIS -1 HB2 HIS -1 5.061 -2.686 -4.174 9 HB3 HIS -1 HB3 HIS -1 5.370 -4.240 -3.402 10 HD2 HIS -1 HD2 HIS -1 4.086 -6.130 -4.572 11 HE1 HIS -1 HE1 HIS -1 0.597 -4.051 -5.857 12 HE2 HIS -1 HE2 HIS -1 1.809 -6.295 -5.880 13 H MET 34 H MET 1 1.935 -4.129 -2.174 14 HA MET 34 HA MET 1 2.086 -5.265 0.485 15 HB2 MET 34 HB2 MET 1 0.287 -5.853 -1.912 16 HB3 MET 34 HB3 MET 1 0.115 -6.616 -0.320 17 HG2 MET 34 HG2 MET 1 0.007 -4.282 0.643 18 HG3 MET 34 HG3 MET 1 -0.225 -3.686 -1.001 19 HE1 MET 34 HE1 MET 1 -2.169 -5.391 -2.497 20 HE2 MET 34 HE2 MET 1 -3.801 -5.403 -1.807 21 HE3 MET 34 HE3 MET 1 -3.004 -3.855 -2.162 22 H LEU 35 H LEU 2 2.281 -7.481 1.045 23 HA LEU 35 HA LEU 2 4.196 -9.068 -0.565 24 HB2 LEU 35 HB2 LEU 2 2.644 -9.735 1.991 25 HB3 LEU 35 HB3 LEU 2 3.861 -10.759 1.253 26 HG LEU 35 HG LEU 2 4.351 -7.999 2.467 27 HD11 LEU 35 HD11 LEU 2 5.133 -10.785 3.433 28 HD12 LEU 35 HD12 LEU 2 5.542 -9.244 4.216 29 HD13 LEU 35 HD13 LEU 2 3.855 -9.753 4.117 30 HD21 LEU 35 HD21 LEU 2 6.774 -8.551 2.198 31 HD22 LEU 35 HD22 LEU 2 6.328 -9.984 1.252 32 HD23 LEU 35 HD23 LEU 2 5.949 -8.352 0.653 33 H GLU 36 H GLU 3 3.461 -11.347 -1.300 34 HA GLU 36 HA GLU 3 1.193 -11.019 -2.929 35 HB2 GLU 36 HB2 GLU 3 3.009 -12.617 -3.427 36 HB3 GLU 36 HB3 GLU 3 2.480 -13.647 -2.086 37 HG2 GLU 36 HG2 GLU 3 0.342 -14.072 -3.178 38 HG3 GLU 36 HG3 GLU 3 0.721 -12.921 -4.459 39 H ALA 37 H ALA 4 1.430 -12.780 0.152 40 HA ALA 37 HA ALA 4 -1.303 -13.699 -0.064 41 HB1 ALA 37 HB1 ALA 4 0.350 -14.949 1.256 42 HB2 ALA 37 HB2 ALA 4 0.410 -13.620 2.449 43 HB3 ALA 37 HB3 ALA 4 -1.095 -14.539 2.190 44 H ASP 38 H ASP 5 0.262 -10.887 1.414 45 HA ASP 38 HA ASP 5 -2.014 -9.932 2.893 46 HB2 ASP 38 HB2 ASP 5 0.353 -9.280 3.312 47 HB3 ASP 38 HB3 ASP 5 0.376 -8.424 1.770 48 H LEU 39 H LEU 6 -0.716 -9.324 -0.384 49 HA LEU 39 HA LEU 6 -2.514 -7.328 -1.200 50 HB2 LEU 39 HB2 LEU 6 -0.459 -7.895 -2.416 51 HB3 LEU 39 HB3 LEU 6 -1.066 -9.469 -2.844 52 HG LEU 39 HG LEU 6 -2.705 -7.078 -3.695 53 HD11 LEU 39 HD11 LEU 6 -1.305 -6.777 -5.718 54 HD12 LEU 39 HD12 LEU 6 -0.393 -6.410 -4.251 55 HD13 LEU 39 HD13 LEU 6 -0.139 -7.966 -5.080 56 HD21 LEU 39 HD21 LEU 6 -2.047 -9.731 -5.048 57 HD22 LEU 39 HD22 LEU 6 -3.601 -9.247 -4.336 58 HD23 LEU 39 HD23 LEU 6 -3.021 -8.429 -5.773 59 H VAL 40 H VAL 7 -2.651 -10.869 -1.766 60 HA VAL 40 HA VAL 7 -5.151 -10.634 -3.086 61 HB VAL 40 HB VAL 7 -5.230 -13.093 -2.990 62 HG11 VAL 40 HG11 VAL 7 -3.252 -13.513 -4.287 63 HG12 VAL 40 HG12 VAL 7 -3.754 -11.856 -4.632 64 HG13 VAL 40 HG13 VAL 7 -2.393 -12.161 -3.565 65 HG21 VAL 40 HG21 VAL 7 -3.399 -14.378 -1.882 66 HG22 VAL 40 HG22 VAL 7 -2.886 -12.887 -1.114 67 HG23 VAL 40 HG23 VAL 7 -4.466 -13.561 -0.732 68 H SER 41 H SER 8 -4.385 -11.272 0.376 69 HA SER 41 HA SER 8 -7.086 -11.763 1.147 70 HB2 SER 41 HB2 SER 8 -4.805 -10.590 2.807 71 HB3 SER 41 HB3 SER 8 -6.318 -11.285 3.420 72 HG SER 41 HG SER 8 -4.119 -12.548 2.189 73 H LYS 42 H LYS 9 -5.213 -8.620 1.107 74 HA LYS 42 HA LYS 9 -7.435 -7.096 2.143 75 HB2 LYS 42 HB2 LYS 9 -4.901 -6.396 0.631 76 HB3 LYS 42 HB3 LYS 9 -6.101 -5.160 1.045 77 HG2 LYS 42 HG2 LYS 9 -5.913 -5.589 3.410 78 HG3 LYS 42 HG3 LYS 9 -4.879 -7.019 3.133 79 HD2 LYS 42 HD2 LYS 9 -3.110 -5.744 2.231 80 HD3 LYS 42 HD3 LYS 9 -4.064 -4.235 2.208 81 HE2 LYS 42 HE2 LYS 9 -4.061 -4.129 4.610 82 HE3 LYS 42 HE3 LYS 9 -3.426 -5.786 4.732 83 HZ1 LYS 42 HZ1 LYS 9 -1.372 -5.042 3.723 84 HZ2 LYS 42 HZ2 LYS 9 -1.916 -3.479 3.652 85 HZ3 LYS 42 HZ3 LYS 9 -1.668 -4.198 5.105 86 H MET 43 H MET 10 -6.384 -7.796 -1.269 87 HA MET 43 HA MET 10 -8.463 -6.075 -2.317 88 HB2 MET 43 HB2 MET 10 -6.770 -8.246 -3.601 89 HB3 MET 43 HB3 MET 10 -7.945 -7.260 -4.492 90 HG2 MET 43 HG2 MET 10 -6.767 -5.195 -3.575 91 HG3 MET 43 HG3 MET 10 -5.501 -6.266 -2.980 92 HE1 MET 43 HE1 MET 10 -4.966 -3.759 -4.762 93 HE2 MET 43 HE2 MET 10 -3.602 -4.846 -4.383 94 HE3 MET 43 HE3 MET 10 -3.892 -4.344 -6.055 95 H LEU 44 H LEU 11 -8.322 -9.643 -1.744 96 HA LEU 44 HA LEU 11 -10.906 -10.384 -2.574 97 HB2 LEU 44 HB2 LEU 11 -9.256 -12.004 -1.736 98 HB3 LEU 44 HB3 LEU 11 -9.156 -11.170 -0.197 99 HG LEU 44 HG LEU 11 -11.531 -11.822 0.284 100 HD11 LEU 44 HD11 LEU 11 -12.406 -13.746 -1.006 101 HD12 LEU 44 HD12 LEU 11 -12.244 -12.299 -2.032 102 HD13 LEU 44 HD13 LEU 11 -11.043 -13.610 -2.143 103 HD21 LEU 44 HD21 LEU 11 -9.429 -13.960 -0.101 104 HD22 LEU 44 HD22 LEU 11 -9.689 -12.964 1.334 105 HD23 LEU 44 HD23 LEU 11 -10.910 -14.164 0.861 106 H ARG 45 H ARG 12 -9.885 -9.233 0.637 107 HA ARG 45 HA ARG 12 -12.393 -8.939 1.861 108 HB2 ARG 45 HB2 ARG 12 -10.449 -8.922 3.124 109 HB3 ARG 45 HB3 ARG 12 -9.648 -7.718 2.151 110 HG2 ARG 45 HG2 ARG 12 -12.077 -6.844 3.663 111 HG3 ARG 45 HG3 ARG 12 -10.580 -7.188 4.531 112 HD2 ARG 45 HD2 ARG 12 -9.423 -5.606 2.792 113 HD3 ARG 45 HD3 ARG 12 -11.082 -5.009 2.508 114 HE ARG 45 HE ARG 12 -10.278 -5.326 5.297 115 HH11 ARG 45 HH11 ARG 12 -10.057 -2.914 2.686 116 HH12 ARG 45 HH12 ARG 12 -10.164 -1.568 3.774 117 HH21 ARG 45 HH21 ARG 12 -10.618 -3.699 6.623 118 HH22 ARG 45 HH22 ARG 12 -10.405 -2.014 6.157 119 H ALA 46 H ALA 13 -10.607 -6.474 -0.123 120 HA ALA 46 HA ALA 13 -12.549 -4.496 0.395 121 HB1 ALA 46 HB1 ALA 13 -10.661 -4.777 -2.004 122 HB2 ALA 46 HB2 ALA 13 -11.496 -3.285 -1.526 123 HB3 ALA 46 HB3 ALA 13 -10.266 -3.989 -0.457 124 H VAL 47 H VAL 14 -12.347 -6.871 -2.324 125 HA VAL 47 HA VAL 14 -14.614 -5.855 -3.756 126 HB VAL 47 HB VAL 14 -13.456 -8.675 -3.533 127 HG11 VAL 47 HG11 VAL 14 -14.631 -9.202 -5.594 128 HG12 VAL 47 HG12 VAL 14 -15.795 -8.776 -4.345 129 HG13 VAL 47 HG13 VAL 14 -15.403 -7.597 -5.614 130 HG21 VAL 47 HG21 VAL 14 -11.872 -7.076 -4.518 131 HG22 VAL 47 HG22 VAL 14 -12.518 -8.070 -5.819 132 HG23 VAL 47 HG23 VAL 14 -13.128 -6.426 -5.591 133 H LEU 48 H LEU 15 -14.306 -8.251 -1.097 134 HA LEU 48 HA LEU 15 -17.081 -8.902 -0.984 135 HB2 LEU 48 HB2 LEU 15 -14.910 -8.961 1.176 136 HB3 LEU 48 HB3 LEU 15 -16.488 -9.698 1.347 137 HG LEU 48 HG LEU 15 -14.719 -10.493 -0.996 138 HD11 LEU 48 HD11 LEU 15 -13.372 -10.750 1.029 139 HD12 LEU 48 HD12 LEU 15 -14.710 -11.574 1.848 140 HD13 LEU 48 HD13 LEU 15 -13.902 -12.345 0.461 141 HD21 LEU 48 HD21 LEU 15 -17.154 -11.176 -0.923 142 HD22 LEU 48 HD22 LEU 15 -16.000 -12.530 -0.894 143 HD23 LEU 48 HD23 LEU 15 -16.801 -12.014 0.597 144 H GLN 49 H GLN 16 -15.205 -6.285 0.646 145 HA GLN 49 HA GLN 16 -17.366 -5.436 2.334 146 HB2 GLN 49 HB2 GLN 16 -14.848 -4.073 1.307 147 HB3 GLN 49 HB3 GLN 16 -16.012 -3.218 2.307 148 HG2 GLN 49 HG2 GLN 16 -14.606 -5.786 3.161 149 HG3 GLN 49 HG3 GLN 16 -14.053 -4.166 3.552 150 HE21 GLN 49 HE22 GLN 16 -14.392 -5.682 5.724 151 HE22 GLN 49 HE21 GLN 16 -15.895 -5.298 6.555 152 H SER 50 H SER 17 -16.399 -4.454 -1.025 153 HA SER 50 HA SER 17 -18.491 -2.523 -1.313 154 HB2 SER 50 HB2 SER 17 -17.098 -4.250 -3.409 155 HB3 SER 50 HB3 SER 17 -18.059 -2.797 -3.722 156 HG SER 50 HG SER 17 -15.836 -2.274 -3.640 157 H HIS 51 H HIS 18 -18.375 -6.055 -1.777 158 HA HIS 51 HA HIS 18 -21.081 -6.065 -2.942 159 HB2 HIS 51 HB2 HIS 18 -18.902 -8.167 -2.809 160 HB3 HIS 51 HB3 HIS 18 -20.482 -8.379 -3.561 161 HD2 HIS 51 HD2 HIS 18 -18.868 -8.908 -5.747 162 HE1 HIS 51 HE1 HIS 18 -18.247 -4.838 -6.766 163 HE2 HIS 51 HE2 HIS 18 -18.088 -7.219 -7.621 164 H LYS 52 H LYS 19 -21.762 -5.437 -0.570 165 HA LYS 52 HA LYS 19 -21.640 -7.383 1.504 166 HB2 LYS 52 HB2 LYS 19 -23.613 -5.104 0.996 167 HB3 LYS 52 HB3 LYS 19 -23.612 -6.054 2.468 168 HG2 LYS 52 HG2 LYS 19 -21.284 -4.352 1.498 169 HG3 LYS 52 HG3 LYS 19 -22.461 -3.916 2.739 170 HD2 LYS 52 HD2 LYS 19 -21.707 -5.955 4.075 171 HD3 LYS 52 HD3 LYS 19 -20.453 -6.218 2.868 172 HE2 LYS 52 HE2 LYS 19 -19.419 -5.074 4.683 173 HE3 LYS 52 HE3 LYS 19 -19.516 -3.936 3.334 174 HZ1 LYS 52 HZ1 LYS 19 -21.395 -2.866 4.445 175 HZ2 LYS 52 HZ2 LYS 19 -21.372 -3.971 5.660 176 HZ3 LYS 52 HZ3 LYS 19 -20.122 -2.938 5.464 177 H ASN 53 H ASN 20 -23.793 -7.323 -1.267 178 HA ASN 53 HA ASN 20 -25.777 -9.099 -0.192 179 HB2 ASN 53 HB2 ASN 20 -26.022 -7.777 -2.309 180 HB3 ASN 53 HB3 ASN 20 -24.770 -8.778 -3.061 181 HD21 ASN 53 HD22 ASN 20 -27.980 -9.105 -1.371 182 HD22 ASN 53 HD21 ASN 20 -28.517 -10.449 -2.350 183 H GLY 54 H GLY 21 -22.443 -9.659 -0.858 184 HA2 GLY 54 HA2 GLY 21 -21.233 -11.534 -0.461 185 HA3 GLY 54 HA3 GLY 21 -22.688 -12.546 -0.446 186 H ILE 55 H ILE 22 -20.449 -13.361 -1.825 187 HA ILE 55 HA ILE 22 -21.413 -13.392 -4.623 188 HB ILE 55 HB ILE 22 -18.814 -13.323 -5.179 189 HG12 ILE 55 HG12 ILE 22 -18.885 -11.555 -2.685 190 HG13 ILE 55 HG13 ILE 22 -17.924 -13.004 -2.927 191 HG21 ILE 55 HG21 ILE 22 -20.154 -10.659 -4.667 192 HG22 ILE 55 HG22 ILE 22 -19.035 -11.154 -5.983 193 HG23 ILE 55 HG23 ILE 22 -20.685 -11.748 -5.959 194 HD11 ILE 55 HD11 ILE 22 -16.777 -11.689 -4.858 195 HD12 ILE 55 HD12 ILE 22 -17.648 -10.269 -4.250 196 HD13 ILE 55 HD13 ILE 22 -16.479 -11.084 -3.221 197 H VAL 56 H VAL 23 -21.649 -15.369 -5.270 198 HA VAL 56 HA VAL 23 -21.014 -17.625 -3.660 199 HB VAL 56 HB VAL 23 -21.695 -18.892 -5.712 200 HG11 VAL 56 HG11 VAL 23 -23.576 -16.666 -4.842 201 HG12 VAL 56 HG12 VAL 23 -24.039 -18.153 -5.695 202 HG13 VAL 56 HG13 VAL 23 -23.349 -18.259 -4.073 203 HG21 VAL 56 HG21 VAL 23 -22.164 -16.152 -6.991 204 HG22 VAL 56 HG22 VAL 23 -20.901 -17.316 -7.457 205 HG23 VAL 56 HG23 VAL 23 -22.601 -17.737 -7.657 206 H LEU 57 H LEU 24 -19.332 -19.226 -3.890 207 HA LEU 57 HA LEU 24 -16.893 -18.270 -4.263 208 HB2 LEU 57 HB2 LEU 24 -15.857 -20.298 -4.144 209 HB3 LEU 57 HB3 LEU 24 -17.268 -20.343 -3.151 210 HG LEU 57 HG LEU 24 -17.035 -21.624 -5.924 211 HD11 LEU 57 HD11 LEU 24 -16.854 -22.921 -3.178 212 HD12 LEU 57 HD12 LEU 24 -16.840 -23.769 -4.743 213 HD13 LEU 57 HD13 LEU 24 -15.523 -22.680 -4.313 214 HD21 LEU 57 HD21 LEU 24 -19.440 -21.160 -5.208 215 HD22 LEU 57 HD22 LEU 24 -19.052 -22.871 -5.420 216 HD23 LEU 57 HD23 LEU 24 -19.156 -22.180 -3.800 217 HA PRO 58 HA PRO 25 -16.044 -19.149 -8.833 218 HB2 PRO 58 HB2 PRO 25 -18.040 -19.163 -10.703 219 HB3 PRO 58 HB3 PRO 25 -17.483 -20.633 -9.856 220 HG2 PRO 58 HG2 PRO 25 -19.885 -18.920 -9.183 221 HG3 PRO 58 HG3 PRO 25 -19.794 -20.703 -9.345 222 HD2 PRO 58 HD2 PRO 25 -19.645 -19.513 -6.914 223 HD3 PRO 58 HD3 PRO 25 -18.659 -20.943 -7.318 224 H ARG 59 H ARG 26 -18.905 -17.154 -8.063 225 HA ARG 59 HA ARG 26 -18.208 -14.937 -9.794 226 HB2 ARG 59 HB2 ARG 26 -20.508 -15.464 -8.906 227 HB3 ARG 59 HB3 ARG 26 -19.960 -14.986 -7.280 228 HG2 ARG 59 HG2 ARG 26 -19.544 -12.698 -8.111 229 HG3 ARG 59 HG3 ARG 26 -19.995 -13.209 -9.749 230 HD2 ARG 59 HD2 ARG 26 -22.286 -13.724 -8.953 231 HD3 ARG 59 HD3 ARG 26 -21.841 -13.168 -7.318 232 HE ARG 59 HE ARG 26 -21.207 -11.123 -9.185 233 HH11 ARG 59 HH11 ARG 26 -24.131 -12.668 -7.856 234 HH12 ARG 59 HH12 ARG 26 -25.103 -11.245 -7.985 235 HH21 ARG 59 HH21 ARG 26 -22.523 -9.247 -9.389 236 HH22 ARG 59 HH22 ARG 26 -24.171 -9.271 -8.886 237 H LEU 60 H LEU 27 -17.416 -15.944 -6.481 238 HA LEU 60 HA LEU 27 -16.177 -13.621 -5.559 239 HB2 LEU 60 HB2 LEU 27 -16.605 -15.653 -4.170 240 HB3 LEU 60 HB3 LEU 27 -15.353 -16.539 -5.003 241 HG LEU 60 HG LEU 27 -14.714 -15.724 -2.780 242 HD11 LEU 60 HD11 LEU 27 -12.840 -14.569 -4.864 243 HD12 LEU 60 HD12 LEU 27 -12.468 -15.196 -3.273 244 HD13 LEU 60 HD13 LEU 27 -13.015 -16.320 -4.521 245 HD21 LEU 60 HD21 LEU 27 -15.828 -13.496 -2.992 246 HD22 LEU 60 HD22 LEU 27 -14.214 -13.449 -2.331 247 HD23 LEU 60 HD23 LEU 27 -14.471 -12.956 -4.019 248 H GLN 61 H GLN 28 -14.676 -16.410 -7.371 249 HA GLN 61 HA GLN 28 -12.134 -15.236 -7.723 250 HB2 GLN 61 HB2 GLN 28 -13.701 -17.260 -9.362 251 HB3 GLN 61 HB3 GLN 28 -12.205 -16.586 -9.993 252 HG2 GLN 61 HG2 GLN 28 -11.003 -17.325 -7.948 253 HG3 GLN 61 HG3 GLN 28 -12.474 -18.150 -7.405 254 HE21 GLN 61 HE22 GLN 28 -9.532 -18.570 -9.256 255 HE22 GLN 61 HE21 GLN 28 -10.024 -20.019 -10.067 256 H GLY 62 H GLY 29 -15.043 -14.895 -9.836 257 HA2 GLY 62 HA2 GLY 29 -13.820 -13.431 -11.882 258 HA3 GLY 62 HA3 GLY 29 -15.529 -13.311 -11.437 259 H GLU 63 H GLU 30 -15.646 -12.077 -9.049 260 HA GLU 63 HA GLU 30 -15.038 -9.360 -9.809 261 HB2 GLU 63 HB2 GLU 30 -16.065 -10.565 -7.195 262 HB3 GLU 63 HB3 GLU 30 -16.015 -8.833 -7.556 263 HG2 GLU 63 HG2 GLU 30 -17.622 -10.895 -9.136 264 HG3 GLU 63 HG3 GLU 30 -18.262 -9.803 -7.919 265 H TYR 64 H TYR 31 -13.606 -11.604 -7.442 266 HA TYR 64 HA TYR 31 -11.643 -9.979 -6.228 267 HB2 TYR 64 HB2 TYR 31 -11.968 -12.209 -5.451 268 HB3 TYR 64 HB3 TYR 31 -11.750 -12.888 -7.064 269 HD1 TYR 64 HD1 TYR 31 -9.931 -11.548 -4.156 270 HD2 TYR 64 HD2 TYR 31 -9.648 -13.270 -8.104 271 HE1 TYR 64 HE1 TYR 31 -7.548 -12.019 -3.768 272 HE2 TYR 64 HE2 TYR 31 -7.243 -13.675 -7.738 273 HH TYR 64 HH TYR 31 -5.554 -12.913 -4.741 274 H ARG 65 H ARG 32 -11.482 -11.863 -9.303 275 HA ARG 65 HA ARG 32 -8.849 -11.026 -9.936 276 HB2 ARG 65 HB2 ARG 32 -9.865 -13.020 -10.824 277 HB3 ARG 65 HB3 ARG 32 -11.074 -12.088 -11.732 278 HG2 ARG 65 HG2 ARG 32 -9.426 -11.150 -13.209 279 HG3 ARG 65 HG3 ARG 32 -8.102 -11.570 -12.106 280 HD2 ARG 65 HD2 ARG 32 -8.699 -13.990 -12.480 281 HD3 ARG 65 HD3 ARG 32 -9.718 -13.468 -13.838 282 HE ARG 65 HE ARG 32 -6.777 -13.211 -13.465 283 HH11 ARG 65 HH21 ARG 32 -9.517 -13.031 -15.732 284 HH12 ARG 65 HH22 ARG 32 -8.530 -12.901 -17.143 285 HH21 ARG 65 HH11 ARG 32 -5.452 -13.063 -15.367 286 HH22 ARG 65 HH12 ARG 32 -6.177 -12.952 -16.931 287 H SER 66 H SER 33 -12.069 -9.582 -10.817 288 HA SER 66 HA SER 33 -11.043 -7.673 -12.593 289 HB2 SER 66 HB2 SER 33 -13.318 -7.284 -10.596 290 HB3 SER 66 HB3 SER 33 -13.017 -6.325 -12.050 291 HG SER 66 HG SER 33 -14.567 -7.905 -12.519 292 H LEU 67 H LEU 34 -10.989 -7.670 -8.968 293 HA LEU 67 HA LEU 34 -9.735 -5.021 -9.009 294 HB2 LEU 67 HB2 LEU 34 -11.150 -5.713 -7.132 295 HB3 LEU 67 HB3 LEU 34 -9.980 -6.971 -6.705 296 HG LEU 67 HG LEU 34 -8.269 -5.288 -6.218 297 HD11 LEU 67 HD11 LEU 34 -8.859 -2.839 -6.157 298 HD12 LEU 67 HD12 LEU 34 -8.765 -3.478 -7.792 299 HD13 LEU 67 HD13 LEU 34 -10.356 -3.207 -7.044 300 HD21 LEU 67 HD21 LEU 34 -10.918 -4.529 -4.909 301 HD22 LEU 67 HD22 LEU 34 -9.898 -5.896 -4.443 302 HD23 LEU 67 HD23 LEU 34 -9.290 -4.246 -4.249 303 H THR 68 H THR 35 -8.424 -8.394 -8.319 304 HA THR 68 HA THR 35 -5.806 -7.321 -7.716 305 HB THR 68 HB THR 35 -5.201 -9.808 -7.859 306 HG1 THR 68 HG1 THR 35 -7.138 -11.169 -7.914 307 HG21 THR 68 HG21 THR 35 -5.835 -8.722 -5.733 308 HG22 THR 68 HG22 THR 35 -7.550 -9.152 -6.047 309 HG23 THR 68 HG23 THR 35 -6.309 -10.406 -5.822 310 H GLY 69 H GLY 36 -7.308 -8.681 -10.639 311 HA2 GLY 69 HA2 GLY 36 -6.516 -8.851 -12.793 312 HA3 GLY 69 HA3 GLY 36 -4.961 -8.139 -12.307 313 H ASP 70 H ASP 37 -6.307 -10.830 -10.371 314 HA ASP 70 HA ASP 37 -4.551 -12.818 -11.687 315 HB2 ASP 70 HB2 ASP 37 -3.345 -11.605 -9.752 316 HB3 ASP 70 HB3 ASP 37 -4.532 -12.348 -8.673 317 H TRP 71 H TRP 38 -5.042 -15.042 -10.741 318 HA TRP 71 HA TRP 38 -7.920 -15.373 -10.134 319 HB2 TRP 71 HB2 TRP 38 -5.704 -17.362 -10.781 320 HB3 TRP 71 HB3 TRP 38 -7.355 -17.806 -10.383 321 HD1 TRP 71 HD1 TRP 38 -5.255 -17.339 -13.261 322 HE1 TRP 71 HE1 TRP 38 -6.572 -17.052 -15.427 323 HE3 TRP 71 HE3 TRP 38 -9.853 -16.334 -11.245 324 HZ2 TRP 71 HZ2 TRP 38 -9.302 -16.355 -16.197 325 HZ3 TRP 71 HZ3 TRP 38 -11.741 -15.728 -12.708 326 HH2 TRP 71 HH2 TRP 38 -11.508 -15.782 -15.176 327 H ILE 72 H ILE 39 -8.471 -16.582 -8.200 328 HA ILE 72 HA ILE 39 -7.143 -15.884 -5.844 329 HB ILE 72 HB ILE 39 -9.041 -18.135 -6.521 330 HG12 ILE 72 HG12 ILE 39 -9.798 -15.680 -6.517 331 HG13 ILE 72 HG13 ILE 39 -10.762 -16.848 -5.628 332 HG21 ILE 72 HG21 ILE 39 -7.918 -17.545 -3.757 333 HG22 ILE 72 HG22 ILE 39 -9.395 -18.481 -4.053 334 HG23 ILE 72 HG23 ILE 39 -7.857 -19.057 -4.687 335 HD11 ILE 72 HD11 ILE 39 -10.052 -16.068 -3.524 336 HD12 ILE 72 HD12 ILE 39 -8.705 -15.118 -4.225 337 HD13 ILE 72 HD13 ILE 39 -10.388 -14.623 -4.496 338 HA PRO 73 HA PRO 40 -3.741 -18.750 -6.286 339 HB2 PRO 73 HB2 PRO 40 -2.099 -17.970 -4.312 340 HB3 PRO 73 HB3 PRO 40 -2.555 -16.842 -5.597 341 HG2 PRO 73 HG2 PRO 40 -3.919 -17.141 -2.896 342 HG3 PRO 73 HG3 PRO 40 -3.210 -15.657 -3.629 343 HD2 PRO 73 HD2 PRO 40 -5.866 -16.282 -3.858 344 HD3 PRO 73 HD3 PRO 40 -4.958 -15.507 -5.201 345 H PHE 74 H PHE 41 -6.057 -20.082 -5.270 346 HA PHE 74 HA PHE 41 -5.793 -20.903 -2.520 347 HB2 PHE 74 HB2 PHE 41 -7.538 -22.467 -2.910 348 HB3 PHE 74 HB3 PHE 41 -7.971 -20.955 -3.646 349 HD1 PHE 74 HD2 PHE 41 -7.699 -20.778 -6.282 350 HD2 PHE 74 HD1 PHE 41 -7.534 -24.490 -4.094 351 HE1 PHE 74 HE2 PHE 41 -8.170 -22.018 -8.355 352 HE2 PHE 74 HE1 PHE 41 -8.098 -25.727 -6.171 353 HZ PHE 74 HZ PHE 41 -8.410 -24.493 -8.311 354 H LYS 75 H LYS 42 -5.263 -22.829 -5.505 355 HA LYS 75 HA LYS 42 -4.015 -24.978 -4.062 356 HB2 LYS 75 HB2 LYS 42 -5.327 -24.990 -6.246 357 HB3 LYS 75 HB3 LYS 42 -3.896 -24.333 -7.046 358 HG2 LYS 75 HG2 LYS 42 -2.609 -26.356 -6.371 359 HG3 LYS 75 HG3 LYS 42 -4.023 -26.964 -5.469 360 HD2 LYS 75 HD2 LYS 42 -5.334 -27.024 -7.569 361 HD3 LYS 75 HD3 LYS 42 -3.926 -26.495 -8.493 362 HE2 LYS 75 HE2 LYS 42 -4.088 -29.052 -6.822 363 HE3 LYS 75 HE3 LYS 42 -4.389 -28.972 -8.555 364 HZ1 LYS 75 HZ1 LYS 42 -2.098 -28.225 -8.877 365 HZ2 LYS 75 HZ2 LYS 42 -1.780 -28.352 -7.271 366 HZ3 LYS 75 HZ3 LYS 42 -2.147 -29.680 -8.139 367 H GLN 76 H GLN 43 -2.903 -22.045 -5.512 368 HA GLN 76 HA GLN 43 -0.136 -22.670 -5.871 369 HB2 GLN 76 HB2 GLN 43 -1.530 -19.961 -5.617 370 HB3 GLN 76 HB3 GLN 43 0.055 -20.282 -6.299 371 HG2 GLN 76 HG2 GLN 43 -1.132 -20.082 -8.226 372 HG3 GLN 76 HG3 GLN 43 -1.268 -21.816 -8.019 373 HE21 GLN 76 HE22 GLN 43 -3.106 -19.484 -9.297 374 HE22 GLN 76 HE21 GLN 43 -4.672 -19.843 -8.580 375 H LEU 77 H LEU 44 -2.040 -21.119 -3.226 376 HA LEU 77 HA LEU 44 0.288 -20.880 -1.437 377 HB2 LEU 77 HB2 LEU 44 -2.665 -20.420 -1.062 378 HB3 LEU 77 HB3 LEU 44 -1.474 -20.261 0.227 379 HG LEU 77 HG LEU 44 -1.450 -18.641 -2.339 380 HD11 LEU 77 HD11 LEU 44 -2.277 -17.750 0.454 381 HD12 LEU 77 HD12 LEU 44 -2.268 -16.756 -1.023 382 HD13 LEU 77 HD13 LEU 44 -3.400 -18.117 -0.878 383 HD21 LEU 77 HD21 LEU 44 0.799 -18.775 -1.433 384 HD22 LEU 77 HD22 LEU 44 0.146 -17.164 -1.145 385 HD23 LEU 77 HD23 LEU 44 0.207 -18.332 0.194 386 H GLY 78 H GLY 45 -2.267 -23.255 -2.122 387 HA2 GLY 78 HA2 GLY 45 -1.487 -25.548 -1.783 388 HA3 GLY 78 HA3 GLY 45 -0.910 -25.097 -0.179 389 H TYR 79 H TYR 46 -3.958 -23.661 -1.023 390 HA TYR 79 HA TYR 46 -5.429 -25.333 0.890 391 HB2 TYR 79 HB2 TYR 46 -6.359 -23.065 -0.922 392 HB3 TYR 79 HB3 TYR 46 -7.253 -23.783 0.411 393 HD1 TYR 79 HD2 TYR 46 -6.328 -23.576 2.776 394 HD2 TYR 79 HD1 TYR 46 -4.760 -21.314 -0.540 395 HE1 TYR 79 HE2 TYR 46 -5.223 -22.054 4.343 396 HE2 TYR 79 HE1 TYR 46 -3.674 -19.748 1.017 397 HH TYR 79 HH TYR 46 -3.283 -19.200 3.293 398 HA PRO 80 HA PRO 47 -6.369 -27.979 -2.513 399 HB2 PRO 80 HB2 PRO 47 -8.619 -29.365 -1.680 400 HB3 PRO 80 HB3 PRO 47 -6.985 -29.608 -0.985 401 HG2 PRO 80 HG2 PRO 47 -9.201 -27.816 0.074 402 HG3 PRO 80 HG3 PRO 47 -8.263 -29.052 0.976 403 HD2 PRO 80 HD2 PRO 47 -7.493 -26.460 1.089 404 HD3 PRO 80 HD3 PRO 47 -6.260 -27.734 0.870 405 H THR 81 H THR 48 -9.021 -25.832 -1.422 406 HA THR 81 HA THR 48 -10.084 -25.734 -4.198 407 HB THR 81 HB THR 48 -12.361 -25.898 -3.026 408 HG1 THR 81 HG1 THR 48 -12.115 -26.999 -0.894 409 HG21 THR 81 HG21 THR 48 -10.706 -28.401 -2.545 410 HG22 THR 81 HG22 THR 48 -12.444 -28.276 -2.870 411 HG23 THR 81 HG23 THR 48 -11.287 -27.903 -4.152 412 H LEU 82 H LEU 49 -11.639 -23.917 -4.442 413 HA LEU 82 HA LEU 49 -10.702 -21.415 -3.416 414 HB2 LEU 82 HB2 LEU 49 -13.392 -22.262 -4.629 415 HB3 LEU 82 HB3 LEU 49 -13.049 -20.620 -4.157 416 HG LEU 82 HG LEU 49 -12.824 -20.778 -6.505 417 HD11 LEU 82 HD11 LEU 49 -10.047 -20.594 -5.265 418 HD12 LEU 82 HD12 LEU 49 -10.513 -19.993 -6.852 419 HD13 LEU 82 HD13 LEU 49 -11.252 -19.285 -5.390 420 HD21 LEU 82 HD21 LEU 49 -11.287 -22.187 -7.708 421 HD22 LEU 82 HD22 LEU 49 -10.644 -22.881 -6.219 422 HD23 LEU 82 HD23 LEU 49 -12.325 -23.212 -6.716 423 H GLU 83 H GLU 50 -13.392 -23.588 -2.389 424 HA GLU 83 HA GLU 50 -14.272 -21.834 -0.334 425 HB2 GLU 83 HB2 GLU 50 -15.509 -23.610 0.588 426 HB3 GLU 83 HB3 GLU 50 -15.585 -23.758 -1.166 427 HG2 GLU 83 HG2 GLU 50 -13.916 -25.573 -1.092 428 HG3 GLU 83 HG3 GLU 50 -13.811 -25.419 0.673 429 H ALA 84 H ALA 51 -11.739 -24.462 -0.210 430 HA ALA 84 HA ALA 51 -11.284 -24.194 2.574 431 HB1 ALA 84 HB1 ALA 51 -9.168 -25.342 2.127 432 HB2 ALA 84 HB2 ALA 51 -10.514 -26.110 1.263 433 HB3 ALA 84 HB3 ALA 51 -9.376 -25.065 0.384 434 H TYR 85 H TYR 52 -9.735 -22.479 -0.184 435 HA TYR 85 HA TYR 52 -7.949 -20.884 1.338 436 HB2 TYR 85 HB2 TYR 52 -7.764 -20.915 -1.025 437 HB3 TYR 85 HB3 TYR 52 -9.437 -20.440 -1.263 438 HD1 TYR 85 HD1 TYR 52 -6.153 -19.220 0.029 439 HD2 TYR 85 HD2 TYR 52 -10.075 -18.157 -1.428 440 HE1 TYR 85 HE1 TYR 52 -5.472 -16.852 0.031 441 HE2 TYR 85 HE2 TYR 52 -9.426 -15.772 -1.413 442 HH TYR 85 HH TYR 52 -6.178 -14.653 -0.314 443 H LEU 86 H LEU 53 -11.412 -20.257 0.446 444 HA LEU 86 HA LEU 53 -11.540 -17.800 1.885 445 HB2 LEU 86 HB2 LEU 53 -13.689 -19.732 0.953 446 HB3 LEU 86 HB3 LEU 53 -14.022 -18.118 1.596 447 HG LEU 86 HG LEU 53 -12.179 -18.429 -0.784 448 HD11 LEU 86 HD11 LEU 53 -14.190 -18.045 -2.230 449 HD12 LEU 86 HD12 LEU 53 -14.123 -19.637 -1.479 450 HD13 LEU 86 HD13 LEU 53 -15.201 -18.432 -0.792 451 HD21 LEU 86 HD21 LEU 53 -14.064 -16.201 0.094 452 HD22 LEU 86 HD22 LEU 53 -12.313 -16.250 0.421 453 HD23 LEU 86 HD23 LEU 53 -12.885 -16.167 -1.246 454 H ARG 87 H ARG 54 -12.266 -21.139 2.965 455 HA ARG 87 HA ARG 54 -13.250 -20.526 5.605 456 HB2 ARG 87 HB2 ARG 54 -11.582 -22.877 4.573 457 HB3 ARG 87 HB3 ARG 54 -11.890 -22.674 6.271 458 HG2 ARG 87 HG2 ARG 54 -13.417 -24.264 5.638 459 HG3 ARG 87 HG3 ARG 54 -14.361 -22.776 5.831 460 HD2 ARG 87 HD2 ARG 54 -14.565 -22.545 3.404 461 HD3 ARG 87 HD3 ARG 54 -13.239 -23.684 3.190 462 HE ARG 87 HE ARG 54 -14.676 -25.267 2.856 463 HH11 ARG 87 HH22 ARG 54 -16.138 -23.511 5.614 464 HH12 ARG 87 HH21 ARG 54 -17.548 -24.504 5.622 465 HH21 ARG 87 HH11 ARG 54 -16.586 -26.374 2.763 466 HH22 ARG 87 HH12 ARG 54 -17.771 -26.243 4.039 467 H SER 88 H SER 55 -9.951 -20.600 4.286 468 HA SER 88 HA SER 55 -8.682 -20.462 6.853 469 HB2 SER 88 HB2 SER 55 -7.524 -20.209 4.063 470 HB3 SER 88 HB3 SER 55 -6.632 -20.495 5.568 471 HG SER 88 HG SER 55 -8.486 -22.200 4.250 472 H VAL 89 H VAL 56 -10.351 -17.951 5.695 473 HA VAL 89 HA VAL 56 -8.406 -15.991 6.807 474 HB VAL 89 HB VAL 56 -8.242 -15.802 4.455 475 HG11 VAL 89 HG11 VAL 56 -10.301 -15.102 3.048 476 HG12 VAL 89 HG12 VAL 56 -10.080 -16.797 3.470 477 HG13 VAL 89 HG13 VAL 56 -11.253 -15.826 4.366 478 HG21 VAL 89 HG21 VAL 56 -9.962 -13.440 5.188 479 HG22 VAL 89 HG22 VAL 56 -8.290 -13.667 5.751 480 HG23 VAL 89 HG23 VAL 56 -8.637 -13.536 4.016 481 HA PRO 90 HA PRO 57 -12.850 -16.087 8.446 482 HB2 PRO 90 HB2 PRO 57 -12.643 -17.089 10.962 483 HB3 PRO 90 HB3 PRO 57 -12.673 -18.138 9.506 484 HG2 PRO 90 HG2 PRO 57 -10.257 -17.205 11.071 485 HG3 PRO 90 HG3 PRO 57 -10.653 -18.857 10.500 486 HD2 PRO 90 HD2 PRO 57 -8.977 -17.162 9.115 487 HD3 PRO 90 HD3 PRO 57 -10.015 -18.379 8.335 488 H ALA 91 H ALA 58 -9.865 -14.721 9.708 489 HA ALA 91 HA ALA 58 -11.167 -12.990 11.656 490 HB1 ALA 91 HB1 ALA 58 -8.340 -12.958 10.491 491 HB2 ALA 91 HB2 ALA 58 -8.901 -12.063 11.919 492 HB3 ALA 91 HB3 ALA 58 -8.857 -13.832 11.955 493 H VAL 92 H VAL 59 -10.947 -12.876 8.248 494 HA VAL 92 HA VAL 59 -11.367 -9.912 8.243 495 HB VAL 92 HB VAL 59 -9.662 -11.445 6.253 496 HG11 VAL 92 HG11 VAL 59 -8.875 -9.221 5.549 497 HG12 VAL 92 HG12 VAL 59 -10.630 -9.363 5.376 498 HG13 VAL 92 HG13 VAL 59 -9.956 -8.452 6.738 499 HG21 VAL 92 HG21 VAL 59 -8.405 -11.508 8.335 500 HG22 VAL 92 HG22 VAL 59 -7.683 -10.313 7.266 501 HG23 VAL 92 HG23 VAL 59 -8.710 -9.774 8.610 502 H VAL 93 H VAL 60 -12.263 -13.077 7.037 503 HA VAL 93 HA VAL 60 -14.326 -11.926 5.249 504 HB VAL 93 HB VAL 60 -12.169 -13.976 4.747 505 HG11 VAL 93 HG11 VAL 60 -14.132 -15.089 3.848 506 HG12 VAL 93 HG12 VAL 60 -14.569 -13.635 2.919 507 HG13 VAL 93 HG13 VAL 60 -13.093 -14.535 2.547 508 HG21 VAL 93 HG21 VAL 60 -11.814 -12.568 2.668 509 HG22 VAL 93 HG22 VAL 60 -12.961 -11.404 3.369 510 HG23 VAL 93 HG23 VAL 60 -11.442 -11.777 4.190 511 H ARG 94 H ARG 61 -15.973 -13.626 4.793 512 HA ARG 94 HA ARG 61 -16.472 -15.510 7.023 513 HB2 ARG 94 HB2 ARG 61 -17.372 -13.552 7.949 514 HB3 ARG 94 HB3 ARG 61 -17.973 -12.944 6.409 515 HG2 ARG 94 HG2 ARG 61 -19.823 -14.535 6.442 516 HG3 ARG 94 HG3 ARG 61 -19.139 -15.371 7.852 517 HD2 ARG 94 HD2 ARG 61 -21.045 -13.866 8.421 518 HD3 ARG 94 HD3 ARG 61 -19.541 -13.485 9.276 519 HE ARG 94 HE ARG 61 -19.921 -11.941 6.822 520 HH11 ARG 94 HH11 ARG 61 -21.170 -12.043 10.124 521 HH12 ARG 94 HH12 ARG 61 -21.129 -10.332 10.355 522 HH21 ARG 94 HH21 ARG 61 -19.525 -9.682 7.251 523 HH22 ARG 94 HH22 ARG 61 -20.349 -8.946 8.591 524 H ILE 95 H ILE 62 -18.185 -17.058 6.341 525 HA ILE 95 HA ILE 62 -19.022 -16.881 3.522 526 HB ILE 95 HB ILE 62 -18.284 -19.185 3.081 527 HG12 ILE 95 HG12 ILE 62 -16.686 -18.973 5.651 528 HG13 ILE 95 HG13 ILE 62 -18.056 -20.047 5.352 529 HG21 ILE 95 HG21 ILE 62 -16.047 -18.681 2.452 530 HG22 ILE 95 HG22 ILE 62 -16.897 -17.154 2.392 531 HG23 ILE 95 HG23 ILE 62 -15.842 -17.504 3.773 532 HD11 ILE 95 HD11 ILE 62 -15.331 -20.185 4.006 533 HD12 ILE 95 HD12 ILE 62 -16.045 -21.316 5.164 534 HD13 ILE 95 HD13 ILE 62 -16.744 -21.171 3.545 535 H GLU 96 H GLU 63 -20.826 -18.150 3.036 536 HA GLU 96 HA GLU 63 -22.071 -19.694 5.259 537 HB2 GLU 96 HB2 GLU 63 -23.401 -17.731 3.349 538 HB3 GLU 96 HB3 GLU 63 -24.291 -18.906 4.304 539 HG2 GLU 96 HG2 GLU 63 -22.546 -16.667 5.421 540 HG3 GLU 96 HG3 GLU 63 -24.301 -16.665 5.316 541 H ALA 97 H ALA 64 -21.582 -21.701 4.517 542 HA ALA 97 HA ALA 64 -21.935 -22.491 1.712 543 HB1 ALA 97 HB1 ALA 64 -21.515 -24.752 2.564 544 HB2 ALA 97 HB2 ALA 64 -20.249 -23.625 3.093 545 HB3 ALA 97 HB3 ALA 64 -21.515 -24.141 4.235 546 H SER 98 H SER 65 -23.891 -22.772 0.874 547 HA SER 98 HA SER 65 -26.308 -22.703 2.487 548 HB2 SER 98 HB2 SER 65 -26.145 -21.512 0.338 549 HB3 SER 98 HB3 SER 65 -25.804 -23.032 -0.505 550 HG SER 98 HG SER 65 -28.056 -22.262 -0.545 551 H ARG 99 H ARG 66 -27.894 -24.324 2.385 552 HA ARG 99 HA ARG 66 -27.059 -27.067 2.629 553 HB2 ARG 99 HB2 ARG 66 -29.498 -27.579 2.687 554 HB3 ARG 99 HB3 ARG 66 -28.938 -26.406 3.857 555 HG2 ARG 99 HG2 ARG 66 -31.073 -25.713 3.112 556 HG3 ARG 99 HG3 ARG 66 -29.905 -24.549 2.539 557 HD2 ARG 99 HD2 ARG 66 -31.642 -24.969 0.880 558 HD3 ARG 99 HD3 ARG 66 -30.075 -25.447 0.263 559 HE ARG 99 HE ARG 66 -31.678 -27.566 1.554 560 HH11 ARG 99 HH11 ARG 66 -30.715 -26.100 -1.573 561 HH12 ARG 99 HH12 ARG 66 -31.350 -27.412 -2.506 562 HH21 ARG 99 HH21 ARG 66 -32.452 -29.302 0.290 563 HH22 ARG 99 HH22 ARG 66 -32.294 -29.287 -1.428 564 H SER 100 H SER 67 -27.798 -25.148 -0.186 565 HA SER 100 HA SER 67 -28.378 -27.353 -1.949 566 HB2 SER 100 HB2 SER 67 -27.350 -24.561 -2.586 567 HB3 SER 100 HB3 SER 67 -28.215 -25.665 -3.678 568 HG SER 100 HG SER 67 -29.573 -24.025 -2.667 569 H GLY 101 H GLY 68 -25.443 -26.603 -0.382 570 HA2 GLY 101 HA2 GLY 68 -23.361 -27.488 -0.684 571 HA3 GLY 101 HA3 GLY 68 -23.918 -28.363 -2.125 572 H GLU 102 H GLU 69 -24.102 -24.860 -1.493 573 HA GLU 102 HA GLU 69 -21.899 -24.257 -3.366 574 HB2 GLU 102 HB2 GLU 69 -24.618 -22.860 -3.253 575 HB3 GLU 102 HB3 GLU 69 -23.198 -22.240 -4.106 576 HG2 GLU 102 HG2 GLU 69 -23.182 -24.282 -5.536 577 HG3 GLU 102 HG3 GLU 69 -24.645 -24.854 -4.728 578 H ILE 103 H ILE 70 -21.155 -21.886 -2.737 579 HA ILE 103 HA ILE 70 -21.768 -21.255 0.056 580 HB ILE 103 HB ILE 70 -19.978 -22.601 0.512 581 HG12 ILE 103 HG12 ILE 70 -19.812 -20.214 1.414 582 HG13 ILE 103 HG13 ILE 70 -18.463 -21.307 1.620 583 HG21 ILE 103 HG21 ILE 70 -19.050 -23.192 -1.592 584 HG22 ILE 103 HG22 ILE 70 -18.338 -21.569 -1.772 585 HG23 ILE 103 HG23 ILE 70 -17.768 -22.663 -0.503 586 HD11 ILE 103 HD11 ILE 70 -18.488 -19.335 -0.703 587 HD12 ILE 103 HD12 ILE 70 -17.921 -18.892 0.895 588 HD13 ILE 103 HD13 ILE 70 -17.117 -20.204 0.017 589 H VAL 104 H VAL 71 -21.809 -19.215 0.515 590 HA VAL 104 HA VAL 71 -21.250 -17.243 -1.640 591 HB VAL 104 HB VAL 71 -23.048 -16.916 0.801 592 HG11 VAL 104 HG11 VAL 71 -24.061 -15.103 -0.560 593 HG12 VAL 104 HG12 VAL 71 -22.339 -14.827 -0.297 594 HG13 VAL 104 HG13 VAL 71 -22.910 -15.442 -1.871 595 HG21 VAL 104 HG21 VAL 71 -25.011 -17.322 -0.665 596 HG22 VAL 104 HG22 VAL 71 -23.925 -17.856 -1.958 597 HG23 VAL 104 HG23 VAL 71 -24.047 -18.779 -0.442 598 H CYS 105 H CYS 72 -19.814 -15.608 -1.145 599 HA CYS 105 HA CYS 72 -18.330 -15.876 1.416 600 HB2 CYS 105 HB2 CYS 72 -17.422 -14.377 -1.069 601 HB3 CYS 105 HB3 CYS 72 -16.420 -15.096 0.213 602 HG CYS 105 HG CYS 72 -18.211 -16.488 -2.221 603 H TYR 106 H TYR 73 -17.825 -13.999 2.633 604 HA TYR 106 HA TYR 73 -19.085 -11.399 1.922 605 HB2 TYR 106 HB2 TYR 73 -19.442 -13.008 4.489 606 HB3 TYR 106 HB3 TYR 73 -19.926 -11.327 4.309 607 HD1 TYR 106 HD1 TYR 73 -21.636 -10.703 2.508 608 HD2 TYR 106 HD2 TYR 73 -20.895 -14.770 3.803 609 HE1 TYR 106 HE1 TYR 73 -23.921 -11.333 1.829 610 HE2 TYR 106 HE2 TYR 73 -23.129 -15.434 3.020 611 HH TYR 106 HH TYR 73 -25.211 -14.698 2.144 612 H ALA 107 H ALA 74 -18.350 -9.705 3.570 613 HA ALA 107 HA ALA 74 -15.460 -10.104 4.188 614 HB1 ALA 107 HB1 ALA 74 -17.164 -7.580 4.364 615 HB2 ALA 107 HB2 ALA 74 -15.392 -7.708 4.498 616 HB3 ALA 107 HB3 ALA 74 -16.181 -8.033 2.960 617 H VAL 108 H VAL 75 -14.693 -9.325 6.256 618 HA VAL 108 HA VAL 75 -16.685 -8.993 8.421 619 HB VAL 108 HB VAL 75 -15.023 -11.343 8.050 620 HG11 VAL 108 HG11 VAL 75 -13.370 -10.267 9.558 621 HG12 VAL 108 HG12 VAL 75 -14.641 -10.085 10.789 622 HG13 VAL 108 HG13 VAL 75 -14.133 -11.698 10.263 623 HG21 VAL 108 HG21 VAL 75 -17.425 -11.295 8.620 624 HG22 VAL 108 HG22 VAL 75 -16.479 -12.250 9.788 625 HG23 VAL 108 HG23 VAL 75 -17.040 -10.616 10.206 626 H ALA 109 H ALA 76 -13.434 -8.273 7.154 627 HA ALA 109 HA ALA 76 -13.375 -5.901 8.850 628 HB1 ALA 109 HB1 ALA 76 -12.148 -7.655 10.211 629 HB2 ALA 109 HB2 ALA 76 -11.012 -7.828 8.847 630 HB3 ALA 109 HB3 ALA 76 -11.142 -6.288 9.707 Start of MODEL 12 1 H1 GLY -2 H1 GLY -2 6.695 0.782 1.555 2 H2 GLY -2 H2 GLY -2 5.190 1.047 0.955 3 H3 GLY -2 H3 GLY -2 5.454 -0.220 1.961 4 HA2 GLY -2 HA2 GLY -2 6.609 0.082 -0.732 5 HA3 GLY -2 HA3 GLY -2 6.889 -1.285 0.359 6 H HIS -1 H HIS -1 6.033 -2.093 -1.972 7 HA HIS -1 HA HIS -1 3.170 -2.149 -2.379 8 HB2 HIS -1 HB2 HIS -1 4.902 -2.533 -4.138 9 HB3 HIS -1 HB3 HIS -1 5.290 -4.081 -3.367 10 HD2 HIS -1 HD2 HIS -1 4.184 -5.970 -4.704 11 HE1 HIS -1 HE1 HIS -1 0.494 -4.130 -5.791 12 HE2 HIS -1 HE2 HIS -1 1.889 -6.261 -5.967 13 H MET 34 H MET 1 1.789 -4.055 -2.136 14 HA MET 34 HA MET 1 1.985 -5.284 0.474 15 HB2 MET 34 HB2 MET 1 0.193 -5.855 -1.928 16 HB3 MET 34 HB3 MET 1 0.029 -6.636 -0.345 17 HG2 MET 34 HG2 MET 1 -0.185 -4.339 0.659 18 HG3 MET 34 HG3 MET 1 -0.316 -3.681 -0.972 19 HE1 MET 34 HE1 MET 1 -3.009 -3.848 -2.358 20 HE2 MET 34 HE2 MET 1 -2.076 -5.333 -2.631 21 HE3 MET 34 HE3 MET 1 -3.768 -5.440 -2.100 22 H LEU 35 H LEU 2 2.344 -7.480 0.983 23 HA LEU 35 HA LEU 2 4.200 -8.984 -0.758 24 HB2 LEU 35 HB2 LEU 2 2.875 -9.556 1.946 25 HB3 LEU 35 HB3 LEU 2 3.765 -10.776 1.065 26 HG LEU 35 HG LEU 2 5.130 -9.872 2.803 27 HD11 LEU 35 HD11 LEU 2 6.230 -10.598 0.694 28 HD12 LEU 35 HD12 LEU 2 6.234 -8.908 0.130 29 HD13 LEU 35 HD13 LEU 2 7.149 -9.375 1.576 30 HD21 LEU 35 HD21 LEU 2 4.160 -7.591 2.961 31 HD22 LEU 35 HD22 LEU 2 5.928 -7.612 2.930 32 HD23 LEU 35 HD23 LEU 2 5.031 -7.136 1.477 33 H GLU 36 H GLU 3 3.498 -11.309 -1.433 34 HA GLU 36 HA GLU 3 1.216 -11.019 -3.036 35 HB2 GLU 36 HB2 GLU 3 3.026 -12.612 -3.532 36 HB3 GLU 36 HB3 GLU 3 2.526 -13.629 -2.165 37 HG2 GLU 36 HG2 GLU 3 0.390 -14.111 -3.227 38 HG3 GLU 36 HG3 GLU 3 0.738 -12.962 -4.526 39 H ALA 37 H ALA 4 1.465 -12.769 0.050 40 HA ALA 37 HA ALA 4 -1.264 -13.687 -0.144 41 HB1 ALA 37 HB1 ALA 4 -1.043 -14.512 2.120 42 HB2 ALA 37 HB2 ALA 4 0.389 -14.934 1.175 43 HB3 ALA 37 HB3 ALA 4 0.468 -13.592 2.352 44 H ASP 38 H ASP 5 0.304 -10.882 1.336 45 HA ASP 38 HA ASP 5 -1.971 -9.893 2.798 46 HB2 ASP 38 HB2 ASP 5 0.377 -9.237 3.224 47 HB3 ASP 38 HB3 ASP 5 0.447 -8.448 1.644 48 H LEU 39 H LEU 6 -0.695 -9.328 -0.513 49 HA LEU 39 HA LEU 6 -2.476 -7.317 -1.306 50 HB2 LEU 39 HB2 LEU 6 -0.439 -7.919 -2.544 51 HB3 LEU 39 HB3 LEU 6 -1.097 -9.478 -2.967 52 HG LEU 39 HG LEU 6 -2.702 -7.068 -3.801 53 HD11 LEU 39 HD11 LEU 6 -1.336 -6.734 -5.813 54 HD12 LEU 39 HD12 LEU 6 -0.391 -6.410 -4.352 55 HD13 LEU 39 HD13 LEU 6 -0.165 -7.940 -5.239 56 HD21 LEU 39 HD21 LEU 6 -2.061 -9.712 -5.171 57 HD22 LEU 39 HD22 LEU 6 -3.609 -9.230 -4.433 58 HD23 LEU 39 HD23 LEU 6 -3.042 -8.406 -5.868 59 H VAL 40 H VAL 7 -2.651 -10.855 -1.864 60 HA VAL 40 HA VAL 7 -5.153 -10.611 -3.170 61 HB VAL 40 HB VAL 7 -5.221 -13.083 -3.064 62 HG11 VAL 40 HG11 VAL 7 -2.388 -12.101 -3.633 63 HG12 VAL 40 HG12 VAL 7 -3.226 -13.477 -4.358 64 HG13 VAL 40 HG13 VAL 7 -3.769 -11.837 -4.703 65 HG21 VAL 40 HG21 VAL 7 -4.444 -13.515 -0.799 66 HG22 VAL 40 HG22 VAL 7 -3.411 -14.355 -1.951 67 HG23 VAL 40 HG23 VAL 7 -2.863 -12.856 -1.205 68 H SER 41 H SER 8 -4.342 -11.219 0.285 69 HA SER 41 HA SER 8 -7.022 -11.719 1.092 70 HB2 SER 41 HB2 SER 8 -4.732 -10.535 2.729 71 HB3 SER 41 HB3 SER 8 -6.231 -11.238 3.361 72 HG SER 41 HG SER 8 -4.052 -12.496 2.095 73 H LYS 42 H LYS 9 -5.169 -8.572 1.022 74 HA LYS 42 HA LYS 9 -7.386 -7.052 2.111 75 HB2 LYS 42 HB2 LYS 9 -4.840 -6.345 0.605 76 HB3 LYS 42 HB3 LYS 9 -6.070 -5.118 0.994 77 HG2 LYS 42 HG2 LYS 9 -5.932 -5.610 3.367 78 HG3 LYS 42 HG3 LYS 9 -4.761 -6.925 3.068 79 HD2 LYS 42 HD2 LYS 9 -3.066 -5.432 2.344 80 HD3 LYS 42 HD3 LYS 9 -4.195 -4.079 2.186 81 HE2 LYS 42 HE2 LYS 9 -2.746 -3.803 4.111 82 HE3 LYS 42 HE3 LYS 9 -4.443 -3.906 4.592 83 HZ1 LYS 42 HZ1 LYS 9 -4.060 -6.151 5.360 84 HZ2 LYS 42 HZ2 LYS 9 -2.558 -6.210 4.703 85 HZ3 LYS 42 HZ3 LYS 9 -2.867 -5.227 5.989 86 H MET 43 H MET 10 -6.364 -7.742 -1.321 87 HA MET 43 HA MET 10 -8.484 -6.075 -2.354 88 HB2 MET 43 HB2 MET 10 -6.800 -8.252 -3.645 89 HB3 MET 43 HB3 MET 10 -7.995 -7.282 -4.518 90 HG2 MET 43 HG2 MET 10 -6.801 -5.199 -3.637 91 HG3 MET 43 HG3 MET 10 -5.511 -6.267 -3.083 92 HE1 MET 43 HE1 MET 10 -3.988 -4.330 -6.184 93 HE2 MET 43 HE2 MET 10 -5.006 -3.765 -4.831 94 HE3 MET 43 HE3 MET 10 -3.635 -4.872 -4.540 95 H LEU 44 H LEU 11 -8.306 -9.637 -1.762 96 HA LEU 44 HA LEU 11 -10.893 -10.400 -2.537 97 HB2 LEU 44 HB2 LEU 11 -9.225 -11.999 -1.693 98 HB3 LEU 44 HB3 LEU 11 -9.128 -11.152 -0.157 99 HG LEU 44 HG LEU 11 -11.506 -11.809 0.324 100 HD11 LEU 44 HD11 LEU 11 -10.988 -13.619 -2.080 101 HD12 LEU 44 HD12 LEU 11 -12.359 -13.759 -0.955 102 HD13 LEU 44 HD13 LEU 11 -12.205 -12.318 -1.996 103 HD21 LEU 44 HD21 LEU 11 -9.395 -13.938 -0.024 104 HD22 LEU 44 HD22 LEU 11 -9.673 -12.932 1.401 105 HD23 LEU 44 HD23 LEU 11 -10.880 -14.144 0.926 106 H ARG 45 H ARG 12 -9.856 -9.207 0.655 107 HA ARG 45 HA ARG 12 -12.365 -8.931 1.878 108 HB2 ARG 45 HB2 ARG 12 -10.423 -8.901 3.144 109 HB3 ARG 45 HB3 ARG 12 -9.634 -7.681 2.192 110 HG2 ARG 45 HG2 ARG 12 -12.099 -6.894 3.718 111 HG3 ARG 45 HG3 ARG 12 -10.568 -7.154 4.559 112 HD2 ARG 45 HD2 ARG 12 -9.534 -5.519 2.781 113 HD3 ARG 45 HD3 ARG 12 -11.227 -5.019 2.541 114 HE ARG 45 HE ARG 12 -10.213 -5.254 5.285 115 HH11 ARG 45 HH21 ARG 12 -10.479 -2.844 2.693 116 HH12 ARG 45 HH22 ARG 12 -10.789 -1.539 3.777 117 HH21 ARG 45 HH11 ARG 12 -10.897 -3.676 6.642 118 HH22 ARG 45 HH12 ARG 12 -10.921 -1.993 6.148 119 H ALA 46 H ALA 13 -10.611 -6.472 -0.136 120 HA ALA 46 HA ALA 13 -12.588 -4.521 0.408 121 HB1 ALA 46 HB1 ALA 13 -11.521 -3.258 -1.467 122 HB2 ALA 46 HB2 ALA 13 -10.283 -3.982 -0.419 123 HB3 ALA 46 HB3 ALA 13 -10.665 -4.730 -1.980 124 H VAL 47 H VAL 14 -12.343 -6.906 -2.288 125 HA VAL 47 HA VAL 14 -14.629 -5.906 -3.727 126 HB VAL 47 HB VAL 14 -13.450 -8.713 -3.509 127 HG11 VAL 47 HG11 VAL 14 -15.792 -8.822 -4.328 128 HG12 VAL 47 HG12 VAL 14 -15.407 -7.627 -5.577 129 HG13 VAL 47 HG13 VAL 14 -14.626 -9.232 -5.582 130 HG21 VAL 47 HG21 VAL 14 -11.874 -7.097 -4.498 131 HG22 VAL 47 HG22 VAL 14 -12.507 -8.120 -5.772 132 HG23 VAL 47 HG23 VAL 14 -13.133 -6.478 -5.580 133 H LEU 48 H LEU 15 -14.291 -8.294 -1.042 134 HA LEU 48 HA LEU 15 -17.064 -8.937 -0.935 135 HB2 LEU 48 HB2 LEU 15 -14.899 -9.000 1.232 136 HB3 LEU 48 HB3 LEU 15 -16.476 -9.733 1.395 137 HG LEU 48 HG LEU 15 -14.698 -10.523 -0.948 138 HD11 LEU 48 HD11 LEU 15 -14.699 -11.619 1.891 139 HD12 LEU 48 HD12 LEU 15 -13.881 -12.376 0.509 140 HD13 LEU 48 HD13 LEU 15 -13.367 -10.772 1.082 141 HD21 LEU 48 HD21 LEU 15 -17.129 -11.202 -0.887 142 HD22 LEU 48 HD22 LEU 15 -15.977 -12.558 -0.859 143 HD23 LEU 48 HD23 LEU 15 -16.778 -12.056 0.631 144 H GLN 49 H GLN 16 -15.202 -6.355 0.770 145 HA GLN 49 HA GLN 16 -17.393 -5.442 2.381 146 HB2 GLN 49 HB2 GLN 16 -14.843 -4.105 1.371 147 HB3 GLN 49 HB3 GLN 16 -16.004 -3.265 2.386 148 HG2 GLN 49 HG2 GLN 16 -14.590 -5.838 3.207 149 HG3 GLN 49 HG3 GLN 16 -14.040 -4.229 3.617 150 HE21 GLN 49 HE22 GLN 16 -14.362 -5.747 5.774 151 HE22 GLN 49 HE21 GLN 16 -15.861 -5.387 6.616 152 H SER 50 H SER 17 -16.350 -4.673 -0.968 153 HA SER 50 HA SER 17 -18.286 -2.576 -1.379 154 HB2 SER 50 HB2 SER 17 -16.959 -4.419 -3.412 155 HB3 SER 50 HB3 SER 17 -17.768 -2.886 -3.743 156 HG SER 50 HG SER 17 -15.360 -3.300 -2.256 157 H HIS 51 H HIS 18 -18.344 -6.117 -1.711 158 HA HIS 51 HA HIS 18 -21.036 -6.057 -2.940 159 HB2 HIS 51 HB2 HIS 18 -18.889 -8.186 -2.830 160 HB3 HIS 51 HB3 HIS 18 -20.475 -8.363 -3.582 161 HD2 HIS 51 HD2 HIS 18 -18.855 -8.924 -5.753 162 HE1 HIS 51 HE1 HIS 18 -18.175 -4.864 -6.778 163 HE2 HIS 51 HE2 HIS 18 -18.055 -7.244 -7.632 164 H LYS 52 H LYS 19 -21.655 -5.445 -0.537 165 HA LYS 52 HA LYS 19 -21.546 -7.350 1.545 166 HB2 LYS 52 HB2 LYS 19 -23.564 -5.158 0.910 167 HB3 LYS 52 HB3 LYS 19 -23.614 -6.079 2.405 168 HG2 LYS 52 HG2 LYS 19 -21.286 -4.317 1.526 169 HG3 LYS 52 HG3 LYS 19 -22.523 -3.906 2.718 170 HD2 LYS 52 HD2 LYS 19 -21.774 -5.897 4.103 171 HD3 LYS 52 HD3 LYS 19 -20.477 -6.156 2.941 172 HE2 LYS 52 HE2 LYS 19 -19.502 -4.975 4.754 173 HE3 LYS 52 HE3 LYS 19 -19.606 -3.844 3.404 174 HZ1 LYS 52 HZ1 LYS 19 -21.518 -3.943 5.684 175 HZ2 LYS 52 HZ2 LYS 19 -20.301 -2.868 5.531 176 HZ3 LYS 52 HZ3 LYS 19 -21.536 -2.832 4.473 177 H ASN 53 H ASN 20 -23.750 -7.272 -1.170 178 HA ASN 53 HA ASN 20 -25.729 -9.091 -0.252 179 HB2 ASN 53 HB2 ASN 20 -25.948 -7.912 -2.376 180 HB3 ASN 53 HB3 ASN 20 -24.424 -8.580 -2.972 181 HD21 ASN 53 HD22 ASN 20 -24.333 -10.818 -3.644 182 HD22 ASN 53 HD21 ASN 20 -25.813 -11.647 -4.081 183 H GLY 54 H GLY 21 -22.338 -9.664 -0.844 184 HA2 GLY 54 HA2 GLY 21 -21.131 -11.526 -0.435 185 HA3 GLY 54 HA3 GLY 21 -22.588 -12.545 -0.356 186 H ILE 55 H ILE 22 -20.425 -13.398 -1.795 187 HA ILE 55 HA ILE 22 -21.430 -13.408 -4.585 188 HB ILE 55 HB ILE 22 -18.824 -13.343 -5.154 189 HG12 ILE 55 HG12 ILE 22 -18.878 -11.591 -2.640 190 HG13 ILE 55 HG13 ILE 22 -17.915 -13.039 -2.905 191 HG21 ILE 55 HG21 ILE 22 -20.152 -10.675 -4.614 192 HG22 ILE 55 HG22 ILE 22 -19.040 -11.171 -5.938 193 HG23 ILE 55 HG23 ILE 22 -20.710 -11.753 -5.907 194 HD11 ILE 55 HD11 ILE 22 -16.790 -11.692 -4.839 195 HD12 ILE 55 HD12 ILE 22 -17.652 -10.284 -4.198 196 HD13 ILE 55 HD13 ILE 22 -16.477 -11.115 -3.189 197 H VAL 56 H VAL 23 -21.646 -15.390 -5.250 198 HA VAL 56 HA VAL 23 -21.013 -17.650 -3.636 199 HB VAL 56 HB VAL 23 -21.673 -18.920 -5.689 200 HG11 VAL 56 HG11 VAL 23 -24.027 -18.179 -5.678 201 HG12 VAL 56 HG12 VAL 23 -23.346 -18.309 -4.057 202 HG13 VAL 56 HG13 VAL 23 -23.568 -16.703 -4.797 203 HG21 VAL 56 HG21 VAL 23 -20.881 -17.349 -7.431 204 HG22 VAL 56 HG22 VAL 23 -22.581 -17.771 -7.636 205 HG23 VAL 56 HG23 VAL 23 -22.142 -16.187 -6.975 206 H LEU 57 H LEU 24 -19.308 -19.244 -3.852 207 HA LEU 57 HA LEU 24 -16.879 -18.268 -4.233 208 HB2 LEU 57 HB2 LEU 24 -15.820 -20.288 -4.100 209 HB3 LEU 57 HB3 LEU 24 -17.237 -20.343 -3.110 210 HG LEU 57 HG LEU 24 -16.966 -21.620 -5.884 211 HD11 LEU 57 HD11 LEU 24 -15.464 -22.664 -4.262 212 HD12 LEU 57 HD12 LEU 24 -16.799 -22.922 -3.135 213 HD13 LEU 57 HD13 LEU 24 -16.769 -23.764 -4.698 214 HD21 LEU 57 HD21 LEU 24 -18.977 -22.877 -5.440 215 HD22 LEU 57 HD22 LEU 24 -19.095 -22.254 -3.791 216 HD23 LEU 57 HD23 LEU 24 -19.392 -21.186 -5.163 217 HA PRO 58 HA PRO 25 -16.020 -19.140 -8.805 218 HB2 PRO 58 HB2 PRO 25 -18.019 -19.174 -10.666 219 HB3 PRO 58 HB3 PRO 25 -17.431 -20.639 -9.826 220 HG2 PRO 58 HG2 PRO 25 -19.871 -18.973 -9.139 221 HG3 PRO 58 HG3 PRO 25 -19.749 -20.750 -9.302 222 HD2 PRO 58 HD2 PRO 25 -19.616 -19.554 -6.872 223 HD3 PRO 58 HD3 PRO 25 -18.604 -20.965 -7.277 224 H ARG 59 H ARG 26 -18.915 -17.166 -8.047 225 HA ARG 59 HA ARG 26 -18.227 -14.915 -9.742 226 HB2 ARG 59 HB2 ARG 26 -20.510 -15.488 -8.843 227 HB3 ARG 59 HB3 ARG 26 -19.959 -14.974 -7.228 228 HG2 ARG 59 HG2 ARG 26 -19.557 -12.701 -8.101 229 HG3 ARG 59 HG3 ARG 26 -19.978 -13.243 -9.740 230 HD2 ARG 59 HD2 ARG 26 -22.293 -13.778 -8.905 231 HD3 ARG 59 HD3 ARG 26 -21.849 -13.120 -7.337 232 HE ARG 59 HE ARG 26 -21.776 -10.951 -8.191 233 HH11 ARG 59 HH11 ARG 26 -22.525 -13.216 -10.844 234 HH12 ARG 59 HH12 ARG 26 -23.101 -11.983 -11.908 235 HH21 ARG 59 HH21 ARG 26 -22.582 -9.335 -9.601 236 HH22 ARG 59 HH22 ARG 26 -23.094 -9.735 -11.195 237 H LEU 60 H LEU 27 -17.431 -15.951 -6.436 238 HA LEU 60 HA LEU 27 -16.169 -13.628 -5.533 239 HB2 LEU 60 HB2 LEU 27 -16.622 -15.623 -4.111 240 HB3 LEU 60 HB3 LEU 27 -15.395 -16.551 -4.932 241 HG LEU 60 HG LEU 27 -14.745 -15.708 -2.713 242 HD11 LEU 60 HD11 LEU 27 -12.843 -14.685 -4.849 243 HD12 LEU 60 HD12 LEU 27 -12.482 -15.246 -3.216 244 HD13 LEU 60 HD13 LEU 27 -13.060 -16.407 -4.421 245 HD21 LEU 60 HD21 LEU 27 -14.435 -12.970 -4.020 246 HD22 LEU 60 HD22 LEU 27 -15.793 -13.455 -2.975 247 HD23 LEU 60 HD23 LEU 27 -14.174 -13.434 -2.323 248 H GLN 61 H GLN 28 -14.703 -16.459 -7.332 249 HA GLN 61 HA GLN 28 -12.155 -15.296 -7.698 250 HB2 GLN 61 HB2 GLN 28 -13.730 -17.301 -9.357 251 HB3 GLN 61 HB3 GLN 28 -12.204 -16.646 -9.941 252 HG2 GLN 61 HG2 GLN 28 -11.080 -17.421 -7.856 253 HG3 GLN 61 HG3 GLN 28 -12.575 -18.234 -7.382 254 HE21 GLN 61 HE22 GLN 28 -9.592 -18.558 -9.280 255 HE22 GLN 61 HE21 GLN 28 -10.052 -20.028 -10.067 256 H GLY 62 H GLY 29 -15.082 -14.961 -9.799 257 HA2 GLY 62 HA2 GLY 29 -13.873 -13.504 -11.849 258 HA3 GLY 62 HA3 GLY 29 -15.580 -13.392 -11.385 259 H GLU 63 H GLU 30 -15.683 -12.137 -9.009 260 HA GLU 63 HA GLU 30 -15.078 -9.439 -9.792 261 HB2 GLU 63 HB2 GLU 30 -16.101 -10.623 -7.174 262 HB3 GLU 63 HB3 GLU 30 -16.031 -8.894 -7.542 263 HG2 GLU 63 HG2 GLU 30 -17.656 -10.958 -9.097 264 HG3 GLU 63 HG3 GLU 30 -18.284 -9.850 -7.888 265 H TYR 64 H TYR 31 -13.619 -11.670 -7.423 266 HA TYR 64 HA TYR 31 -11.652 -10.019 -6.232 267 HB2 TYR 64 HB2 TYR 31 -11.970 -12.259 -5.452 268 HB3 TYR 64 HB3 TYR 31 -11.725 -12.923 -7.068 269 HD1 TYR 64 HD2 TYR 31 -9.586 -13.219 -8.094 270 HD2 TYR 64 HD1 TYR 31 -9.978 -11.619 -4.106 271 HE1 TYR 64 HE2 TYR 31 -7.191 -13.559 -7.714 272 HE2 TYR 64 HE1 TYR 31 -7.577 -12.062 -3.689 273 HH TYR 64 HH TYR 31 -5.436 -13.447 -6.264 274 H ARG 65 H ARG 32 -11.518 -11.927 -9.298 275 HA ARG 65 HA ARG 32 -8.914 -11.073 -9.975 276 HB2 ARG 65 HB2 ARG 32 -9.904 -13.086 -10.828 277 HB3 ARG 65 HB3 ARG 32 -11.136 -12.188 -11.727 278 HG2 ARG 65 HG2 ARG 32 -9.532 -11.261 -13.252 279 HG3 ARG 65 HG3 ARG 32 -8.183 -11.625 -12.164 280 HD2 ARG 65 HD2 ARG 32 -8.708 -14.060 -12.460 281 HD3 ARG 65 HD3 ARG 32 -9.796 -13.610 -13.785 282 HE ARG 65 HE ARG 32 -6.856 -13.216 -13.553 283 HH11 ARG 65 HH11 ARG 32 -9.683 -13.305 -15.699 284 HH12 ARG 65 HH12 ARG 32 -8.759 -13.244 -17.162 285 HH21 ARG 65 HH21 ARG 32 -5.617 -13.161 -15.513 286 HH22 ARG 65 HH22 ARG 32 -6.405 -13.190 -17.049 287 H SER 66 H SER 33 -12.154 -9.658 -10.831 288 HA SER 66 HA SER 33 -11.185 -7.740 -12.633 289 HB2 SER 66 HB2 SER 33 -13.418 -7.407 -10.585 290 HB3 SER 66 HB3 SER 33 -13.153 -6.396 -12.020 291 HG SER 66 HG SER 33 -14.692 -7.984 -12.510 292 H LEU 67 H LEU 34 -11.069 -7.709 -9.009 293 HA LEU 67 HA LEU 34 -9.853 -5.047 -9.084 294 HB2 LEU 67 HB2 LEU 34 -11.231 -5.741 -7.180 295 HB3 LEU 67 HB3 LEU 34 -10.048 -6.992 -6.760 296 HG LEU 67 HG LEU 34 -8.346 -5.285 -6.297 297 HD11 LEU 67 HD11 LEU 34 -10.462 -3.231 -7.093 298 HD12 LEU 67 HD12 LEU 34 -8.958 -2.845 -6.239 299 HD13 LEU 67 HD13 LEU 34 -8.883 -3.487 -7.873 300 HD21 LEU 67 HD21 LEU 34 -9.362 -4.239 -4.329 301 HD22 LEU 67 HD22 LEU 34 -10.989 -4.565 -4.965 302 HD23 LEU 67 HD23 LEU 34 -9.929 -5.907 -4.504 303 H THR 68 H THR 35 -8.500 -8.406 -8.400 304 HA THR 68 HA THR 35 -5.877 -7.313 -7.846 305 HB THR 68 HB THR 35 -5.271 -9.794 -7.920 306 HG1 THR 68 HG1 THR 35 -7.227 -11.159 -7.987 307 HG21 THR 68 HG21 THR 35 -7.669 -9.122 -6.172 308 HG22 THR 68 HG22 THR 35 -6.435 -10.381 -5.901 309 HG23 THR 68 HG23 THR 35 -5.964 -8.700 -5.819 310 H GLY 69 H GLY 36 -7.395 -8.724 -10.728 311 HA2 GLY 69 HA2 GLY 36 -6.608 -8.883 -12.899 312 HA3 GLY 69 HA3 GLY 36 -5.052 -8.176 -12.414 313 H ASP 70 H ASP 37 -6.382 -10.840 -10.452 314 HA ASP 70 HA ASP 37 -4.607 -12.846 -11.734 315 HB2 ASP 70 HB2 ASP 37 -3.394 -11.571 -9.850 316 HB3 ASP 70 HB3 ASP 37 -4.566 -12.274 -8.734 317 H TRP 71 H TRP 38 -5.068 -15.051 -10.715 318 HA TRP 71 HA TRP 38 -7.938 -15.391 -10.096 319 HB2 TRP 71 HB2 TRP 38 -5.685 -17.371 -10.654 320 HB3 TRP 71 HB3 TRP 38 -7.321 -17.833 -10.222 321 HD1 TRP 71 HD1 TRP 38 -5.276 -17.483 -13.143 322 HE1 TRP 71 HE1 TRP 38 -6.632 -17.270 -15.302 323 HE3 TRP 71 HE3 TRP 38 -9.837 -16.365 -11.111 324 HZ2 TRP 71 HZ2 TRP 38 -9.363 -16.631 -16.060 325 HZ3 TRP 71 HZ3 TRP 38 -11.741 -15.810 -12.563 326 HH2 TRP 71 HH2 TRP 38 -11.551 -15.981 -15.035 327 H ILE 72 H ILE 39 -8.484 -16.610 -8.136 328 HA ILE 72 HA ILE 39 -7.166 -15.864 -5.756 329 HB ILE 72 HB ILE 39 -9.030 -18.140 -6.463 330 HG12 ILE 72 HG12 ILE 39 -9.841 -15.710 -6.470 331 HG13 ILE 72 HG13 ILE 39 -10.781 -16.885 -5.563 332 HG21 ILE 72 HG21 ILE 39 -7.851 -19.045 -4.623 333 HG22 ILE 72 HG22 ILE 39 -7.923 -17.532 -3.701 334 HG23 ILE 72 HG23 ILE 39 -9.397 -18.483 -3.987 335 HD11 ILE 72 HD11 ILE 39 -10.076 -16.064 -3.478 336 HD12 ILE 72 HD12 ILE 39 -8.743 -15.103 -4.196 337 HD13 ILE 72 HD13 ILE 39 -10.432 -14.640 -4.464 338 HA PRO 73 HA PRO 40 -3.759 -18.738 -6.301 339 HB2 PRO 73 HB2 PRO 40 -2.065 -17.949 -4.366 340 HB3 PRO 73 HB3 PRO 40 -2.546 -16.830 -5.660 341 HG2 PRO 73 HG2 PRO 40 -3.824 -17.090 -2.907 342 HG3 PRO 73 HG3 PRO 40 -3.141 -15.623 -3.694 343 HD2 PRO 73 HD2 PRO 40 -5.809 -16.273 -3.802 344 HD3 PRO 73 HD3 PRO 40 -4.961 -15.468 -5.163 345 H PHE 74 H PHE 41 -6.049 -20.040 -5.215 346 HA PHE 74 HA PHE 41 -5.776 -20.838 -2.468 347 HB2 PHE 74 HB2 PHE 41 -7.504 -22.425 -2.842 348 HB3 PHE 74 HB3 PHE 41 -7.955 -20.924 -3.576 349 HD1 PHE 74 HD2 PHE 41 -7.662 -20.732 -6.218 350 HD2 PHE 74 HD1 PHE 41 -7.523 -24.446 -4.024 351 HE1 PHE 74 HE2 PHE 41 -8.167 -21.974 -8.289 352 HE2 PHE 74 HE1 PHE 41 -8.095 -25.680 -6.104 353 HZ PHE 74 HZ PHE 41 -8.410 -24.448 -8.239 354 H LYS 75 H LYS 42 -5.240 -22.853 -5.393 355 HA LYS 75 HA LYS 42 -3.962 -24.907 -3.809 356 HB2 LYS 75 HB2 LYS 42 -5.414 -25.221 -5.801 357 HB3 LYS 75 HB3 LYS 42 -4.211 -24.463 -6.815 358 HG2 LYS 75 HG2 LYS 42 -4.271 -26.929 -6.994 359 HG3 LYS 75 HG3 LYS 42 -2.683 -26.343 -6.474 360 HD2 LYS 75 HD2 LYS 42 -3.173 -27.024 -4.146 361 HD3 LYS 75 HD3 LYS 42 -4.820 -27.511 -4.627 362 HE2 LYS 75 HE2 LYS 42 -3.850 -29.185 -6.192 363 HE3 LYS 75 HE3 LYS 42 -2.219 -28.679 -5.739 364 HZ1 LYS 75 HZ1 LYS 42 -2.883 -30.669 -4.553 365 HZ2 LYS 75 HZ2 LYS 42 -2.669 -29.467 -3.478 366 HZ3 LYS 75 HZ3 LYS 42 -4.189 -29.941 -3.907 367 H GLN 76 H GLN 43 -2.925 -22.074 -5.452 368 HA GLN 76 HA GLN 43 -0.161 -22.701 -5.876 369 HB2 GLN 76 HB2 GLN 43 -1.552 -19.989 -5.620 370 HB3 GLN 76 HB3 GLN 43 0.017 -20.315 -6.331 371 HG2 GLN 76 HG2 GLN 43 -1.201 -20.154 -8.240 372 HG3 GLN 76 HG3 GLN 43 -1.338 -21.885 -7.991 373 HE21 GLN 76 HE22 GLN 43 -3.184 -19.614 -9.310 374 HE22 GLN 76 HE21 GLN 43 -4.741 -19.926 -8.554 375 H LEU 77 H LEU 44 -2.019 -21.083 -3.223 376 HA LEU 77 HA LEU 44 0.323 -20.843 -1.472 377 HB2 LEU 77 HB2 LEU 44 -2.631 -20.393 -1.052 378 HB3 LEU 77 HB3 LEU 44 -1.419 -20.208 0.218 379 HG LEU 77 HG LEU 44 -1.450 -18.608 -2.367 380 HD11 LEU 77 HD11 LEU 44 -3.374 -18.079 -0.881 381 HD12 LEU 77 HD12 LEU 44 -2.231 -17.717 0.441 382 HD13 LEU 77 HD13 LEU 44 -2.245 -16.723 -1.029 383 HD21 LEU 77 HD21 LEU 44 0.239 -18.280 0.142 384 HD22 LEU 77 HD22 LEU 44 0.829 -18.725 -1.474 385 HD23 LEU 77 HD23 LEU 44 0.168 -17.121 -1.195 386 H GLY 78 H GLY 45 -2.259 -23.215 -2.066 387 HA2 GLY 78 HA2 GLY 45 -1.464 -25.510 -1.730 388 HA3 GLY 78 HA3 GLY 45 -0.863 -25.037 -0.138 389 H TYR 79 H TYR 46 -3.914 -23.595 -0.916 390 HA TYR 79 HA TYR 46 -5.362 -25.273 0.998 391 HB2 TYR 79 HB2 TYR 46 -6.338 -23.027 -0.821 392 HB3 TYR 79 HB3 TYR 46 -7.198 -23.729 0.542 393 HD1 TYR 79 HD2 TYR 46 -6.239 -23.482 2.887 394 HD2 TYR 79 HD1 TYR 46 -4.742 -21.258 -0.494 395 HE1 TYR 79 HE2 TYR 46 -5.125 -21.932 4.407 396 HE2 TYR 79 HE1 TYR 46 -3.636 -19.675 1.015 397 HH TYR 79 HH TYR 46 -3.756 -20.002 4.613 398 HA PRO 80 HA PRO 47 -6.265 -27.936 -2.367 399 HB2 PRO 80 HB2 PRO 47 -8.536 -29.340 -1.557 400 HB3 PRO 80 HB3 PRO 47 -6.901 -29.586 -0.868 401 HG2 PRO 80 HG2 PRO 47 -9.120 -27.799 0.206 402 HG3 PRO 80 HG3 PRO 47 -8.169 -29.030 1.099 403 HD2 PRO 80 HD2 PRO 47 -7.437 -26.433 1.212 404 HD3 PRO 80 HD3 PRO 47 -6.184 -27.687 1.006 405 H THR 81 H THR 48 -8.960 -25.808 -1.353 406 HA THR 81 HA THR 48 -9.954 -25.725 -4.144 407 HB THR 81 HB THR 48 -12.265 -25.970 -3.052 408 HG1 THR 81 HG1 THR 48 -12.082 -27.101 -0.935 409 HG21 THR 81 HG21 THR 48 -12.268 -28.356 -3.010 410 HG22 THR 81 HG22 THR 48 -11.051 -27.880 -4.212 411 HG23 THR 81 HG23 THR 48 -10.541 -28.437 -2.604 412 H LEU 82 H LEU 49 -11.587 -23.958 -4.379 413 HA LEU 82 HA LEU 49 -10.682 -21.438 -3.360 414 HB2 LEU 82 HB2 LEU 49 -13.350 -22.329 -4.587 415 HB3 LEU 82 HB3 LEU 49 -13.044 -20.678 -4.115 416 HG LEU 82 HG LEU 49 -12.807 -20.842 -6.465 417 HD11 LEU 82 HD11 LEU 49 -10.505 -20.011 -6.790 418 HD12 LEU 82 HD12 LEU 49 -11.260 -19.314 -5.333 419 HD13 LEU 82 HD13 LEU 49 -10.041 -20.609 -5.208 420 HD21 LEU 82 HD21 LEU 49 -10.602 -22.918 -6.141 421 HD22 LEU 82 HD22 LEU 49 -12.268 -23.270 -6.656 422 HD23 LEU 82 HD23 LEU 49 -11.232 -22.234 -7.647 423 H GLU 83 H GLU 50 -13.352 -23.626 -2.322 424 HA GLU 83 HA GLU 50 -14.250 -21.855 -0.286 425 HB2 GLU 83 HB2 GLU 50 -15.468 -23.644 0.651 426 HB3 GLU 83 HB3 GLU 50 -15.550 -23.805 -1.099 427 HG2 GLU 83 HG2 GLU 50 -13.846 -25.606 -1.002 428 HG3 GLU 83 HG3 GLU 50 -13.764 -25.435 0.758 429 H ALA 84 H ALA 51 -11.706 -24.473 -0.158 430 HA ALA 84 HA ALA 51 -11.245 -24.195 2.616 431 HB1 ALA 84 HB1 ALA 51 -9.128 -25.333 2.175 432 HB2 ALA 84 HB2 ALA 51 -10.459 -26.090 1.279 433 HB3 ALA 84 HB3 ALA 51 -9.315 -25.032 0.421 434 H TYR 85 H TYR 52 -9.693 -22.464 -0.136 435 HA TYR 85 HA TYR 52 -7.921 -20.842 1.377 436 HB2 TYR 85 HB2 TYR 52 -7.740 -20.880 -0.977 437 HB3 TYR 85 HB3 TYR 52 -9.420 -20.419 -1.220 438 HD1 TYR 85 HD1 TYR 52 -6.130 -19.174 0.034 439 HD2 TYR 85 HD2 TYR 52 -10.076 -18.137 -1.373 440 HE1 TYR 85 HE1 TYR 52 -5.462 -16.799 0.018 441 HE2 TYR 85 HE2 TYR 52 -9.439 -15.749 -1.366 442 HH TYR 85 HH TYR 52 -6.183 -14.604 -0.335 443 H LEU 86 H LEU 53 -11.395 -20.259 0.493 444 HA LEU 86 HA LEU 53 -11.546 -17.792 1.923 445 HB2 LEU 86 HB2 LEU 53 -13.681 -19.745 1.000 446 HB3 LEU 86 HB3 LEU 53 -14.022 -18.137 1.642 447 HG LEU 86 HG LEU 53 -12.184 -18.442 -0.737 448 HD11 LEU 86 HD11 LEU 53 -14.128 -19.644 -1.427 449 HD12 LEU 86 HD12 LEU 53 -15.209 -18.446 -0.716 450 HD13 LEU 86 HD13 LEU 53 -14.233 -18.038 -2.160 451 HD21 LEU 86 HD21 LEU 53 -12.295 -16.241 0.440 452 HD22 LEU 86 HD22 LEU 53 -12.930 -16.171 -1.206 453 HD23 LEU 86 HD23 LEU 53 -14.049 -16.209 0.173 454 H ARG 87 H ARG 54 -12.233 -21.130 3.010 455 HA ARG 87 HA ARG 54 -13.212 -20.508 5.655 456 HB2 ARG 87 HB2 ARG 54 -11.556 -22.872 4.633 457 HB3 ARG 87 HB3 ARG 54 -11.878 -22.655 6.326 458 HG2 ARG 87 HG2 ARG 54 -13.401 -24.234 5.687 459 HG3 ARG 87 HG3 ARG 54 -14.343 -22.760 5.880 460 HD2 ARG 87 HD2 ARG 54 -14.557 -22.530 3.458 461 HD3 ARG 87 HD3 ARG 54 -13.226 -23.649 3.232 462 HE ARG 87 HE ARG 54 -14.636 -25.245 2.901 463 HH11 ARG 87 HH11 ARG 54 -16.111 -23.522 5.684 464 HH12 ARG 87 HH12 ARG 54 -17.496 -24.542 5.696 465 HH21 ARG 87 HH21 ARG 54 -16.521 -26.415 2.837 466 HH22 ARG 87 HH22 ARG 54 -17.707 -26.277 4.110 467 H SER 88 H SER 55 -9.921 -20.546 4.311 468 HA SER 88 HA SER 55 -8.648 -20.459 6.882 469 HB2 SER 88 HB2 SER 55 -7.502 -20.169 4.087 470 HB3 SER 88 HB3 SER 55 -6.595 -20.466 5.584 471 HG SER 88 HG SER 55 -8.471 -22.160 4.278 472 H VAL 89 H VAL 56 -10.328 -17.940 5.752 473 HA VAL 89 HA VAL 56 -8.392 -15.981 6.865 474 HB VAL 89 HB VAL 56 -8.231 -15.781 4.512 475 HG11 VAL 89 HG11 VAL 56 -10.046 -16.786 3.516 476 HG12 VAL 89 HG12 VAL 56 -11.241 -15.857 4.428 477 HG13 VAL 89 HG13 VAL 56 -10.305 -15.085 3.122 478 HG21 VAL 89 HG21 VAL 56 -8.656 -13.517 4.075 479 HG22 VAL 89 HG22 VAL 56 -9.977 -13.433 5.244 480 HG23 VAL 89 HG23 VAL 56 -8.303 -13.641 5.809 481 HA PRO 90 HA PRO 57 -12.836 -16.103 8.507 482 HB2 PRO 90 HB2 PRO 57 -12.636 -17.123 11.013 483 HB3 PRO 90 HB3 PRO 57 -12.649 -18.158 9.552 484 HG2 PRO 90 HG2 PRO 57 -10.236 -17.208 11.130 485 HG3 PRO 90 HG3 PRO 57 -10.620 -18.865 10.552 486 HD2 PRO 90 HD2 PRO 57 -8.957 -17.161 9.178 487 HD3 PRO 90 HD3 PRO 57 -9.993 -18.380 8.394 488 H ALA 91 H ALA 58 -9.864 -14.722 9.767 489 HA ALA 91 HA ALA 58 -11.196 -12.994 11.708 490 HB1 ALA 91 HB1 ALA 58 -8.940 -12.037 11.987 491 HB2 ALA 91 HB2 ALA 58 -8.874 -13.808 12.042 492 HB3 ALA 91 HB3 ALA 58 -8.354 -12.937 10.578 493 H VAL 92 H VAL 59 -10.957 -12.882 8.301 494 HA VAL 92 HA VAL 59 -11.413 -9.929 8.292 495 HB VAL 92 HB VAL 59 -9.672 -11.428 6.304 496 HG11 VAL 92 HG11 VAL 59 -8.928 -9.174 5.619 497 HG12 VAL 92 HG12 VAL 59 -10.678 -9.353 5.435 498 HG13 VAL 92 HG13 VAL 59 -10.033 -8.441 6.810 499 HG21 VAL 92 HG21 VAL 59 -7.725 -10.250 7.340 500 HG22 VAL 92 HG22 VAL 59 -8.770 -9.753 8.681 501 HG23 VAL 92 HG23 VAL 59 -8.426 -11.476 8.387 502 H VAL 93 H VAL 60 -12.272 -13.107 7.081 503 HA VAL 93 HA VAL 60 -14.338 -11.974 5.275 504 HB VAL 93 HB VAL 60 -12.165 -14.012 4.788 505 HG11 VAL 93 HG11 VAL 60 -13.085 -14.541 2.579 506 HG12 VAL 93 HG12 VAL 60 -14.128 -15.112 3.866 507 HG13 VAL 93 HG13 VAL 60 -14.558 -13.642 2.956 508 HG21 VAL 93 HG21 VAL 60 -11.437 -11.794 4.257 509 HG22 VAL 93 HG22 VAL 60 -11.794 -12.581 2.722 510 HG23 VAL 93 HG23 VAL 60 -12.949 -11.424 3.422 511 H ARG 94 H ARG 61 -15.973 -13.669 4.816 512 HA ARG 94 HA ARG 61 -16.481 -15.581 7.023 513 HB2 ARG 94 HB2 ARG 61 -17.372 -13.617 7.972 514 HB3 ARG 94 HB3 ARG 61 -17.984 -13.007 6.437 515 HG2 ARG 94 HG2 ARG 61 -19.826 -14.614 6.473 516 HG3 ARG 94 HG3 ARG 61 -19.142 -15.437 7.884 517 HD2 ARG 94 HD2 ARG 61 -21.059 -13.931 8.443 518 HD3 ARG 94 HD3 ARG 61 -19.544 -13.541 9.299 519 HE ARG 94 HE ARG 61 -19.914 -12.011 6.841 520 HH11 ARG 94 HH11 ARG 61 -21.207 -12.109 10.132 521 HH12 ARG 94 HH12 ARG 61 -21.229 -10.395 10.333 522 HH21 ARG 94 HH21 ARG 61 -19.556 -9.749 7.256 523 HH22 ARG 94 HH22 ARG 61 -20.403 -9.014 8.575 524 H ILE 95 H ILE 62 -18.238 -17.086 6.345 525 HA ILE 95 HA ILE 62 -19.048 -16.917 3.521 526 HB ILE 95 HB ILE 62 -18.299 -19.228 3.096 527 HG12 ILE 95 HG12 ILE 62 -16.748 -19.001 5.693 528 HG13 ILE 95 HG13 ILE 62 -18.108 -20.091 5.378 529 HG21 ILE 95 HG21 ILE 62 -16.897 -17.194 2.431 530 HG22 ILE 95 HG22 ILE 62 -15.862 -17.554 3.824 531 HG23 ILE 95 HG23 ILE 62 -16.046 -18.729 2.505 532 HD11 ILE 95 HD11 ILE 62 -16.754 -21.198 3.587 533 HD12 ILE 95 HD12 ILE 62 -15.365 -20.205 4.086 534 HD13 ILE 95 HD13 ILE 62 -16.083 -21.332 5.237 535 H GLU 96 H GLU 63 -20.867 -18.190 3.026 536 HA GLU 96 HA GLU 63 -22.096 -19.756 5.244 537 HB2 GLU 96 HB2 GLU 63 -23.520 -17.845 3.349 538 HB3 GLU 96 HB3 GLU 63 -24.312 -19.046 4.382 539 HG2 GLU 96 HG2 GLU 63 -23.193 -17.924 6.372 540 HG3 GLU 96 HG3 GLU 63 -22.736 -16.608 5.280 541 H ALA 97 H ALA 64 -21.598 -21.756 4.480 542 HA ALA 97 HA ALA 64 -21.928 -22.538 1.663 543 HB1 ALA 97 HB1 ALA 64 -20.262 -23.670 3.062 544 HB2 ALA 97 HB2 ALA 64 -21.536 -24.194 4.192 545 HB3 ALA 97 HB3 ALA 64 -21.521 -24.800 2.525 546 H SER 98 H SER 65 -23.926 -22.696 0.823 547 HA SER 98 HA SER 65 -26.299 -22.714 2.541 548 HB2 SER 98 HB2 SER 65 -26.113 -21.309 0.478 549 HB3 SER 98 HB3 SER 65 -26.026 -22.792 -0.498 550 HG SER 98 HG SER 65 -28.173 -21.864 -0.309 551 H ARG 99 H ARG 66 -27.946 -24.301 2.242 552 HA ARG 99 HA ARG 66 -27.114 -27.052 2.253 553 HB2 ARG 99 HB2 ARG 66 -29.485 -27.608 2.247 554 HB3 ARG 99 HB3 ARG 66 -29.112 -26.380 3.451 555 HG2 ARG 99 HG2 ARG 66 -30.152 -24.636 2.169 556 HG3 ARG 99 HG3 ARG 66 -30.213 -25.633 0.696 557 HD2 ARG 99 HD2 ARG 66 -31.744 -27.188 1.718 558 HD3 ARG 99 HD3 ARG 66 -31.687 -26.286 3.255 559 HE ARG 99 HE ARG 66 -32.439 -24.491 1.187 560 HH11 ARG 99 HH11 ARG 66 -33.814 -27.274 2.927 561 HH12 ARG 99 HH12 ARG 66 -35.457 -26.791 2.691 562 HH21 ARG 99 HH21 ARG 66 -34.629 -23.843 0.876 563 HH22 ARG 99 HH22 ARG 66 -35.926 -24.791 1.515 564 H SER 100 H SER 67 -28.013 -24.901 -0.391 565 HA SER 100 HA SER 67 -28.553 -26.830 -2.379 566 HB2 SER 100 HB2 SER 67 -27.150 -24.154 -2.739 567 HB3 SER 100 HB3 SER 67 -28.126 -25.029 -3.925 568 HG SER 100 HG SER 67 -29.348 -23.360 -2.931 569 H GLY 101 H GLY 68 -25.608 -26.332 -0.644 570 HA2 GLY 101 HA2 GLY 68 -23.654 -27.428 -0.800 571 HA3 GLY 101 HA3 GLY 68 -24.184 -28.242 -2.290 572 H GLU 102 H GLU 69 -24.178 -24.745 -1.712 573 HA GLU 102 HA GLU 69 -21.791 -24.260 -3.370 574 HB2 GLU 102 HB2 GLU 69 -24.456 -22.758 -3.562 575 HB3 GLU 102 HB3 GLU 69 -22.925 -22.221 -4.276 576 HG2 GLU 102 HG2 GLU 69 -22.834 -24.298 -5.642 577 HG3 GLU 102 HG3 GLU 69 -24.414 -24.774 -5.003 578 H ILE 103 H ILE 70 -21.041 -21.904 -2.728 579 HA ILE 103 HA ILE 70 -21.760 -21.282 0.049 580 HB ILE 103 HB ILE 70 -19.969 -22.612 0.519 581 HG12 ILE 103 HG12 ILE 70 -19.803 -20.218 1.420 582 HG13 ILE 103 HG13 ILE 70 -18.451 -21.319 1.634 583 HG21 ILE 103 HG21 ILE 70 -17.756 -22.685 -0.498 584 HG22 ILE 103 HG22 ILE 70 -19.048 -23.223 -1.572 585 HG23 ILE 103 HG23 ILE 70 -18.337 -21.601 -1.772 586 HD11 ILE 103 HD11 ILE 70 -17.102 -20.247 0.018 587 HD12 ILE 103 HD12 ILE 70 -18.460 -19.362 -0.693 588 HD13 ILE 103 HD13 ILE 70 -17.871 -18.929 0.903 589 H VAL 104 H VAL 71 -21.865 -19.222 0.511 590 HA VAL 104 HA VAL 71 -21.273 -17.233 -1.622 591 HB VAL 104 HB VAL 71 -23.067 -16.961 0.838 592 HG11 VAL 104 HG11 VAL 71 -22.879 -15.321 -1.746 593 HG12 VAL 104 HG12 VAL 71 -24.017 -15.040 -0.414 594 HG13 VAL 104 HG13 VAL 71 -22.289 -14.829 -0.135 595 HG21 VAL 104 HG21 VAL 71 -25.014 -17.231 -0.652 596 HG22 VAL 104 HG22 VAL 71 -23.937 -17.674 -1.990 597 HG23 VAL 104 HG23 VAL 71 -24.078 -18.722 -0.562 598 H CYS 105 H CYS 72 -19.805 -15.626 -1.121 599 HA CYS 105 HA CYS 72 -18.300 -15.901 1.434 600 HB2 CYS 105 HB2 CYS 72 -17.400 -14.412 -1.052 601 HB3 CYS 105 HB3 CYS 72 -16.405 -15.155 0.220 602 HG CYS 105 HG CYS 72 -18.226 -16.503 -2.212 603 H TYR 106 H TYR 73 -17.807 -14.027 2.649 604 HA TYR 106 HA TYR 73 -19.073 -11.431 1.927 605 HB2 TYR 106 HB2 TYR 73 -19.435 -13.061 4.483 606 HB3 TYR 106 HB3 TYR 73 -19.905 -11.378 4.328 607 HD1 TYR 106 HD1 TYR 73 -21.624 -10.730 2.528 608 HD2 TYR 106 HD2 TYR 73 -20.895 -14.812 3.776 609 HE1 TYR 106 HE1 TYR 73 -23.925 -11.324 1.891 610 HE2 TYR 106 HE2 TYR 73 -23.157 -15.449 3.037 611 HH TYR 106 HH TYR 73 -25.255 -14.663 2.307 612 H ALA 107 H ALA 74 -18.349 -9.749 3.614 613 HA ALA 107 HA ALA 74 -15.464 -10.162 4.256 614 HB1 ALA 107 HB1 ALA 74 -15.407 -7.758 4.578 615 HB2 ALA 107 HB2 ALA 74 -16.157 -8.087 3.026 616 HB3 ALA 107 HB3 ALA 74 -17.178 -7.630 4.403 617 H VAL 108 H VAL 75 -14.735 -9.358 6.337 618 HA VAL 108 HA VAL 75 -16.749 -9.074 8.488 619 HB VAL 108 HB VAL 75 -15.087 -11.417 8.096 620 HG11 VAL 108 HG11 VAL 75 -14.650 -10.193 10.840 621 HG12 VAL 108 HG12 VAL 75 -14.165 -11.808 10.280 622 HG13 VAL 108 HG13 VAL 75 -13.409 -10.369 9.588 623 HG21 VAL 108 HG21 VAL 75 -17.061 -10.724 10.308 624 HG22 VAL 108 HG22 VAL 75 -17.482 -11.374 8.711 625 HG23 VAL 108 HG23 VAL 75 -16.519 -12.347 9.843 626 H ALA 109 H ALA 76 -13.507 -8.292 7.247 627 HA ALA 109 HA ALA 76 -13.471 -5.972 9.019 628 HB1 ALA 109 HB1 ALA 76 -11.071 -7.853 8.930 629 HB2 ALA 109 HB2 ALA 76 -11.221 -6.344 9.841 630 HB3 ALA 109 HB3 ALA 76 -12.195 -7.754 10.305 Start of MODEL 13 1 H1 GLY -2 H1 GLY -2 2.295 -0.766 -7.088 2 H2 GLY -2 H2 GLY -2 3.605 -0.305 -6.209 3 H3 GLY -2 H3 GLY -2 3.599 -1.750 -6.971 4 HA2 GLY -2 HA2 GLY -2 1.824 -0.999 -4.752 5 HA3 GLY -2 HA3 GLY -2 1.818 -2.568 -5.573 6 H HIS -1 H HIS -1 2.223 -2.188 -2.749 7 HA HIS -1 HA HIS -1 5.039 -3.156 -2.412 8 HB2 HIS -1 HB2 HIS -1 5.207 -1.832 -0.393 9 HB3 HIS -1 HB3 HIS -1 4.878 -0.806 -1.777 10 HD2 HIS -1 HD2 HIS -1 2.715 0.676 -1.737 11 HE1 HIS -1 HE1 HIS -1 1.018 -0.691 1.924 12 HE2 HIS -1 HE2 HIS -1 0.841 1.041 0.070 13 H MET 34 H MET 1 1.831 -4.117 -2.054 14 HA MET 34 HA MET 1 1.975 -5.354 0.567 15 HB2 MET 34 HB2 MET 1 0.173 -5.862 -1.845 16 HB3 MET 34 HB3 MET 1 0.033 -6.703 -0.287 17 HG2 MET 34 HG2 MET 1 -0.186 -4.467 0.816 18 HG3 MET 34 HG3 MET 1 -0.339 -3.730 -0.782 19 HE1 MET 34 HE1 MET 1 -3.072 -3.922 -2.191 20 HE2 MET 34 HE2 MET 1 -2.069 -5.354 -2.516 21 HE3 MET 34 HE3 MET 1 -3.749 -5.555 -1.989 22 H LEU 35 H LEU 2 2.397 -7.525 1.066 23 HA LEU 35 HA LEU 2 4.197 -9.037 -0.726 24 HB2 LEU 35 HB2 LEU 2 2.860 -9.820 1.907 25 HB3 LEU 35 HB3 LEU 2 4.091 -10.747 1.063 26 HG LEU 35 HG LEU 2 4.480 -8.004 2.337 27 HD11 LEU 35 HD11 LEU 2 5.562 -10.746 3.123 28 HD12 LEU 35 HD12 LEU 2 5.892 -9.203 3.945 29 HD13 LEU 35 HD13 LEU 2 4.251 -9.866 3.945 30 HD21 LEU 35 HD21 LEU 2 5.955 -8.160 0.392 31 HD22 LEU 35 HD22 LEU 2 6.905 -8.348 1.865 32 HD23 LEU 35 HD23 LEU 2 6.500 -9.781 0.895 33 H GLU 36 H GLU 3 3.498 -11.328 -1.427 34 HA GLU 36 HA GLU 3 1.190 -11.006 -2.981 35 HB2 GLU 36 HB2 GLU 3 3.019 -12.564 -3.551 36 HB3 GLU 36 HB3 GLU 3 2.533 -13.633 -2.221 37 HG2 GLU 36 HG2 GLU 3 0.384 -14.080 -3.281 38 HG3 GLU 36 HG3 GLU 3 0.722 -12.895 -4.541 39 H ALA 37 H ALA 4 1.471 -12.849 0.046 40 HA ALA 37 HA ALA 4 -1.232 -13.793 -0.167 41 HB1 ALA 37 HB1 ALA 4 0.499 -13.693 2.338 42 HB2 ALA 37 HB2 ALA 4 -0.987 -14.650 2.098 43 HB3 ALA 37 HB3 ALA 4 0.447 -15.022 1.140 44 H ASP 38 H ASP 5 0.255 -10.946 1.341 45 HA ASP 38 HA ASP 5 -2.087 -10.104 2.818 46 HB2 ASP 38 HB2 ASP 5 0.246 -9.399 3.351 47 HB3 ASP 38 HB3 ASP 5 0.293 -8.481 1.844 48 H LEU 39 H LEU 6 -0.724 -9.408 -0.411 49 HA LEU 39 HA LEU 6 -2.477 -7.390 -1.239 50 HB2 LEU 39 HB2 LEU 6 -0.414 -7.991 -2.424 51 HB3 LEU 39 HB3 LEU 6 -1.072 -9.548 -2.875 52 HG LEU 39 HG LEU 6 -2.558 -7.066 -3.750 53 HD11 LEU 39 HD11 LEU 6 -0.192 -6.624 -4.310 54 HD12 LEU 39 HD12 LEU 6 -0.089 -8.195 -5.133 55 HD13 LEU 39 HD13 LEU 6 -1.154 -6.914 -5.763 56 HD21 LEU 39 HD21 LEU 6 -3.654 -9.156 -4.351 57 HD22 LEU 39 HD22 LEU 6 -2.971 -8.443 -5.798 58 HD23 LEU 39 HD23 LEU 6 -2.136 -9.808 -5.026 59 H VAL 40 H VAL 7 -2.668 -10.927 -1.827 60 HA VAL 40 HA VAL 7 -5.165 -10.646 -3.131 61 HB VAL 40 HB VAL 7 -5.262 -13.115 -3.056 62 HG11 VAL 40 HG11 VAL 7 -2.408 -12.198 -3.594 63 HG12 VAL 40 HG12 VAL 7 -3.271 -13.548 -4.337 64 HG13 VAL 40 HG13 VAL 7 -3.770 -11.892 -4.672 65 HG21 VAL 40 HG21 VAL 7 -3.527 -14.451 -1.952 66 HG22 VAL 40 HG22 VAL 7 -2.884 -12.987 -1.203 67 HG23 VAL 40 HG23 VAL 7 -4.502 -13.578 -0.779 68 H SER 41 H SER 8 -4.371 -11.288 0.309 69 HA SER 41 HA SER 8 -7.046 -11.757 1.149 70 HB2 SER 41 HB2 SER 8 -4.724 -10.559 2.722 71 HB3 SER 41 HB3 SER 8 -6.217 -11.221 3.403 72 HG SER 41 HG SER 8 -4.095 -12.555 2.108 73 H LYS 42 H LYS 9 -5.208 -8.574 1.106 74 HA LYS 42 HA LYS 9 -7.512 -7.150 2.163 75 HB2 LYS 42 HB2 LYS 9 -4.972 -6.216 0.760 76 HB3 LYS 42 HB3 LYS 9 -6.257 -5.110 1.268 77 HG2 LYS 42 HG2 LYS 9 -6.078 -6.009 3.611 78 HG3 LYS 42 HG3 LYS 9 -4.661 -6.960 3.083 79 HD2 LYS 42 HD2 LYS 9 -3.571 -4.829 2.345 80 HD3 LYS 42 HD3 LYS 9 -4.912 -3.907 3.023 81 HE2 LYS 42 HE2 LYS 9 -3.068 -5.793 4.561 82 HE3 LYS 42 HE3 LYS 9 -2.834 -4.055 4.439 83 HZ1 LYS 42 HZ1 LYS 9 -4.969 -3.744 5.583 84 HZ2 LYS 42 HZ2 LYS 9 -5.164 -5.370 5.742 85 HZ3 LYS 42 HZ3 LYS 9 -3.937 -4.609 6.496 86 H MET 43 H MET 10 -6.391 -7.796 -1.238 87 HA MET 43 HA MET 10 -8.469 -6.083 -2.291 88 HB2 MET 43 HB2 MET 10 -6.771 -8.263 -3.570 89 HB3 MET 43 HB3 MET 10 -7.963 -7.292 -4.455 90 HG2 MET 43 HG2 MET 10 -6.804 -5.203 -3.590 91 HG3 MET 43 HG3 MET 10 -5.523 -6.244 -2.977 92 HE1 MET 43 HE1 MET 10 -4.977 -3.780 -4.778 93 HE2 MET 43 HE2 MET 10 -3.614 -4.860 -4.407 94 HE3 MET 43 HE3 MET 10 -3.917 -4.377 -6.078 95 H LEU 44 H LEU 11 -8.325 -9.659 -1.735 96 HA LEU 44 HA LEU 11 -10.908 -10.410 -2.541 97 HB2 LEU 44 HB2 LEU 11 -9.270 -12.026 -1.713 98 HB3 LEU 44 HB3 LEU 11 -9.149 -11.196 -0.174 99 HG LEU 44 HG LEU 11 -11.534 -11.828 0.311 100 HD11 LEU 44 HD11 LEU 11 -12.410 -13.775 -0.952 101 HD12 LEU 44 HD12 LEU 11 -12.248 -12.343 -1.993 102 HD13 LEU 44 HD13 LEU 11 -11.046 -13.659 -2.086 103 HD21 LEU 44 HD21 LEU 11 -10.922 -14.161 0.932 104 HD22 LEU 44 HD22 LEU 11 -9.424 -13.979 -0.012 105 HD23 LEU 44 HD23 LEU 11 -9.706 -12.950 1.395 106 H ARG 45 H ARG 12 -9.895 -9.243 0.670 107 HA ARG 45 HA ARG 12 -12.415 -8.965 1.876 108 HB2 ARG 45 HB2 ARG 12 -10.482 -8.935 3.157 109 HB3 ARG 45 HB3 ARG 12 -9.686 -7.722 2.197 110 HG2 ARG 45 HG2 ARG 12 -12.162 -6.901 3.685 111 HG3 ARG 45 HG3 ARG 12 -10.660 -7.178 4.562 112 HD2 ARG 45 HD2 ARG 12 -9.561 -5.569 2.804 113 HD3 ARG 45 HD3 ARG 12 -11.242 -5.038 2.521 114 HE ARG 45 HE ARG 12 -10.398 -5.313 5.296 115 HH11 ARG 45 HH11 ARG 12 -10.315 -2.894 2.679 116 HH12 ARG 45 HH12 ARG 12 -10.522 -1.557 3.750 117 HH21 ARG 45 HH21 ARG 12 -10.855 -3.684 6.618 118 HH22 ARG 45 HH22 ARG 12 -10.733 -1.997 6.132 119 H ALA 46 H ALA 13 -10.632 -6.505 -0.110 120 HA ALA 46 HA ALA 13 -12.593 -4.545 0.425 121 HB1 ALA 46 HB1 ALA 13 -11.518 -3.292 -1.454 122 HB2 ALA 46 HB2 ALA 13 -10.286 -4.029 -0.403 123 HB3 ALA 46 HB3 ALA 13 -10.684 -4.769 -1.969 124 H VAL 47 H VAL 14 -12.349 -6.894 -2.304 125 HA VAL 47 HA VAL 14 -14.616 -5.880 -3.755 126 HB VAL 47 HB VAL 14 -13.450 -8.698 -3.533 127 HG11 VAL 47 HG11 VAL 14 -15.796 -8.808 -4.354 128 HG12 VAL 47 HG12 VAL 14 -15.413 -7.609 -5.598 129 HG13 VAL 47 HG13 VAL 14 -14.628 -9.216 -5.613 130 HG21 VAL 47 HG21 VAL 14 -13.132 -6.468 -5.599 131 HG22 VAL 47 HG22 VAL 14 -11.881 -7.082 -4.511 132 HG23 VAL 47 HG23 VAL 14 -12.508 -8.109 -5.795 133 H LEU 48 H LEU 15 -14.309 -8.282 -1.098 134 HA LEU 48 HA LEU 15 -17.091 -8.923 -0.982 135 HB2 LEU 48 HB2 LEU 15 -14.907 -8.996 1.165 136 HB3 LEU 48 HB3 LEU 15 -16.484 -9.722 1.335 137 HG LEU 48 HG LEU 15 -14.692 -10.534 -0.982 138 HD11 LEU 48 HD11 LEU 15 -13.929 -12.397 0.500 139 HD12 LEU 48 HD12 LEU 15 -13.399 -10.793 1.065 140 HD13 LEU 48 HD13 LEU 15 -14.754 -11.608 1.867 141 HD21 LEU 48 HD21 LEU 15 -16.838 -12.025 0.561 142 HD22 LEU 48 HD22 LEU 15 -17.124 -11.187 -0.974 143 HD23 LEU 48 HD23 LEU 15 -16.000 -12.560 -0.900 144 H GLN 49 H GLN 16 -15.213 -6.295 0.621 145 HA GLN 49 HA GLN 16 -17.377 -5.480 2.315 146 HB2 GLN 49 HB2 GLN 16 -14.842 -4.102 1.339 147 HB3 GLN 49 HB3 GLN 16 -16.021 -3.245 2.316 148 HG2 GLN 49 HG2 GLN 16 -14.635 -5.812 3.185 149 HG3 GLN 49 HG3 GLN 16 -14.131 -4.190 3.633 150 HE21 GLN 49 HE22 GLN 16 -14.531 -5.697 5.749 151 HE22 GLN 49 HE21 GLN 16 -16.085 -5.385 6.524 152 H SER 50 H SER 17 -16.399 -4.421 -1.019 153 HA SER 50 HA SER 17 -18.497 -2.497 -1.284 154 HB2 SER 50 HB2 SER 17 -17.120 -4.228 -3.388 155 HB3 SER 50 HB3 SER 17 -18.084 -2.773 -3.703 156 HG SER 50 HG SER 17 -15.842 -2.274 -3.639 157 H HIS 51 H HIS 18 -18.315 -6.015 -1.893 158 HA HIS 51 HA HIS 18 -21.046 -6.064 -2.958 159 HB2 HIS 51 HB2 HIS 18 -18.870 -8.168 -2.807 160 HB3 HIS 51 HB3 HIS 18 -20.452 -8.376 -3.565 161 HD2 HIS 51 HD2 HIS 18 -18.812 -8.937 -5.731 162 HE1 HIS 51 HE1 HIS 18 -18.170 -4.877 -6.780 163 HE2 HIS 51 HE2 HIS 18 -18.028 -7.259 -7.624 164 H LYS 52 H LYS 19 -21.639 -5.383 -0.573 165 HA LYS 52 HA LYS 19 -21.555 -7.185 1.586 166 HB2 LYS 52 HB2 LYS 19 -23.570 -5.064 0.746 167 HB3 LYS 52 HB3 LYS 19 -23.767 -5.951 2.245 168 HG2 LYS 52 HG2 LYS 19 -21.368 -4.193 1.576 169 HG3 LYS 52 HG3 LYS 19 -22.722 -3.790 2.635 170 HD2 LYS 52 HD2 LYS 19 -22.082 -5.936 3.962 171 HD3 LYS 52 HD3 LYS 19 -20.534 -5.863 3.118 172 HE2 LYS 52 HE2 LYS 19 -21.746 -3.569 4.735 173 HE3 LYS 52 HE3 LYS 19 -20.614 -4.735 5.414 174 HZ1 LYS 52 HZ1 LYS 19 -19.620 -2.599 4.651 175 HZ2 LYS 52 HZ2 LYS 19 -18.879 -3.917 4.063 176 HZ3 LYS 52 HZ3 LYS 19 -19.882 -3.033 3.091 177 H ASN 53 H ASN 20 -23.761 -7.254 -1.154 178 HA ASN 53 HA ASN 20 -25.705 -9.074 -0.216 179 HB2 ASN 53 HB2 ASN 20 -25.921 -7.926 -2.353 180 HB3 ASN 53 HB3 ASN 20 -24.425 -8.636 -2.959 181 HD21 ASN 53 HD22 ASN 20 -24.384 -10.879 -3.613 182 HD22 ASN 53 HD21 ASN 20 -25.888 -11.702 -3.973 183 H GLY 54 H GLY 21 -22.303 -9.630 -0.834 184 HA2 GLY 54 HA2 GLY 21 -21.056 -11.470 -0.475 185 HA3 GLY 54 HA3 GLY 21 -22.489 -12.507 -0.321 186 H ILE 55 H ILE 22 -20.398 -13.378 -1.793 187 HA ILE 55 HA ILE 22 -21.424 -13.429 -4.576 188 HB ILE 55 HB ILE 22 -18.841 -13.346 -5.193 189 HG12 ILE 55 HG12 ILE 22 -18.844 -11.605 -2.671 190 HG13 ILE 55 HG13 ILE 22 -17.897 -13.056 -2.961 191 HG21 ILE 55 HG21 ILE 22 -19.070 -11.173 -5.966 192 HG22 ILE 55 HG22 ILE 22 -20.728 -11.762 -5.913 193 HG23 ILE 55 HG23 ILE 22 -20.160 -10.680 -4.628 194 HD11 ILE 55 HD11 ILE 22 -16.435 -11.168 -3.261 195 HD12 ILE 55 HD12 ILE 22 -16.796 -11.706 -4.913 196 HD13 ILE 55 HD13 ILE 22 -17.620 -10.303 -4.227 197 H VAL 56 H VAL 23 -21.627 -15.419 -5.219 198 HA VAL 56 HA VAL 23 -20.946 -17.630 -3.589 199 HB VAL 56 HB VAL 23 -21.620 -18.949 -5.634 200 HG11 VAL 56 HG11 VAL 23 -23.520 -16.774 -4.667 201 HG12 VAL 56 HG12 VAL 23 -23.991 -18.243 -5.547 202 HG13 VAL 56 HG13 VAL 23 -23.245 -18.383 -3.953 203 HG21 VAL 56 HG21 VAL 23 -22.608 -17.814 -7.552 204 HG22 VAL 56 HG22 VAL 23 -22.213 -16.217 -6.895 205 HG23 VAL 56 HG23 VAL 23 -20.922 -17.325 -7.398 206 H LEU 57 H LEU 24 -19.245 -19.337 -3.926 207 HA LEU 57 HA LEU 24 -16.824 -18.223 -4.309 208 HB2 LEU 57 HB2 LEU 24 -15.678 -20.110 -4.043 209 HB3 LEU 57 HB3 LEU 24 -17.174 -20.383 -3.224 210 HG LEU 57 HG LEU 24 -17.893 -21.836 -5.225 211 HD11 LEU 57 HD11 LEU 24 -15.802 -22.840 -6.444 212 HD12 LEU 57 HD12 LEU 24 -16.438 -21.355 -7.073 213 HD13 LEU 57 HD13 LEU 24 -15.011 -21.306 -6.034 214 HD21 LEU 57 HD21 LEU 24 -16.442 -23.740 -4.484 215 HD22 LEU 57 HD22 LEU 24 -15.415 -22.583 -3.605 216 HD23 LEU 57 HD23 LEU 24 -17.095 -22.827 -3.143 217 HA PRO 58 HA PRO 25 -16.144 -19.119 -8.894 218 HB2 PRO 58 HB2 PRO 25 -18.232 -19.189 -10.661 219 HB3 PRO 58 HB3 PRO 25 -17.579 -20.634 -9.836 220 HG2 PRO 58 HG2 PRO 25 -20.010 -19.006 -9.072 221 HG3 PRO 58 HG3 PRO 25 -19.859 -20.782 -9.197 222 HD2 PRO 58 HD2 PRO 25 -19.666 -19.486 -6.822 223 HD3 PRO 58 HD3 PRO 25 -18.682 -20.924 -7.176 224 H ARG 59 H ARG 26 -18.968 -17.129 -7.993 225 HA ARG 59 HA ARG 26 -18.328 -14.905 -9.758 226 HB2 ARG 59 HB2 ARG 26 -20.598 -15.453 -8.810 227 HB3 ARG 59 HB3 ARG 26 -20.016 -14.955 -7.208 228 HG2 ARG 59 HG2 ARG 26 -19.640 -12.675 -8.070 229 HG3 ARG 59 HG3 ARG 26 -20.103 -13.208 -9.698 230 HD2 ARG 59 HD2 ARG 26 -22.381 -13.714 -8.903 231 HD3 ARG 59 HD3 ARG 26 -21.946 -13.180 -7.259 232 HE ARG 59 HE ARG 26 -21.298 -11.078 -9.029 233 HH11 ARG 59 HH11 ARG 26 -24.265 -12.737 -7.952 234 HH12 ARG 59 HH12 ARG 26 -25.272 -11.353 -8.178 235 HH21 ARG 59 HH21 ARG 26 -22.661 -9.259 -9.360 236 HH22 ARG 59 HH22 ARG 26 -24.342 -9.344 -8.983 237 H LEU 60 H LEU 27 -17.453 -15.920 -6.469 238 HA LEU 60 HA LEU 27 -16.178 -13.606 -5.574 239 HB2 LEU 60 HB2 LEU 27 -16.588 -15.628 -4.169 240 HB3 LEU 60 HB3 LEU 27 -15.377 -16.531 -5.049 241 HG LEU 60 HG LEU 27 -14.634 -15.817 -2.887 242 HD11 LEU 60 HD11 LEU 27 -12.432 -15.229 -3.381 243 HD12 LEU 60 HD12 LEU 27 -12.987 -16.257 -4.711 244 HD13 LEU 60 HD13 LEU 27 -12.841 -14.483 -4.927 245 HD21 LEU 60 HD21 LEU 27 -14.512 -12.962 -3.963 246 HD22 LEU 60 HD22 LEU 27 -15.826 -13.601 -2.942 247 HD23 LEU 60 HD23 LEU 27 -14.202 -13.545 -2.307 248 H GLN 61 H GLN 28 -14.733 -16.445 -7.294 249 HA GLN 61 HA GLN 28 -12.180 -15.412 -7.771 250 HB2 GLN 61 HB2 GLN 28 -13.965 -17.415 -9.125 251 HB3 GLN 61 HB3 GLN 28 -12.588 -16.855 -10.052 252 HG2 GLN 61 HG2 GLN 28 -12.142 -17.822 -7.209 253 HG3 GLN 61 HG3 GLN 28 -12.417 -18.987 -8.505 254 HE21 GLN 61 HE22 GLN 28 -10.369 -19.834 -9.187 255 HE22 GLN 61 HE21 GLN 28 -8.960 -18.846 -9.426 256 H GLY 62 H GLY 29 -15.092 -14.970 -9.887 257 HA2 GLY 62 HA2 GLY 29 -13.796 -13.514 -11.908 258 HA3 GLY 62 HA3 GLY 29 -15.512 -13.379 -11.499 259 H GLU 63 H GLU 30 -15.645 -12.151 -9.065 260 HA GLU 63 HA GLU 30 -15.060 -9.440 -9.843 261 HB2 GLU 63 HB2 GLU 30 -16.070 -10.643 -7.227 262 HB3 GLU 63 HB3 GLU 30 -16.014 -8.913 -7.588 263 HG2 GLU 63 HG2 GLU 30 -17.637 -10.962 -9.155 264 HG3 GLU 63 HG3 GLU 30 -18.265 -9.881 -7.920 265 H TYR 64 H TYR 31 -13.607 -11.671 -7.473 266 HA TYR 64 HA TYR 31 -11.674 -10.013 -6.241 267 HB2 TYR 64 HB2 TYR 31 -11.988 -12.239 -5.448 268 HB3 TYR 64 HB3 TYR 31 -11.757 -12.920 -7.060 269 HD1 TYR 64 HD2 TYR 31 -9.617 -13.255 -8.087 270 HD2 TYR 64 HD1 TYR 31 -9.986 -11.603 -4.117 271 HE1 TYR 64 HE2 TYR 31 -7.222 -13.589 -7.716 272 HE2 TYR 64 HE1 TYR 31 -7.581 -12.046 -3.709 273 HH TYR 64 HH TYR 31 -5.464 -13.478 -6.277 274 H ARG 65 H ARG 32 -11.484 -11.955 -9.280 275 HA ARG 65 HA ARG 32 -8.890 -11.084 -9.936 276 HB2 ARG 65 HB2 ARG 32 -9.843 -13.114 -10.797 277 HB3 ARG 65 HB3 ARG 32 -11.088 -12.230 -11.705 278 HG2 ARG 65 HG2 ARG 32 -9.494 -11.282 -13.215 279 HG3 ARG 65 HG3 ARG 32 -8.140 -11.610 -12.123 280 HD2 ARG 65 HD2 ARG 32 -8.627 -14.062 -12.420 281 HD3 ARG 65 HD3 ARG 32 -9.695 -13.630 -13.762 282 HE ARG 65 HE ARG 32 -6.762 -13.256 -13.482 283 HH11 ARG 65 HH11 ARG 32 -9.561 -13.146 -15.670 284 HH12 ARG 65 HH12 ARG 32 -8.621 -13.021 -17.113 285 HH21 ARG 65 HH21 ARG 32 -5.492 -13.117 -15.420 286 HH22 ARG 65 HH22 ARG 32 -6.260 -13.011 -16.961 287 H SER 66 H SER 33 -12.103 -9.671 -10.839 288 HA SER 66 HA SER 33 -11.087 -7.777 -12.635 289 HB2 SER 66 HB2 SER 33 -13.383 -7.399 -10.657 290 HB3 SER 66 HB3 SER 33 -13.075 -6.432 -12.110 291 HG SER 66 HG SER 33 -14.608 -8.032 -12.580 292 H LEU 67 H LEU 34 -11.044 -7.730 -9.019 293 HA LEU 67 HA LEU 34 -9.852 -5.055 -9.068 294 HB2 LEU 67 HB2 LEU 34 -11.238 -5.759 -7.178 295 HB3 LEU 67 HB3 LEU 34 -10.057 -7.009 -6.765 296 HG LEU 67 HG LEU 34 -8.344 -5.292 -6.303 297 HD11 LEU 67 HD11 LEU 34 -8.933 -3.474 -7.836 298 HD12 LEU 67 HD12 LEU 34 -10.505 -3.255 -7.030 299 HD13 LEU 67 HD13 LEU 34 -8.986 -2.868 -6.195 300 HD21 LEU 67 HD21 LEU 34 -9.889 -5.979 -4.505 301 HD22 LEU 67 HD22 LEU 34 -9.344 -4.311 -4.294 302 HD23 LEU 67 HD23 LEU 34 -10.978 -4.638 -4.913 303 H THR 68 H THR 35 -8.490 -8.399 -8.369 304 HA THR 68 HA THR 35 -5.888 -7.294 -7.756 305 HB THR 68 HB THR 35 -5.254 -9.763 -7.859 306 HG1 THR 68 HG1 THR 35 -7.173 -11.160 -7.989 307 HG21 THR 68 HG21 THR 35 -6.443 -10.381 -5.859 308 HG22 THR 68 HG22 THR 35 -5.984 -8.698 -5.755 309 HG23 THR 68 HG23 THR 35 -7.683 -9.128 -6.135 310 H GLY 69 H GLY 36 -7.354 -8.663 -10.684 311 HA2 GLY 69 HA2 GLY 36 -6.545 -8.812 -12.838 312 HA3 GLY 69 HA3 GLY 36 -5.005 -8.072 -12.342 313 H ASP 70 H ASP 37 -6.312 -10.784 -10.438 314 HA ASP 70 HA ASP 37 -4.527 -12.753 -11.732 315 HB2 ASP 70 HB2 ASP 37 -3.306 -11.513 -9.827 316 HB3 ASP 70 HB3 ASP 37 -4.464 -12.268 -8.718 317 H TRP 71 H TRP 38 -4.969 -14.953 -10.724 318 HA TRP 71 HA TRP 38 -7.843 -15.325 -10.078 319 HB2 TRP 71 HB2 TRP 38 -5.611 -17.319 -10.645 320 HB3 TRP 71 HB3 TRP 38 -7.282 -17.730 -10.273 321 HD1 TRP 71 HD1 TRP 38 -5.093 -17.202 -13.139 322 HE1 TRP 71 HE1 TRP 38 -6.408 -17.014 -15.330 323 HE3 TRP 71 HE3 TRP 38 -9.747 -16.398 -11.193 324 HZ2 TRP 71 HZ2 TRP 38 -9.156 -16.447 -16.130 325 HZ3 TRP 71 HZ3 TRP 38 -11.646 -15.889 -12.661 326 HH2 TRP 71 HH2 TRP 38 -11.397 -15.943 -15.134 327 H ILE 72 H ILE 39 -8.378 -16.531 -8.148 328 HA ILE 72 HA ILE 39 -7.053 -15.867 -5.759 329 HB ILE 72 HB ILE 39 -8.941 -18.104 -6.523 330 HG12 ILE 72 HG12 ILE 39 -9.709 -15.638 -6.474 331 HG13 ILE 72 HG13 ILE 39 -10.691 -16.839 -5.659 332 HG21 ILE 72 HG21 ILE 39 -7.830 -17.558 -3.758 333 HG22 ILE 72 HG22 ILE 39 -9.321 -18.474 -4.054 334 HG23 ILE 72 HG23 ILE 39 -7.793 -19.050 -4.711 335 HD11 ILE 72 HD11 ILE 39 -10.344 -14.635 -4.457 336 HD12 ILE 72 HD12 ILE 39 -10.064 -16.104 -3.520 337 HD13 ILE 72 HD13 ILE 39 -8.675 -15.150 -4.136 338 HA PRO 73 HA PRO 40 -3.703 -18.755 -6.384 339 HB2 PRO 73 HB2 PRO 40 -1.987 -18.043 -4.411 340 HB3 PRO 73 HB3 PRO 40 -2.441 -16.894 -5.678 341 HG2 PRO 73 HG2 PRO 40 -3.737 -17.176 -2.946 342 HG3 PRO 73 HG3 PRO 40 -3.023 -15.707 -3.687 343 HD2 PRO 73 HD2 PRO 40 -5.706 -16.317 -3.818 344 HD3 PRO 73 HD3 PRO 40 -4.849 -15.500 -5.164 345 H PHE 74 H PHE 41 -6.093 -19.981 -5.196 346 HA PHE 74 HA PHE 41 -5.726 -20.887 -2.554 347 HB2 PHE 74 HB2 PHE 41 -7.518 -22.407 -2.916 348 HB3 PHE 74 HB3 PHE 41 -7.928 -20.919 -3.697 349 HD1 PHE 74 HD1 PHE 41 -7.726 -20.808 -6.319 350 HD2 PHE 74 HD2 PHE 41 -7.445 -24.468 -4.050 351 HE1 PHE 74 HE1 PHE 41 -8.214 -22.103 -8.359 352 HE2 PHE 74 HE2 PHE 41 -8.013 -25.764 -6.094 353 HZ PHE 74 HZ PHE 41 -8.369 -24.587 -8.257 354 H LYS 75 H LYS 42 -5.252 -22.847 -5.523 355 HA LYS 75 HA LYS 42 -3.967 -24.951 -4.088 356 HB2 LYS 75 HB2 LYS 42 -5.281 -24.987 -6.263 357 HB3 LYS 75 HB3 LYS 42 -3.861 -24.354 -7.080 358 HG2 LYS 75 HG2 LYS 42 -2.577 -26.385 -6.395 359 HG3 LYS 75 HG3 LYS 42 -3.974 -26.957 -5.463 360 HD2 LYS 75 HD2 LYS 42 -5.316 -27.062 -7.545 361 HD3 LYS 75 HD3 LYS 42 -3.920 -26.530 -8.496 362 HE2 LYS 75 HE2 LYS 42 -4.034 -29.078 -6.798 363 HE3 LYS 75 HE3 LYS 42 -4.399 -29.020 -8.520 364 HZ1 LYS 75 HZ1 LYS 42 -2.140 -29.712 -8.189 365 HZ2 LYS 75 HZ2 LYS 42 -2.099 -28.247 -8.904 366 HZ3 LYS 75 HZ3 LYS 42 -1.759 -28.394 -7.309 367 H GLN 76 H GLN 43 -2.759 -22.003 -5.483 368 HA GLN 76 HA GLN 43 0.008 -22.830 -5.780 369 HB2 GLN 76 HB2 GLN 43 -1.288 -20.077 -5.705 370 HB3 GLN 76 HB3 GLN 43 0.367 -20.413 -6.200 371 HG2 GLN 76 HG2 GLN 43 -0.265 -20.903 -8.305 372 HG3 GLN 76 HG3 GLN 43 -1.413 -22.109 -7.772 373 HE21 GLN 76 HE22 GLN 43 -3.649 -21.631 -8.182 374 HE22 GLN 76 HE21 GLN 43 -4.255 -20.024 -8.467 375 H LEU 77 H LEU 44 -1.889 -21.062 -3.269 376 HA LEU 77 HA LEU 44 0.358 -20.836 -1.413 377 HB2 LEU 77 HB2 LEU 44 -2.615 -20.395 -1.145 378 HB3 LEU 77 HB3 LEU 44 -1.478 -20.226 0.200 379 HG LEU 77 HG LEU 44 -1.405 -18.577 -2.352 380 HD11 LEU 77 HD11 LEU 44 -2.243 -16.719 -1.011 381 HD12 LEU 77 HD12 LEU 44 -3.367 -18.081 -0.885 382 HD13 LEU 77 HD13 LEU 44 -2.248 -17.730 0.451 383 HD21 LEU 77 HD21 LEU 44 0.171 -17.111 -1.090 384 HD22 LEU 77 HD22 LEU 44 0.230 -18.331 0.205 385 HD23 LEU 77 HD23 LEU 44 0.846 -18.705 -1.426 386 H GLY 78 H GLY 45 -2.191 -23.222 -2.095 387 HA2 GLY 78 HA2 GLY 45 -1.419 -25.506 -1.734 388 HA3 GLY 78 HA3 GLY 45 -0.826 -25.047 -0.137 389 H TYR 79 H TYR 46 -3.884 -23.638 -0.989 390 HA TYR 79 HA TYR 46 -5.339 -25.297 0.940 391 HB2 TYR 79 HB2 TYR 46 -6.308 -23.065 -0.893 392 HB3 TYR 79 HB3 TYR 46 -7.173 -23.771 0.466 393 HD1 TYR 79 HD2 TYR 46 -6.221 -23.506 2.822 394 HD2 TYR 79 HD1 TYR 46 -4.744 -21.284 -0.563 395 HE1 TYR 79 HE2 TYR 46 -5.120 -21.944 4.344 396 HE2 TYR 79 HE1 TYR 46 -3.670 -19.660 0.955 397 HH TYR 79 HH TYR 46 -3.785 -20.004 4.545 398 HA PRO 80 HA PRO 47 -6.291 -27.960 -2.461 399 HB2 PRO 80 HB2 PRO 47 -8.530 -29.361 -1.604 400 HB3 PRO 80 HB3 PRO 47 -6.892 -29.604 -0.930 401 HG2 PRO 80 HG2 PRO 47 -9.100 -27.811 0.158 402 HG3 PRO 80 HG3 PRO 47 -8.137 -29.043 1.047 403 HD2 PRO 80 HD2 PRO 47 -7.397 -26.454 1.148 404 HD3 PRO 80 HD3 PRO 47 -6.159 -27.717 0.932 405 H THR 81 H THR 48 -8.946 -25.816 -1.357 406 HA THR 81 HA THR 48 -10.021 -25.745 -4.124 407 HB THR 81 HB THR 48 -12.296 -25.925 -2.959 408 HG1 THR 81 HG1 THR 48 -12.041 -26.975 -0.792 409 HG21 THR 81 HG21 THR 48 -10.622 -28.403 -2.413 410 HG22 THR 81 HG22 THR 48 -12.364 -28.299 -2.730 411 HG23 THR 81 HG23 THR 48 -11.206 -27.948 -4.029 412 H LEU 82 H LEU 49 -11.608 -23.958 -4.376 413 HA LEU 82 HA LEU 49 -10.687 -21.427 -3.371 414 HB2 LEU 82 HB2 LEU 49 -13.363 -22.316 -4.579 415 HB3 LEU 82 HB3 LEU 49 -13.066 -20.669 -4.079 416 HG LEU 82 HG LEU 49 -12.806 -20.763 -6.432 417 HD11 LEU 82 HD11 LEU 49 -10.541 -19.917 -6.741 418 HD12 LEU 82 HD12 LEU 49 -11.252 -19.300 -5.231 419 HD13 LEU 82 HD13 LEU 49 -10.033 -20.602 -5.207 420 HD21 LEU 82 HD21 LEU 49 -11.242 -22.142 -7.641 421 HD22 LEU 82 HD22 LEU 49 -10.634 -22.875 -6.157 422 HD23 LEU 82 HD23 LEU 49 -12.307 -23.190 -6.695 423 H GLU 83 H GLU 50 -13.324 -23.625 -2.295 424 HA GLU 83 HA GLU 50 -14.214 -21.850 -0.260 425 HB2 GLU 83 HB2 GLU 50 -15.386 -23.668 0.725 426 HB3 GLU 83 HB3 GLU 50 -15.555 -23.756 -1.024 427 HG2 GLU 83 HG2 GLU 50 -13.904 -25.583 -1.103 428 HG3 GLU 83 HG3 GLU 50 -13.655 -25.466 0.643 429 H ALA 84 H ALA 51 -11.637 -24.442 -0.143 430 HA ALA 84 HA ALA 51 -11.154 -24.137 2.625 431 HB1 ALA 84 HB1 ALA 51 -9.036 -25.266 2.176 432 HB2 ALA 84 HB2 ALA 51 -10.385 -26.045 1.330 433 HB3 ALA 84 HB3 ALA 51 -9.253 -25.007 0.423 434 H TYR 85 H TYR 52 -9.683 -22.413 -0.162 435 HA TYR 85 HA TYR 52 -7.878 -20.779 1.322 436 HB2 TYR 85 HB2 TYR 52 -7.719 -20.857 -1.050 437 HB3 TYR 85 HB3 TYR 52 -9.395 -20.375 -1.271 438 HD1 TYR 85 HD1 TYR 52 -6.047 -19.148 -0.147 439 HD2 TYR 85 HD2 TYR 52 -10.059 -18.083 -1.348 440 HE1 TYR 85 HE1 TYR 52 -5.354 -16.782 -0.301 441 HE2 TYR 85 HE2 TYR 52 -9.400 -15.724 -1.448 442 HH TYR 85 HH TYR 52 -7.607 -14.178 -1.388 443 H LEU 86 H LEU 53 -11.365 -20.202 0.433 444 HA LEU 86 HA LEU 53 -11.533 -17.738 1.855 445 HB2 LEU 86 HB2 LEU 53 -13.645 -19.742 0.984 446 HB3 LEU 86 HB3 LEU 53 -14.006 -18.128 1.606 447 HG LEU 86 HG LEU 53 -12.206 -18.459 -0.812 448 HD11 LEU 86 HD11 LEU 53 -14.290 -18.121 -2.196 449 HD12 LEU 86 HD12 LEU 53 -14.151 -19.702 -1.422 450 HD13 LEU 86 HD13 LEU 53 -15.232 -18.504 -0.719 451 HD21 LEU 86 HD21 LEU 53 -12.967 -16.208 -1.307 452 HD22 LEU 86 HD22 LEU 53 -14.093 -16.232 0.074 453 HD23 LEU 86 HD23 LEU 53 -12.332 -16.247 0.341 454 H ARG 87 H ARG 54 -12.140 -21.077 2.976 455 HA ARG 87 HA ARG 54 -13.158 -20.458 5.610 456 HB2 ARG 87 HB2 ARG 54 -11.477 -22.810 4.588 457 HB3 ARG 87 HB3 ARG 54 -11.771 -22.582 6.287 458 HG2 ARG 87 HG2 ARG 54 -13.289 -24.178 5.703 459 HG3 ARG 87 HG3 ARG 54 -14.249 -22.707 5.866 460 HD2 ARG 87 HD2 ARG 54 -14.476 -22.541 3.436 461 HD3 ARG 87 HD3 ARG 54 -13.139 -23.669 3.239 462 HE ARG 87 HE ARG 54 -14.586 -25.241 2.918 463 HH11 ARG 87 HH11 ARG 54 -15.981 -23.528 5.743 464 HH12 ARG 87 HH12 ARG 54 -17.346 -24.577 5.821 465 HH21 ARG 87 HH21 ARG 54 -16.443 -26.408 2.913 466 HH22 ARG 87 HH22 ARG 54 -17.593 -26.305 4.222 467 H SER 88 H SER 55 -9.857 -20.511 4.295 468 HA SER 88 HA SER 55 -8.587 -20.396 6.858 469 HB2 SER 88 HB2 SER 55 -7.448 -20.094 4.064 470 HB3 SER 88 HB3 SER 55 -6.530 -20.373 5.550 471 HG SER 88 HG SER 55 -8.372 -22.089 4.247 472 H VAL 89 H VAL 56 -10.290 -17.885 5.760 473 HA VAL 89 HA VAL 56 -8.372 -15.912 6.879 474 HB VAL 89 HB VAL 56 -8.189 -15.712 4.534 475 HG11 VAL 89 HG11 VAL 56 -10.257 -15.013 3.125 476 HG12 VAL 89 HG12 VAL 56 -9.990 -16.717 3.509 477 HG13 VAL 89 HG13 VAL 56 -11.197 -15.792 4.413 478 HG21 VAL 89 HG21 VAL 56 -9.943 -13.373 5.246 479 HG22 VAL 89 HG22 VAL 56 -8.277 -13.576 5.847 480 HG23 VAL 89 HG23 VAL 56 -8.594 -13.448 4.104 481 HA PRO 90 HA PRO 57 -12.823 -16.074 8.481 482 HB2 PRO 90 HB2 PRO 57 -12.632 -17.103 10.987 483 HB3 PRO 90 HB3 PRO 57 -12.631 -18.122 9.516 484 HG2 PRO 90 HG2 PRO 57 -10.232 -17.165 11.118 485 HG3 PRO 90 HG3 PRO 57 -10.595 -18.827 10.533 486 HD2 PRO 90 HD2 PRO 57 -8.943 -17.099 9.177 487 HD3 PRO 90 HD3 PRO 57 -9.949 -18.320 8.378 488 H ALA 91 H ALA 58 -9.880 -14.655 9.764 489 HA ALA 91 HA ALA 58 -11.232 -12.947 11.708 490 HB1 ALA 91 HB1 ALA 58 -8.390 -12.862 10.587 491 HB2 ALA 91 HB2 ALA 58 -8.992 -11.984 12.009 492 HB3 ALA 91 HB3 ALA 58 -8.908 -13.750 12.046 493 H VAL 92 H VAL 59 -10.981 -12.843 8.311 494 HA VAL 92 HA VAL 59 -11.424 -9.882 8.290 495 HB VAL 92 HB VAL 59 -9.702 -11.387 6.294 496 HG11 VAL 92 HG11 VAL 59 -8.925 -9.157 5.629 497 HG12 VAL 92 HG12 VAL 59 -10.674 -9.295 5.456 498 HG13 VAL 92 HG13 VAL 59 -9.993 -8.406 6.837 499 HG21 VAL 92 HG21 VAL 59 -7.726 -10.269 7.349 500 HG22 VAL 92 HG22 VAL 59 -8.761 -9.763 8.699 501 HG23 VAL 92 HG23 VAL 59 -8.452 -11.494 8.379 502 H VAL 93 H VAL 60 -12.277 -13.063 7.071 503 HA VAL 93 HA VAL 60 -14.341 -11.932 5.263 504 HB VAL 93 HB VAL 60 -12.139 -13.943 4.756 505 HG11 VAL 93 HG11 VAL 60 -14.543 -13.627 2.940 506 HG12 VAL 93 HG12 VAL 60 -13.036 -14.477 2.545 507 HG13 VAL 93 HG13 VAL 60 -14.063 -15.088 3.835 508 HG21 VAL 93 HG21 VAL 60 -12.972 -11.364 3.404 509 HG22 VAL 93 HG22 VAL 60 -11.451 -11.719 4.236 510 HG23 VAL 93 HG23 VAL 60 -11.792 -12.498 2.700 511 H ARG 94 H ARG 61 -15.943 -13.651 4.776 512 HA ARG 94 HA ARG 61 -16.458 -15.565 6.979 513 HB2 ARG 94 HB2 ARG 61 -17.363 -13.596 7.899 514 HB3 ARG 94 HB3 ARG 61 -17.969 -13.007 6.357 515 HG2 ARG 94 HG2 ARG 61 -19.808 -14.619 6.389 516 HG3 ARG 94 HG3 ARG 61 -19.117 -15.433 7.805 517 HD2 ARG 94 HD2 ARG 61 -21.049 -13.944 8.343 518 HD3 ARG 94 HD3 ARG 61 -19.566 -13.555 9.222 519 HE ARG 94 HE ARG 61 -19.889 -12.015 6.760 520 HH11 ARG 94 HH11 ARG 61 -21.235 -12.129 10.028 521 HH12 ARG 94 HH12 ARG 61 -21.259 -10.422 10.243 522 HH21 ARG 94 HH21 ARG 61 -19.588 -9.742 7.173 523 HH22 ARG 94 HH22 ARG 61 -20.444 -9.018 8.498 524 H ILE 95 H ILE 62 -18.146 -17.126 6.279 525 HA ILE 95 HA ILE 62 -19.025 -16.924 3.488 526 HB ILE 95 HB ILE 62 -18.293 -19.221 2.994 527 HG12 ILE 95 HG12 ILE 62 -16.674 -19.052 5.560 528 HG13 ILE 95 HG13 ILE 62 -18.051 -20.121 5.252 529 HG21 ILE 95 HG21 ILE 62 -16.887 -17.184 2.337 530 HG22 ILE 95 HG22 ILE 62 -15.818 -17.583 3.692 531 HG23 ILE 95 HG23 ILE 62 -16.068 -18.732 2.357 532 HD11 ILE 95 HD11 ILE 62 -16.058 -21.396 5.047 533 HD12 ILE 95 HD12 ILE 62 -16.751 -21.215 3.415 534 HD13 ILE 95 HD13 ILE 62 -15.331 -20.252 3.913 535 H GLU 96 H GLU 63 -20.882 -18.193 3.068 536 HA GLU 96 HA GLU 63 -21.967 -19.825 5.312 537 HB2 GLU 96 HB2 GLU 63 -23.523 -17.833 3.604 538 HB3 GLU 96 HB3 GLU 63 -24.235 -19.106 4.602 539 HG2 GLU 96 HG2 GLU 63 -22.973 -18.090 6.589 540 HG3 GLU 96 HG3 GLU 63 -22.628 -16.705 5.553 541 H ALA 97 H ALA 64 -21.480 -21.780 4.465 542 HA ALA 97 HA ALA 64 -22.005 -22.479 1.662 543 HB1 ALA 97 HB1 ALA 64 -21.424 -24.750 2.393 544 HB2 ALA 97 HB2 ALA 64 -20.169 -23.590 2.864 545 HB3 ALA 97 HB3 ALA 64 -21.325 -24.202 4.078 546 H SER 98 H SER 65 -24.001 -22.998 0.934 547 HA SER 98 HA SER 65 -26.202 -23.016 2.925 548 HB2 SER 98 HB2 SER 65 -26.064 -21.378 0.946 549 HB3 SER 98 HB3 SER 65 -26.419 -22.769 -0.093 550 HG SER 98 HG SER 65 -28.017 -21.542 1.918 551 H ARG 99 H ARG 66 -28.028 -24.414 2.451 552 HA ARG 99 HA ARG 66 -27.425 -27.128 2.514 553 HB2 ARG 99 HB2 ARG 66 -29.727 -27.580 2.496 554 HB3 ARG 99 HB3 ARG 66 -29.532 -26.063 3.339 555 HG2 ARG 99 HG2 ARG 66 -30.570 -26.451 0.498 556 HG3 ARG 99 HG3 ARG 66 -31.521 -26.084 1.934 557 HD2 ARG 99 HD2 ARG 66 -30.392 -23.874 2.129 558 HD3 ARG 99 HD3 ARG 66 -29.478 -24.238 0.649 559 HE ARG 99 HE ARG 66 -32.340 -24.477 0.306 560 HH11 ARG 99 HH11 ARG 66 -29.614 -22.168 0.246 561 HH12 ARG 99 HH12 ARG 66 -30.416 -21.045 -0.794 562 HH21 ARG 99 HH21 ARG 66 -33.386 -22.992 -1.093 563 HH22 ARG 99 HH22 ARG 66 -32.615 -21.517 -1.565 564 H SER 100 H SER 67 -28.052 -25.193 -0.393 565 HA SER 100 HA SER 67 -28.470 -27.375 -2.169 566 HB2 SER 100 HB2 SER 67 -27.427 -24.596 -2.821 567 HB3 SER 100 HB3 SER 67 -28.367 -25.669 -3.872 568 HG SER 100 HG SER 67 -30.174 -25.286 -2.642 569 H GLY 101 H GLY 68 -25.569 -26.434 -0.587 570 HA2 GLY 101 HA2 GLY 68 -23.490 -27.409 -0.836 571 HA3 GLY 101 HA3 GLY 68 -23.898 -27.981 -2.463 572 H GLU 102 H GLU 69 -24.832 -24.716 -2.229 573 HA GLU 102 HA GLU 69 -22.444 -23.728 -3.647 574 HB2 GLU 102 HB2 GLU 69 -25.078 -22.426 -2.773 575 HB3 GLU 102 HB3 GLU 69 -23.795 -21.574 -3.619 576 HG2 GLU 102 HG2 GLU 69 -25.422 -23.913 -4.688 577 HG3 GLU 102 HG3 GLU 69 -25.558 -22.223 -5.170 578 H ILE 103 H ILE 70 -21.503 -21.659 -2.724 579 HA ILE 103 HA ILE 70 -21.881 -21.235 0.125 580 HB ILE 103 HB ILE 70 -20.004 -22.626 0.341 581 HG12 ILE 103 HG12 ILE 70 -19.824 -20.284 1.401 582 HG13 ILE 103 HG13 ILE 70 -18.450 -21.366 1.420 583 HG21 ILE 103 HG21 ILE 70 -17.879 -22.401 -0.915 584 HG22 ILE 103 HG22 ILE 70 -19.253 -23.044 -1.833 585 HG23 ILE 103 HG23 ILE 70 -18.743 -21.356 -2.063 586 HD11 ILE 103 HD11 ILE 70 -18.672 -19.247 -0.752 587 HD12 ILE 103 HD12 ILE 70 -17.980 -18.908 0.823 588 HD13 ILE 103 HD13 ILE 70 -17.248 -20.145 -0.205 589 H VAL 104 H VAL 71 -21.873 -19.148 0.628 590 HA VAL 104 HA VAL 71 -21.371 -17.205 -1.577 591 HB VAL 104 HB VAL 71 -23.191 -16.869 0.844 592 HG11 VAL 104 HG11 VAL 71 -24.180 -15.064 -0.533 593 HG12 VAL 104 HG12 VAL 71 -22.453 -14.797 -0.269 594 HG13 VAL 104 HG13 VAL 71 -23.023 -15.411 -1.839 595 HG21 VAL 104 HG21 VAL 71 -25.129 -17.302 -0.652 596 HG22 VAL 104 HG22 VAL 71 -24.020 -17.823 -1.934 597 HG23 VAL 104 HG23 VAL 71 -24.148 -18.747 -0.426 598 H CYS 105 H CYS 72 -19.754 -15.762 -1.172 599 HA CYS 105 HA CYS 72 -18.318 -15.928 1.407 600 HB2 CYS 105 HB2 CYS 72 -17.462 -14.378 -1.056 601 HB3 CYS 105 HB3 CYS 72 -16.440 -15.075 0.219 602 HG CYS 105 HG CYS 72 -18.139 -16.495 -2.253 603 H TYR 106 H TYR 73 -17.816 -14.031 2.619 604 HA TYR 106 HA TYR 73 -19.118 -11.448 1.911 605 HB2 TYR 106 HB2 TYR 73 -19.461 -13.066 4.476 606 HB3 TYR 106 HB3 TYR 73 -19.934 -11.384 4.315 607 HD1 TYR 106 HD1 TYR 73 -21.669 -10.730 2.567 608 HD2 TYR 106 HD2 TYR 73 -20.912 -14.828 3.759 609 HE1 TYR 106 HE1 TYR 73 -23.955 -11.318 1.916 610 HE2 TYR 106 HE2 TYR 73 -23.162 -15.471 2.955 611 HH TYR 106 HH TYR 73 -25.512 -13.080 1.595 612 H ALA 107 H ALA 74 -18.363 -9.747 3.531 613 HA ALA 107 HA ALA 74 -15.480 -10.154 4.178 614 HB1 ALA 107 HB1 ALA 74 -15.423 -7.753 4.512 615 HB2 ALA 107 HB2 ALA 74 -16.155 -8.090 2.947 616 HB3 ALA 107 HB3 ALA 74 -17.188 -7.630 4.320 617 H VAL 108 H VAL 75 -14.758 -9.335 6.264 618 HA VAL 108 HA VAL 75 -16.788 -9.068 8.401 619 HB VAL 108 HB VAL 75 -15.097 -11.384 8.048 620 HG11 VAL 108 HG11 VAL 75 -14.225 -11.736 10.276 621 HG12 VAL 108 HG12 VAL 75 -13.457 -10.312 9.553 622 HG13 VAL 108 HG13 VAL 75 -14.723 -10.109 10.785 623 HG21 VAL 108 HG21 VAL 75 -17.500 -11.373 8.613 624 HG22 VAL 108 HG22 VAL 75 -16.546 -12.315 9.779 625 HG23 VAL 108 HG23 VAL 75 -17.121 -10.689 10.208 626 H ALA 109 H ALA 76 -13.546 -8.271 7.181 627 HA ALA 109 HA ALA 76 -13.547 -5.901 8.888 628 HB1 ALA 109 HB1 ALA 76 -11.307 -6.243 9.745 629 HB2 ALA 109 HB2 ALA 76 -12.300 -7.609 10.262 630 HB3 ALA 109 HB3 ALA 76 -11.155 -7.789 8.910 Start of MODEL 14 1 H1 GLY -2 H1 GLY -2 5.673 -4.153 -6.491 2 H2 GLY -2 H2 GLY -2 5.539 -2.746 -5.660 3 H3 GLY -2 H3 GLY -2 6.309 -4.031 -4.988 4 HA2 GLY -2 HA2 GLY -2 3.440 -3.932 -5.651 5 HA3 GLY -2 HA3 GLY -2 4.279 -5.307 -4.913 6 H HIS -1 H HIS -1 2.245 -2.821 -4.160 7 HA HIS -1 HA HIS -1 3.437 -1.704 -1.803 8 HB2 HIS -1 HB2 HIS -1 1.598 -0.683 -3.144 9 HB3 HIS -1 HB3 HIS -1 0.498 -1.926 -2.556 10 HD2 HIS -1 HD2 HIS -1 -0.821 -1.258 -0.403 11 HE1 HIS -1 HE1 HIS -1 1.708 1.820 1.098 12 HE2 HIS -1 HE2 HIS -1 -0.489 0.582 1.437 13 H MET 34 H MET 1 1.664 -4.680 -2.387 14 HA MET 34 HA MET 1 1.709 -5.340 0.527 15 HB2 MET 34 HB2 MET 1 -0.271 -6.218 -1.612 16 HB3 MET 34 HB3 MET 1 -0.199 -6.830 0.045 17 HG2 MET 34 HG2 MET 1 -1.791 -5.285 0.420 18 HG3 MET 34 HG3 MET 1 -0.423 -4.193 0.560 19 HE1 MET 34 HE1 MET 1 -3.823 -4.835 -1.020 20 HE2 MET 34 HE2 MET 1 -3.760 -4.136 -2.651 21 HE3 MET 34 HE3 MET 1 -2.968 -5.674 -2.331 22 H LEU 35 H LEU 2 2.239 -7.533 1.027 23 HA LEU 35 HA LEU 2 4.079 -8.904 -0.829 24 HB2 LEU 35 HB2 LEU 2 2.938 -9.773 1.868 25 HB3 LEU 35 HB3 LEU 2 4.240 -10.571 0.991 26 HG LEU 35 HG LEU 2 4.362 -7.776 2.219 27 HD11 LEU 35 HD11 LEU 2 4.410 -9.626 3.843 28 HD12 LEU 35 HD12 LEU 2 5.766 -10.377 2.971 29 HD13 LEU 35 HD13 LEU 2 5.967 -8.797 3.760 30 HD21 LEU 35 HD21 LEU 2 6.493 -9.339 0.690 31 HD22 LEU 35 HD22 LEU 2 5.757 -7.785 0.216 32 HD23 LEU 35 HD23 LEU 2 6.791 -7.873 1.648 33 H GLU 36 H GLU 3 3.564 -11.358 -1.303 34 HA GLU 36 HA GLU 3 1.329 -11.336 -2.946 35 HB2 GLU 36 HB2 GLU 3 3.224 -12.857 -3.255 36 HB3 GLU 36 HB3 GLU 3 2.733 -13.779 -1.825 37 HG2 GLU 36 HG2 GLU 3 0.637 -14.439 -2.911 38 HG3 GLU 36 HG3 GLU 3 1.019 -13.433 -4.310 39 H ALA 37 H ALA 4 1.472 -13.162 0.128 40 HA ALA 37 HA ALA 4 -1.258 -13.942 -0.118 41 HB1 ALA 37 HB1 ALA 4 -1.112 -14.748 2.175 42 HB2 ALA 37 HB2 ALA 4 0.347 -15.194 1.279 43 HB3 ALA 37 HB3 ALA 4 0.391 -13.836 2.436 44 H ASP 38 H ASP 5 0.262 -11.138 1.421 45 HA ASP 38 HA ASP 5 -2.057 -10.201 2.842 46 HB2 ASP 38 HB2 ASP 5 0.304 -9.572 3.336 47 HB3 ASP 38 HB3 ASP 5 0.370 -8.657 1.836 48 H LEU 39 H LEU 6 -0.724 -9.574 -0.408 49 HA LEU 39 HA LEU 6 -2.430 -7.488 -1.236 50 HB2 LEU 39 HB2 LEU 6 -0.345 -8.231 -2.405 51 HB3 LEU 39 HB3 LEU 6 -1.097 -9.719 -2.876 52 HG LEU 39 HG LEU 6 -2.423 -7.143 -3.721 53 HD11 LEU 39 HD11 LEU 6 -0.976 -7.040 -5.721 54 HD12 LEU 39 HD12 LEU 6 -0.049 -6.780 -4.242 55 HD13 LEU 39 HD13 LEU 6 0.026 -8.351 -5.071 56 HD21 LEU 39 HD21 LEU 6 -2.924 -8.439 -5.783 57 HD22 LEU 39 HD22 LEU 6 -2.095 -9.839 -5.091 58 HD23 LEU 39 HD23 LEU 6 -3.588 -9.215 -4.353 59 H VAL 40 H VAL 7 -2.616 -11.026 -1.894 60 HA VAL 40 HA VAL 7 -5.093 -10.748 -3.226 61 HB VAL 40 HB VAL 7 -5.161 -13.163 -3.275 62 HG11 VAL 40 HG11 VAL 7 -3.540 -11.865 -4.716 63 HG12 VAL 40 HG12 VAL 7 -2.259 -12.276 -3.578 64 HG13 VAL 40 HG13 VAL 7 -3.110 -13.553 -4.450 65 HG21 VAL 40 HG21 VAL 7 -4.503 -13.741 -0.963 66 HG22 VAL 40 HG22 VAL 7 -3.482 -14.567 -2.137 67 HG23 VAL 40 HG23 VAL 7 -2.873 -13.136 -1.289 68 H SER 41 H SER 8 -4.376 -11.456 0.218 69 HA SER 41 HA SER 8 -7.086 -11.941 0.950 70 HB2 SER 41 HB2 SER 8 -4.799 -10.916 2.679 71 HB3 SER 41 HB3 SER 8 -6.325 -11.624 3.247 72 HG SER 41 HG SER 8 -4.134 -12.844 1.958 73 H LYS 42 H LYS 9 -5.194 -8.795 1.045 74 HA LYS 42 HA LYS 9 -7.452 -7.340 2.181 75 HB2 LYS 42 HB2 LYS 9 -4.893 -6.511 0.752 76 HB3 LYS 42 HB3 LYS 9 -6.127 -5.329 1.231 77 HG2 LYS 42 HG2 LYS 9 -5.970 -5.951 3.567 78 HG3 LYS 42 HG3 LYS 9 -4.853 -7.289 3.190 79 HD2 LYS 42 HD2 LYS 9 -3.183 -5.718 2.335 80 HD3 LYS 42 HD3 LYS 9 -4.246 -4.329 2.685 81 HE2 LYS 42 HE2 LYS 9 -4.119 -4.686 5.046 82 HE3 LYS 42 HE3 LYS 9 -3.464 -6.318 4.844 83 HZ1 LYS 42 HZ1 LYS 9 -1.725 -4.786 5.471 84 HZ2 LYS 42 HZ2 LYS 9 -1.441 -5.384 3.965 85 HZ3 LYS 42 HZ3 LYS 9 -1.995 -3.833 4.162 86 H MET 43 H MET 10 -6.332 -7.950 -1.198 87 HA MET 43 HA MET 10 -8.259 -6.203 -2.420 88 HB2 MET 43 HB2 MET 10 -6.856 -8.694 -3.464 89 HB3 MET 43 HB3 MET 10 -7.784 -7.568 -4.456 90 HG2 MET 43 HG2 MET 10 -5.490 -6.502 -2.795 91 HG3 MET 43 HG3 MET 10 -5.171 -7.398 -4.270 92 HE1 MET 43 HE1 MET 10 -3.740 -5.154 -4.634 93 HE2 MET 43 HE2 MET 10 -4.287 -5.981 -6.097 94 HE3 MET 43 HE3 MET 10 -4.395 -4.212 -5.994 95 H LEU 44 H LEU 11 -8.315 -9.756 -1.797 96 HA LEU 44 HA LEU 11 -10.900 -10.464 -2.588 97 HB2 LEU 44 HB2 LEU 11 -9.261 -12.091 -1.751 98 HB3 LEU 44 HB3 LEU 11 -9.140 -11.258 -0.220 99 HG LEU 44 HG LEU 11 -11.578 -11.877 0.213 100 HD11 LEU 44 HD11 LEU 11 -10.921 -13.852 -2.015 101 HD12 LEU 44 HD12 LEU 11 -12.388 -13.837 -1.005 102 HD13 LEU 44 HD13 LEU 11 -12.081 -12.513 -2.158 103 HD21 LEU 44 HD21 LEU 11 -9.392 -13.959 0.071 104 HD22 LEU 44 HD22 LEU 11 -9.785 -12.904 1.431 105 HD23 LEU 44 HD23 LEU 11 -10.926 -14.172 0.937 106 H ARG 45 H ARG 12 -9.882 -9.352 0.646 107 HA ARG 45 HA ARG 12 -12.385 -9.025 1.856 108 HB2 ARG 45 HB2 ARG 12 -10.492 -9.061 3.148 109 HB3 ARG 45 HB3 ARG 12 -9.631 -7.881 2.197 110 HG2 ARG 45 HG2 ARG 12 -12.084 -6.954 3.660 111 HG3 ARG 45 HG3 ARG 12 -10.607 -7.315 4.549 112 HD2 ARG 45 HD2 ARG 12 -9.400 -5.753 2.813 113 HD3 ARG 45 HD3 ARG 12 -11.046 -5.118 2.537 114 HE ARG 45 HE ARG 12 -10.319 -5.475 5.323 115 HH11 ARG 45 HH12 ARG 12 -9.877 -3.064 2.718 116 HH12 ARG 45 HH11 ARG 12 -9.887 -1.730 3.815 117 HH21 ARG 45 HH21 ARG 12 -10.514 -3.830 6.653 118 HH22 ARG 45 HH22 ARG 12 -10.168 -2.172 6.193 119 H ALA 46 H ALA 13 -10.574 -6.583 -0.132 120 HA ALA 46 HA ALA 13 -12.476 -4.580 0.450 121 HB1 ALA 46 HB1 ALA 13 -11.419 -3.337 -1.444 122 HB2 ALA 46 HB2 ALA 13 -10.187 -4.092 -0.414 123 HB3 ALA 46 HB3 ALA 13 -10.606 -4.826 -1.974 124 H VAL 47 H VAL 14 -12.307 -6.908 -2.304 125 HA VAL 47 HA VAL 14 -14.573 -5.852 -3.706 126 HB VAL 47 HB VAL 14 -13.440 -8.689 -3.548 127 HG11 VAL 47 HG11 VAL 14 -15.798 -8.749 -4.320 128 HG12 VAL 47 HG12 VAL 14 -15.415 -7.548 -5.569 129 HG13 VAL 47 HG13 VAL 14 -14.658 -9.164 -5.595 130 HG21 VAL 47 HG21 VAL 14 -13.095 -6.403 -5.553 131 HG22 VAL 47 HG22 VAL 14 -11.847 -7.119 -4.518 132 HG23 VAL 47 HG23 VAL 14 -12.547 -8.061 -5.828 133 H LEU 48 H LEU 15 -14.282 -8.283 -1.067 134 HA LEU 48 HA LEU 15 -17.063 -8.891 -0.953 135 HB2 LEU 48 HB2 LEU 15 -14.872 -8.994 1.183 136 HB3 LEU 48 HB3 LEU 15 -16.465 -9.703 1.369 137 HG LEU 48 HG LEU 15 -14.716 -10.519 -0.972 138 HD11 LEU 48 HD11 LEU 15 -13.394 -10.810 1.050 139 HD12 LEU 48 HD12 LEU 15 -14.744 -11.618 1.861 140 HD13 LEU 48 HD13 LEU 15 -13.950 -12.397 0.465 141 HD21 LEU 48 HD21 LEU 15 -16.860 -11.970 0.612 142 HD22 LEU 48 HD22 LEU 15 -17.155 -11.163 -0.930 143 HD23 LEU 48 HD23 LEU 15 -16.044 -12.549 -0.840 144 H GLN 49 H GLN 16 -15.144 -6.324 0.674 145 HA GLN 49 HA GLN 16 -17.265 -5.448 2.387 146 HB2 GLN 49 HB2 GLN 16 -14.715 -4.142 1.363 147 HB3 GLN 49 HB3 GLN 16 -15.855 -3.237 2.337 148 HG2 GLN 49 HG2 GLN 16 -14.525 -5.832 3.237 149 HG3 GLN 49 HG3 GLN 16 -13.970 -4.219 3.653 150 HE21 GLN 49 HE22 GLN 16 -14.400 -5.757 5.781 151 HE22 GLN 49 HE21 GLN 16 -15.914 -5.348 6.586 152 H SER 50 H SER 17 -16.329 -4.442 -0.968 153 HA SER 50 HA SER 17 -18.379 -2.452 -1.195 154 HB2 SER 50 HB2 SER 17 -17.061 -4.201 -3.324 155 HB3 SER 50 HB3 SER 17 -17.967 -2.709 -3.625 156 HG SER 50 HG SER 17 -16.365 -1.536 -2.550 157 H HIS 51 H HIS 18 -18.327 -5.970 -1.780 158 HA HIS 51 HA HIS 18 -21.041 -5.900 -2.905 159 HB2 HIS 51 HB2 HIS 18 -18.929 -8.065 -2.783 160 HB3 HIS 51 HB3 HIS 18 -20.510 -8.216 -3.544 161 HD2 HIS 51 HD2 HIS 18 -18.883 -8.786 -5.705 162 HE1 HIS 51 HE1 HIS 18 -18.147 -4.736 -6.729 163 HE2 HIS 51 HE2 HIS 18 -18.056 -7.119 -7.580 164 H LYS 52 H LYS 19 -21.730 -5.274 -0.523 165 HA LYS 52 HA LYS 19 -21.659 -7.218 1.544 166 HB2 LYS 52 HB2 LYS 19 -23.672 -4.973 1.011 167 HB3 LYS 52 HB3 LYS 19 -23.638 -5.929 2.483 168 HG2 LYS 52 HG2 LYS 19 -21.478 -4.033 1.526 169 HG3 LYS 52 HG3 LYS 19 -22.573 -3.850 2.907 170 HD2 LYS 52 HD2 LYS 19 -21.497 -6.088 3.764 171 HD3 LYS 52 HD3 LYS 19 -20.214 -5.744 2.603 172 HE2 LYS 52 HE2 LYS 19 -21.065 -4.078 5.011 173 HE3 LYS 52 HE3 LYS 19 -19.532 -4.907 4.761 174 HZ1 LYS 52 HZ1 LYS 19 -19.171 -2.630 4.333 175 HZ2 LYS 52 HZ2 LYS 19 -19.190 -3.306 2.840 176 HZ3 LYS 52 HZ3 LYS 19 -20.491 -2.460 3.388 177 H ASN 53 H ASN 20 -23.780 -7.156 -1.257 178 HA ASN 53 HA ASN 20 -25.782 -8.941 -0.221 179 HB2 ASN 53 HB2 ASN 20 -26.008 -7.593 -2.317 180 HB3 ASN 53 HB3 ASN 20 -24.756 -8.584 -3.073 181 HD21 ASN 53 HD22 ASN 20 -28.012 -8.858 -1.462 182 HD22 ASN 53 HD21 ASN 20 -28.536 -10.207 -2.432 183 H GLY 54 H GLY 21 -22.440 -9.528 -0.849 184 HA2 GLY 54 HA2 GLY 21 -21.253 -11.420 -0.500 185 HA3 GLY 54 HA3 GLY 21 -22.718 -12.415 -0.459 186 H ILE 55 H ILE 22 -20.554 -13.303 -1.846 187 HA ILE 55 HA ILE 22 -21.474 -13.309 -4.659 188 HB ILE 55 HB ILE 22 -18.897 -13.209 -5.216 189 HG12 ILE 55 HG12 ILE 22 -18.917 -11.574 -2.637 190 HG13 ILE 55 HG13 ILE 22 -17.928 -12.978 -3.013 191 HG21 ILE 55 HG21 ILE 22 -20.772 -11.602 -5.923 192 HG22 ILE 55 HG22 ILE 22 -20.213 -10.554 -4.601 193 HG23 ILE 55 HG23 ILE 22 -19.110 -11.004 -5.942 194 HD11 ILE 55 HD11 ILE 22 -16.549 -11.000 -3.201 195 HD12 ILE 55 HD12 ILE 22 -16.875 -11.496 -4.876 196 HD13 ILE 55 HD13 ILE 22 -17.766 -10.148 -4.142 197 H VAL 56 H VAL 23 -21.678 -15.308 -5.290 198 HA VAL 56 HA VAL 23 -20.989 -17.539 -3.680 199 HB VAL 56 HB VAL 23 -21.611 -18.813 -5.769 200 HG11 VAL 56 HG11 VAL 23 -23.560 -16.671 -4.833 201 HG12 VAL 56 HG12 VAL 23 -23.989 -18.129 -5.752 202 HG13 VAL 56 HG13 VAL 23 -23.303 -18.279 -4.131 203 HG21 VAL 56 HG21 VAL 23 -22.551 -17.657 -7.689 204 HG22 VAL 56 HG22 VAL 23 -22.177 -16.066 -6.999 205 HG23 VAL 56 HG23 VAL 23 -20.868 -17.172 -7.475 206 H LEU 57 H LEU 24 -19.248 -19.226 -4.031 207 HA LEU 57 HA LEU 24 -16.875 -18.003 -4.319 208 HB2 LEU 57 HB2 LEU 24 -15.654 -19.845 -4.031 209 HB3 LEU 57 HB3 LEU 24 -17.158 -20.177 -3.259 210 HG LEU 57 HG LEU 24 -17.760 -21.640 -5.296 211 HD11 LEU 57 HD11 LEU 24 -14.890 -20.957 -6.035 212 HD12 LEU 57 HD12 LEU 24 -15.564 -22.554 -6.430 213 HD13 LEU 57 HD13 LEU 24 -16.293 -21.134 -7.103 214 HD21 LEU 57 HD21 LEU 24 -15.316 -22.306 -3.594 215 HD22 LEU 57 HD22 LEU 24 -17.008 -22.611 -3.187 216 HD23 LEU 57 HD23 LEU 24 -16.281 -23.497 -4.504 217 HA PRO 58 HA PRO 25 -16.024 -18.879 -8.881 218 HB2 PRO 58 HB2 PRO 25 -18.062 -18.957 -10.711 219 HB3 PRO 58 HB3 PRO 25 -17.384 -20.399 -9.904 220 HG2 PRO 58 HG2 PRO 25 -19.884 -18.862 -9.168 221 HG3 PRO 58 HG3 PRO 25 -19.669 -20.634 -9.304 222 HD2 PRO 58 HD2 PRO 25 -19.578 -19.349 -6.912 223 HD3 PRO 58 HD3 PRO 25 -18.542 -20.749 -7.254 224 H ARG 59 H ARG 26 -18.917 -16.951 -8.070 225 HA ARG 59 HA ARG 26 -18.239 -14.661 -9.733 226 HB2 ARG 59 HB2 ARG 26 -20.528 -15.270 -8.856 227 HB3 ARG 59 HB3 ARG 26 -19.990 -14.761 -7.236 228 HG2 ARG 59 HG2 ARG 26 -19.587 -12.492 -8.106 229 HG3 ARG 59 HG3 ARG 26 -20.001 -13.032 -9.747 230 HD2 ARG 59 HD2 ARG 26 -22.316 -13.569 -8.945 231 HD3 ARG 59 HD3 ARG 26 -21.898 -12.921 -7.364 232 HE ARG 59 HE ARG 26 -21.861 -10.753 -8.194 233 HH11 ARG 59 HH11 ARG 26 -22.454 -12.997 -10.897 234 HH12 ARG 59 HH12 ARG 26 -23.004 -11.753 -11.970 235 HH21 ARG 59 HH21 ARG 26 -22.584 -9.116 -9.634 236 HH22 ARG 59 HH22 ARG 26 -23.049 -9.517 -11.243 237 H LEU 60 H LEU 27 -17.454 -15.730 -6.417 238 HA LEU 60 HA LEU 27 -16.208 -13.402 -5.512 239 HB2 LEU 60 HB2 LEU 27 -16.678 -15.380 -4.071 240 HB3 LEU 60 HB3 LEU 27 -15.465 -16.322 -4.904 241 HG LEU 60 HG LEU 27 -14.822 -15.497 -2.697 242 HD11 LEU 60 HD11 LEU 27 -12.569 -15.198 -3.171 243 HD12 LEU 60 HD12 LEU 27 -13.188 -16.238 -4.459 244 HD13 LEU 60 HD13 LEU 27 -12.862 -14.514 -4.775 245 HD21 LEU 60 HD21 LEU 27 -14.385 -12.778 -4.000 246 HD22 LEU 60 HD22 LEU 27 -15.791 -13.194 -2.995 247 HD23 LEU 60 HD23 LEU 27 -14.194 -13.240 -2.287 248 H GLN 61 H GLN 28 -14.770 -16.230 -7.273 249 HA GLN 61 HA GLN 28 -12.196 -15.123 -7.672 250 HB2 GLN 61 HB2 GLN 28 -13.865 -17.248 -8.989 251 HB3 GLN 61 HB3 GLN 28 -12.471 -16.672 -9.886 252 HG2 GLN 61 HG2 GLN 28 -12.091 -17.456 -6.991 253 HG3 GLN 61 HG3 GLN 28 -12.286 -18.708 -8.214 254 HE21 GLN 61 HE22 GLN 28 -10.301 -19.494 -8.966 255 HE22 GLN 61 HE21 GLN 28 -8.858 -18.540 -9.130 256 H GLY 62 H GLY 29 -15.130 -14.807 -9.780 257 HA2 GLY 62 HA2 GLY 29 -13.850 -13.398 -11.866 258 HA3 GLY 62 HA3 GLY 29 -15.573 -13.289 -11.456 259 H GLU 63 H GLU 30 -15.648 -12.031 -9.018 260 HA GLU 63 HA GLU 30 -15.090 -9.316 -9.808 261 HB2 GLU 63 HB2 GLU 30 -16.054 -10.513 -7.174 262 HB3 GLU 63 HB3 GLU 30 -16.001 -8.785 -7.547 263 HG2 GLU 63 HG2 GLU 30 -17.651 -10.847 -9.076 264 HG3 GLU 63 HG3 GLU 30 -18.259 -9.754 -7.841 265 H TYR 64 H TYR 31 -13.542 -11.575 -7.492 266 HA TYR 64 HA TYR 31 -11.531 -9.897 -6.422 267 HB2 TYR 64 HB2 TYR 31 -11.825 -12.116 -5.567 268 HB3 TYR 64 HB3 TYR 31 -11.613 -12.844 -7.149 269 HD1 TYR 64 HD2 TYR 31 -9.437 -13.109 -8.220 270 HD2 TYR 64 HD1 TYR 31 -9.835 -11.459 -4.249 271 HE1 TYR 64 HE2 TYR 31 -7.024 -13.401 -7.848 272 HE2 TYR 64 HE1 TYR 31 -7.410 -11.808 -3.870 273 HH TYR 64 HH TYR 31 -5.243 -13.103 -6.464 274 H ARG 65 H ARG 32 -11.408 -11.937 -9.413 275 HA ARG 65 HA ARG 32 -8.830 -10.996 -10.131 276 HB2 ARG 65 HB2 ARG 32 -9.870 -13.158 -10.775 277 HB3 ARG 65 HB3 ARG 32 -10.961 -12.330 -11.867 278 HG2 ARG 65 HG2 ARG 32 -8.071 -11.701 -12.346 279 HG3 ARG 65 HG3 ARG 32 -8.445 -13.391 -12.463 280 HD2 ARG 65 HD2 ARG 32 -8.709 -12.701 -14.639 281 HD3 ARG 65 HD3 ARG 32 -10.391 -12.687 -14.047 282 HE ARG 65 HE ARG 32 -9.218 -10.184 -13.561 283 HH11 ARG 65 HH12 ARG 32 -10.384 -12.093 -16.325 284 HH12 ARG 65 HH11 ARG 32 -10.698 -10.726 -17.336 285 HH21 ARG 65 HH21 ARG 32 -9.546 -8.346 -14.941 286 HH22 ARG 65 HH22 ARG 32 -10.231 -8.544 -16.515 287 H SER 66 H SER 33 -12.029 -9.644 -10.743 288 HA SER 66 HA SER 33 -11.195 -7.837 -12.825 289 HB2 SER 66 HB2 SER 33 -13.435 -7.553 -10.771 290 HB3 SER 66 HB3 SER 33 -13.219 -6.588 -12.235 291 HG SER 66 HG SER 33 -13.650 -9.419 -12.124 292 H LEU 67 H LEU 34 -11.092 -7.681 -9.206 293 HA LEU 67 HA LEU 34 -10.017 -4.970 -9.277 294 HB2 LEU 67 HB2 LEU 34 -11.334 -5.755 -7.362 295 HB3 LEU 67 HB3 LEU 34 -10.114 -6.991 -7.006 296 HG LEU 67 HG LEU 34 -8.428 -5.217 -6.586 297 HD11 LEU 67 HD11 LEU 34 -9.179 -2.856 -6.279 298 HD12 LEU 67 HD12 LEU 34 -9.251 -3.362 -7.968 299 HD13 LEU 67 HD13 LEU 34 -10.745 -3.269 -7.009 300 HD21 LEU 67 HD21 LEU 34 -9.763 -6.123 -4.733 301 HD22 LEU 67 HD22 LEU 34 -9.338 -4.432 -4.454 302 HD23 LEU 67 HD23 LEU 34 -10.987 -4.852 -4.971 303 H THR 68 H THR 35 -8.525 -8.242 -8.551 304 HA THR 68 HA THR 35 -5.958 -7.043 -8.001 305 HB THR 68 HB THR 35 -5.265 -9.513 -8.066 306 HG1 THR 68 HG1 THR 35 -7.108 -10.962 -8.205 307 HG21 THR 68 HG21 THR 35 -6.315 -10.020 -5.999 308 HG22 THR 68 HG22 THR 35 -6.152 -8.270 -6.055 309 HG23 THR 68 HG23 THR 35 -7.747 -9.021 -6.379 310 H GLY 69 H GLY 36 -7.430 -8.590 -10.880 311 HA2 GLY 69 HA2 GLY 36 -6.632 -8.777 -13.048 312 HA3 GLY 69 HA3 GLY 36 -5.138 -7.924 -12.598 313 H ASP 70 H ASP 37 -6.275 -10.644 -10.577 314 HA ASP 70 HA ASP 37 -4.519 -12.592 -11.920 315 HB2 ASP 70 HB2 ASP 37 -3.211 -11.354 -10.049 316 HB3 ASP 70 HB3 ASP 37 -4.332 -12.116 -8.906 317 H TRP 71 H TRP 38 -4.932 -14.806 -10.895 318 HA TRP 71 HA TRP 38 -7.762 -15.039 -9.955 319 HB2 TRP 71 HB2 TRP 38 -5.870 -17.184 -10.992 320 HB3 TRP 71 HB3 TRP 38 -7.546 -17.413 -10.513 321 HD1 TRP 71 HD1 TRP 38 -5.481 -16.702 -13.457 322 HE1 TRP 71 HE1 TRP 38 -6.889 -16.078 -15.499 323 HE3 TRP 71 HE3 TRP 38 -9.941 -15.850 -11.101 324 HZ2 TRP 71 HZ2 TRP 38 -9.627 -15.212 -16.031 325 HZ3 TRP 71 HZ3 TRP 38 -11.895 -15.024 -12.394 326 HH2 TRP 71 HH2 TRP 38 -11.790 -14.836 -14.859 327 H ILE 72 H ILE 39 -8.138 -16.275 -8.029 328 HA ILE 72 HA ILE 39 -6.416 -15.673 -5.956 329 HB ILE 72 HB ILE 39 -8.748 -17.532 -6.249 330 HG12 ILE 72 HG12 ILE 39 -8.096 -15.077 -4.558 331 HG13 ILE 72 HG13 ILE 39 -8.999 -15.106 -6.077 332 HG21 ILE 72 HG21 ILE 39 -8.734 -18.147 -3.872 333 HG22 ILE 72 HG22 ILE 39 -7.376 -18.820 -4.730 334 HG23 ILE 72 HG23 ILE 39 -7.127 -17.405 -3.680 335 HD11 ILE 72 HD11 ILE 39 -10.777 -16.412 -5.025 336 HD12 ILE 72 HD12 ILE 39 -9.909 -16.317 -3.466 337 HD13 ILE 72 HD13 ILE 39 -10.491 -14.835 -4.243 338 HA PRO 73 HA PRO 40 -3.391 -18.888 -6.364 339 HB2 PRO 73 HB2 PRO 40 -1.652 -18.215 -4.386 340 HB3 PRO 73 HB3 PRO 40 -1.937 -17.150 -5.780 341 HG2 PRO 73 HG2 PRO 40 -3.308 -17.029 -3.080 342 HG3 PRO 73 HG3 PRO 40 -2.428 -15.718 -3.928 343 HD2 PRO 73 HD2 PRO 40 -5.144 -16.034 -4.081 344 HD3 PRO 73 HD3 PRO 40 -4.188 -15.466 -5.486 345 H PHE 74 H PHE 41 -5.801 -20.020 -5.328 346 HA PHE 74 HA PHE 41 -5.633 -20.740 -2.533 347 HB2 PHE 74 HB2 PHE 41 -7.473 -22.211 -2.903 348 HB3 PHE 74 HB3 PHE 41 -7.797 -20.688 -3.666 349 HD1 PHE 74 HD1 PHE 41 -7.568 -20.539 -6.269 350 HD2 PHE 74 HD2 PHE 41 -7.517 -24.253 -4.076 351 HE1 PHE 74 HE1 PHE 41 -8.096 -21.774 -8.346 352 HE2 PHE 74 HE2 PHE 41 -8.131 -25.483 -6.149 353 HZ PHE 74 HZ PHE 41 -8.404 -24.248 -8.284 354 H LYS 75 H LYS 42 -5.155 -22.829 -5.414 355 HA LYS 75 HA LYS 42 -4.076 -24.938 -3.792 356 HB2 LYS 75 HB2 LYS 42 -5.357 -24.994 -6.044 357 HB3 LYS 75 HB3 LYS 42 -3.845 -24.544 -6.808 358 HG2 LYS 75 HG2 LYS 42 -4.240 -26.923 -6.989 359 HG3 LYS 75 HG3 LYS 42 -2.818 -26.675 -5.974 360 HD2 LYS 75 HD2 LYS 42 -4.148 -27.095 -3.954 361 HD3 LYS 75 HD3 LYS 42 -5.627 -27.226 -4.901 362 HE2 LYS 75 HE2 LYS 42 -3.188 -29.063 -5.173 363 HE3 LYS 75 HE3 LYS 42 -4.580 -29.411 -4.155 364 HZ1 LYS 75 HZ1 LYS 42 -4.779 -30.527 -6.270 365 HZ2 LYS 75 HZ2 LYS 42 -5.975 -29.425 -6.158 366 HZ3 LYS 75 HZ3 LYS 42 -4.673 -29.133 -7.114 367 H GLN 76 H GLN 43 -2.764 -22.179 -5.336 368 HA GLN 76 HA GLN 43 -0.015 -22.982 -5.540 369 HB2 GLN 76 HB2 GLN 43 -1.252 -20.193 -5.524 370 HB3 GLN 76 HB3 GLN 43 0.335 -20.653 -6.114 371 HG2 GLN 76 HG2 GLN 43 -0.762 -20.503 -8.095 372 HG3 GLN 76 HG3 GLN 43 -1.022 -22.206 -7.790 373 HE21 GLN 76 HE22 GLN 43 -2.640 -19.792 -9.238 374 HE22 GLN 76 HE21 GLN 43 -4.256 -20.009 -8.574 375 H LEU 77 H LEU 44 -1.953 -21.124 -3.123 376 HA LEU 77 HA LEU 44 0.189 -20.856 -1.166 377 HB2 LEU 77 HB2 LEU 44 -2.813 -20.558 -1.016 378 HB3 LEU 77 HB3 LEU 44 -1.744 -20.357 0.367 379 HG LEU 77 HG LEU 44 -1.520 -18.683 -2.161 380 HD11 LEU 77 HD11 LEU 44 -2.655 -16.880 -0.914 381 HD12 LEU 77 HD12 LEU 44 -3.720 -18.292 -1.042 382 HD13 LEU 77 HD13 LEU 44 -2.862 -17.933 0.478 383 HD21 LEU 77 HD21 LEU 44 -0.324 -18.297 0.610 384 HD22 LEU 77 HD22 LEU 44 0.561 -18.702 -0.877 385 HD23 LEU 77 HD23 LEU 44 -0.223 -17.137 -0.730 386 H GLY 78 H GLY 45 -2.293 -23.282 -1.944 387 HA2 GLY 78 HA2 GLY 45 -1.520 -25.571 -1.573 388 HA3 GLY 78 HA3 GLY 45 -1.028 -25.116 0.055 389 H TYR 79 H TYR 46 -4.023 -23.642 -0.856 390 HA TYR 79 HA TYR 46 -5.559 -25.374 0.950 391 HB2 TYR 79 HB2 TYR 46 -6.440 -23.028 -0.787 392 HB3 TYR 79 HB3 TYR 46 -7.356 -23.785 0.518 393 HD1 TYR 79 HD2 TYR 46 -6.442 -23.676 2.902 394 HD2 TYR 79 HD1 TYR 46 -4.866 -21.306 -0.332 395 HE1 TYR 79 HE2 TYR 46 -5.324 -22.216 4.526 396 HE2 TYR 79 HE1 TYR 46 -3.751 -19.820 1.272 397 HH TYR 79 HH TYR 46 -3.330 -19.356 3.566 398 HA PRO 80 HA PRO 47 -6.404 -27.837 -2.567 399 HB2 PRO 80 HB2 PRO 47 -8.685 -29.292 -1.869 400 HB3 PRO 80 HB3 PRO 47 -7.072 -29.579 -1.159 401 HG2 PRO 80 HG2 PRO 47 -9.306 -27.835 -0.042 402 HG3 PRO 80 HG3 PRO 47 -8.374 -29.120 0.805 403 HD2 PRO 80 HD2 PRO 47 -7.625 -26.538 1.072 404 HD3 PRO 80 HD3 PRO 47 -6.383 -27.790 0.822 405 H THR 81 H THR 48 -9.092 -25.765 -1.456 406 HA THR 81 HA THR 48 -10.070 -25.516 -4.252 407 HB THR 81 HB THR 48 -12.383 -25.743 -3.174 408 HG1 THR 81 HG1 THR 48 -12.213 -26.936 -1.078 409 HG21 THR 81 HG21 THR 48 -12.447 -28.130 -3.161 410 HG22 THR 81 HG22 THR 48 -11.227 -27.681 -4.363 411 HG23 THR 81 HG23 THR 48 -10.722 -28.270 -2.772 412 H LEU 82 H LEU 49 -11.631 -23.678 -4.425 413 HA LEU 82 HA LEU 49 -10.657 -21.261 -3.213 414 HB2 LEU 82 HB2 LEU 49 -13.284 -21.954 -4.622 415 HB3 LEU 82 HB3 LEU 49 -13.011 -20.374 -3.933 416 HG LEU 82 HG LEU 49 -12.607 -20.185 -6.233 417 HD11 LEU 82 HD11 LEU 49 -10.324 -19.331 -6.314 418 HD12 LEU 82 HD12 LEU 49 -11.047 -18.950 -4.734 419 HD13 LEU 82 HD13 LEU 49 -9.858 -20.269 -4.906 420 HD21 LEU 82 HD21 LEU 49 -11.003 -21.472 -7.520 421 HD22 LEU 82 HD22 LEU 49 -10.527 -22.404 -6.090 422 HD23 LEU 82 HD23 LEU 49 -12.171 -22.566 -6.763 423 H GLU 83 H GLU 50 -13.356 -23.485 -2.355 424 HA GLU 83 HA GLU 50 -14.301 -21.782 -0.278 425 HB2 GLU 83 HB2 GLU 50 -15.568 -23.583 0.564 426 HB3 GLU 83 HB3 GLU 50 -15.639 -23.643 -1.192 427 HG2 GLU 83 HG2 GLU 50 -14.025 -25.504 -1.202 428 HG3 GLU 83 HG3 GLU 50 -13.879 -25.411 0.559 429 H ALA 84 H ALA 51 -11.800 -24.428 -0.194 430 HA ALA 84 HA ALA 51 -11.361 -24.245 2.591 431 HB1 ALA 84 HB1 ALA 51 -10.583 -26.108 1.222 432 HB2 ALA 84 HB2 ALA 51 -9.433 -25.035 0.383 433 HB3 ALA 84 HB3 ALA 51 -9.250 -25.378 2.131 434 H TYR 85 H TYR 52 -9.786 -22.444 -0.100 435 HA TYR 85 HA TYR 52 -8.023 -20.889 1.493 436 HB2 TYR 85 HB2 TYR 52 -7.793 -20.884 -0.873 437 HB3 TYR 85 HB3 TYR 52 -9.457 -20.396 -1.138 438 HD1 TYR 85 HD1 TYR 52 -6.210 -19.219 0.315 439 HD2 TYR 85 HD2 TYR 52 -10.039 -18.107 -1.330 440 HE1 TYR 85 HE1 TYR 52 -5.504 -16.872 0.370 441 HE2 TYR 85 HE2 TYR 52 -9.347 -15.731 -1.301 442 HH TYR 85 HH TYR 52 -6.173 -14.650 0.030 443 H LEU 86 H LEU 53 -11.471 -20.160 0.503 444 HA LEU 86 HA LEU 53 -11.649 -17.786 2.029 445 HB2 LEU 86 HB2 LEU 53 -13.766 -19.753 1.084 446 HB3 LEU 86 HB3 LEU 53 -14.128 -18.184 1.795 447 HG LEU 86 HG LEU 53 -12.297 -18.302 -0.619 448 HD11 LEU 86 HD11 LEU 53 -15.320 -18.498 -0.619 449 HD12 LEU 86 HD12 LEU 53 -14.364 -17.955 -2.033 450 HD13 LEU 86 HD13 LEU 53 -14.173 -19.588 -1.382 451 HD21 LEU 86 HD21 LEU 53 -12.538 -16.168 0.617 452 HD22 LEU 86 HD22 LEU 53 -13.198 -16.067 -1.014 453 HD23 LEU 86 HD23 LEU 53 -14.301 -16.229 0.369 454 H ARG 87 H ARG 54 -12.315 -21.153 3.041 455 HA ARG 87 HA ARG 54 -13.320 -20.566 5.691 456 HB2 ARG 87 HB2 ARG 54 -11.678 -22.936 4.659 457 HB3 ARG 87 HB3 ARG 54 -12.035 -22.743 6.348 458 HG2 ARG 87 HG2 ARG 54 -13.570 -24.289 5.649 459 HG3 ARG 87 HG3 ARG 54 -14.495 -22.795 5.837 460 HD2 ARG 87 HD2 ARG 54 -14.619 -22.529 3.405 461 HD3 ARG 87 HD3 ARG 54 -13.316 -23.689 3.216 462 HE ARG 87 HE ARG 54 -14.778 -25.227 2.810 463 HH11 ARG 87 HH11 ARG 54 -16.280 -23.492 5.578 464 HH12 ARG 87 HH12 ARG 54 -17.697 -24.466 5.530 465 HH21 ARG 87 HH21 ARG 54 -16.709 -26.305 2.662 466 HH22 ARG 87 HH22 ARG 54 -17.916 -26.171 3.917 467 H SER 88 H SER 55 -10.039 -20.614 4.370 468 HA SER 88 HA SER 55 -8.775 -20.524 6.961 469 HB2 SER 88 HB2 SER 55 -7.613 -20.328 4.166 470 HB3 SER 88 HB3 SER 55 -6.721 -20.620 5.672 471 HG SER 88 HG SER 55 -8.611 -22.286 4.368 472 H VAL 89 H VAL 56 -10.398 -18.014 5.730 473 HA VAL 89 HA VAL 56 -8.454 -16.060 6.844 474 HB VAL 89 HB VAL 56 -8.297 -15.890 4.486 475 HG11 VAL 89 HG11 VAL 56 -11.307 -15.874 4.402 476 HG12 VAL 89 HG12 VAL 56 -10.335 -15.157 3.092 477 HG13 VAL 89 HG13 VAL 56 -10.141 -16.859 3.521 478 HG21 VAL 89 HG21 VAL 56 -8.660 -13.622 4.055 479 HG22 VAL 89 HG22 VAL 56 -9.991 -13.498 5.211 480 HG23 VAL 89 HG23 VAL 56 -8.323 -13.740 5.795 481 HA PRO 90 HA PRO 57 -12.892 -16.139 8.481 482 HB2 PRO 90 HB2 PRO 57 -12.692 -17.137 11.010 483 HB3 PRO 90 HB3 PRO 57 -12.733 -18.181 9.552 484 HG2 PRO 90 HG2 PRO 57 -10.300 -17.234 11.103 485 HG3 PRO 90 HG3 PRO 57 -10.693 -18.900 10.555 486 HD2 PRO 90 HD2 PRO 57 -9.029 -17.245 9.135 487 HD3 PRO 90 HD3 PRO 57 -10.105 -18.443 8.375 488 H ALA 91 H ALA 58 -9.905 -14.779 9.754 489 HA ALA 91 HA ALA 58 -11.221 -13.042 11.688 490 HB1 ALA 91 HB1 ALA 58 -8.377 -13.004 10.567 491 HB2 ALA 91 HB2 ALA 58 -8.956 -12.135 12.001 492 HB3 ALA 91 HB3 ALA 58 -8.911 -13.906 12.016 493 H VAL 92 H VAL 59 -10.982 -12.945 8.287 494 HA VAL 92 HA VAL 59 -11.363 -9.981 8.270 495 HB VAL 92 HB VAL 59 -9.689 -11.519 6.262 496 HG11 VAL 92 HG11 VAL 59 -10.633 -9.412 5.436 497 HG12 VAL 92 HG12 VAL 59 -9.932 -8.529 6.807 498 HG13 VAL 92 HG13 VAL 59 -8.880 -9.290 5.587 499 HG21 VAL 92 HG21 VAL 59 -8.689 -9.892 8.641 500 HG22 VAL 92 HG22 VAL 59 -8.424 -11.633 8.352 501 HG23 VAL 92 HG23 VAL 59 -7.679 -10.444 7.289 502 H VAL 93 H VAL 60 -12.273 -13.142 7.034 503 HA VAL 93 HA VAL 60 -14.341 -11.954 5.266 504 HB VAL 93 HB VAL 60 -12.177 -13.991 4.733 505 HG11 VAL 93 HG11 VAL 60 -14.597 -13.644 2.929 506 HG12 VAL 93 HG12 VAL 60 -13.105 -14.520 2.535 507 HG13 VAL 93 HG13 VAL 60 -14.134 -15.109 3.831 508 HG21 VAL 93 HG21 VAL 60 -11.864 -12.537 2.668 509 HG22 VAL 93 HG22 VAL 60 -13.001 -11.394 3.412 510 HG23 VAL 93 HG23 VAL 60 -11.465 -11.780 4.203 511 H ARG 94 H ARG 61 -15.999 -13.626 4.771 512 HA ARG 94 HA ARG 61 -16.527 -15.547 6.968 513 HB2 ARG 94 HB2 ARG 61 -17.401 -13.575 7.916 514 HB3 ARG 94 HB3 ARG 61 -18.007 -12.963 6.380 515 HG2 ARG 94 HG2 ARG 61 -19.874 -14.542 6.423 516 HG3 ARG 94 HG3 ARG 61 -19.188 -15.384 7.820 517 HD2 ARG 94 HD2 ARG 61 -21.069 -13.856 8.404 518 HD3 ARG 94 HD3 ARG 61 -19.558 -13.499 9.255 519 HE ARG 94 HE ARG 61 -19.944 -11.947 6.803 520 HH11 ARG 94 HH11 ARG 61 -21.171 -12.055 10.105 521 HH12 ARG 94 HH12 ARG 61 -21.125 -10.339 10.342 522 HH21 ARG 94 HH21 ARG 61 -19.529 -9.702 7.230 523 HH22 ARG 94 HH22 ARG 61 -20.328 -8.953 8.572 524 H ILE 95 H ILE 62 -18.281 -17.047 6.278 525 HA ILE 95 HA ILE 62 -19.142 -16.818 3.481 526 HB ILE 95 HB ILE 62 -18.447 -19.139 2.988 527 HG12 ILE 95 HG12 ILE 62 -16.831 -18.981 5.552 528 HG13 ILE 95 HG13 ILE 62 -18.189 -20.063 5.219 529 HG21 ILE 95 HG21 ILE 62 -15.954 -17.536 3.678 530 HG22 ILE 95 HG22 ILE 62 -16.234 -18.648 2.316 531 HG23 ILE 95 HG23 ILE 62 -17.024 -17.088 2.340 532 HD11 ILE 95 HD11 ILE 62 -15.445 -20.126 3.906 533 HD12 ILE 95 HD12 ILE 62 -16.164 -21.299 5.014 534 HD13 ILE 95 HD13 ILE 62 -16.839 -21.111 3.379 535 H GLU 96 H GLU 63 -20.979 -18.074 3.009 536 HA GLU 96 HA GLU 63 -22.163 -19.675 5.234 537 HB2 GLU 96 HB2 GLU 63 -23.638 -17.793 3.343 538 HB3 GLU 96 HB3 GLU 63 -24.388 -18.992 4.408 539 HG2 GLU 96 HG2 GLU 63 -23.230 -17.826 6.364 540 HG3 GLU 96 HG3 GLU 63 -22.815 -16.522 5.246 541 H ALA 97 H ALA 64 -21.569 -21.658 4.458 542 HA ALA 97 HA ALA 64 -21.967 -22.428 1.637 543 HB1 ALA 97 HB1 ALA 64 -20.091 -23.414 2.852 544 HB2 ALA 97 HB2 ALA 64 -21.205 -24.048 4.097 545 HB3 ALA 97 HB3 ALA 64 -21.288 -24.643 2.417 546 H SER 98 H SER 65 -23.959 -22.809 0.931 547 HA SER 98 HA SER 65 -26.241 -23.005 2.741 548 HB2 SER 98 HB2 SER 65 -26.297 -21.693 0.634 549 HB3 SER 98 HB3 SER 65 -26.020 -23.183 -0.298 550 HG SER 98 HG SER 65 -28.277 -22.531 -0.086 551 H ARG 99 H ARG 66 -27.658 -24.789 2.700 552 HA ARG 99 HA ARG 66 -26.512 -27.389 2.796 553 HB2 ARG 99 HB2 ARG 66 -28.612 -28.244 3.257 554 HB3 ARG 99 HB3 ARG 66 -28.588 -26.657 3.995 555 HG2 ARG 99 HG2 ARG 66 -30.042 -27.447 1.412 556 HG3 ARG 99 HG3 ARG 66 -30.749 -27.237 3.004 557 HD2 ARG 99 HD2 ARG 66 -29.954 -24.807 2.906 558 HD3 ARG 99 HD3 ARG 66 -29.643 -25.060 1.189 559 HE ARG 99 HE ARG 66 -32.211 -24.925 2.612 560 HH11 ARG 99 HH11 ARG 66 -30.676 -25.491 -0.585 561 HH12 ARG 99 HH12 ARG 66 -32.182 -25.529 -1.417 562 HH21 ARG 99 HH21 ARG 66 -34.170 -24.904 1.454 563 HH22 ARG 99 HH22 ARG 66 -34.192 -25.107 -0.261 564 H SER 100 H SER 67 -27.723 -25.587 0.046 565 HA SER 100 HA SER 67 -28.196 -27.716 -1.748 566 HB2 SER 100 HB2 SER 67 -27.150 -24.943 -2.411 567 HB3 SER 100 HB3 SER 67 -28.193 -25.986 -3.401 568 HG SER 100 HG SER 67 -29.352 -24.308 -2.298 569 H GLY 101 H GLY 68 -25.182 -26.761 -0.334 570 HA2 GLY 101 HA2 GLY 68 -23.052 -27.514 -0.747 571 HA3 GLY 101 HA3 GLY 68 -23.618 -28.405 -2.177 572 H GLU 102 H GLU 69 -24.088 -24.926 -1.448 573 HA GLU 102 HA GLU 69 -22.063 -24.121 -3.435 574 HB2 GLU 102 HB2 GLU 69 -24.897 -23.000 -3.169 575 HB3 GLU 102 HB3 GLU 69 -23.588 -22.226 -4.071 576 HG2 GLU 102 HG2 GLU 69 -23.418 -24.239 -5.539 577 HG3 GLU 102 HG3 GLU 69 -24.787 -24.964 -4.690 578 H ILE 103 H ILE 70 -21.427 -21.774 -2.806 579 HA ILE 103 HA ILE 70 -21.922 -21.186 0.029 580 HB ILE 103 HB ILE 70 -20.011 -22.536 0.229 581 HG12 ILE 103 HG12 ILE 70 -19.939 -20.203 1.346 582 HG13 ILE 103 HG13 ILE 70 -18.525 -21.239 1.375 583 HG21 ILE 103 HG21 ILE 70 -18.760 -21.173 -2.129 584 HG22 ILE 103 HG22 ILE 70 -17.861 -22.191 -0.979 585 HG23 ILE 103 HG23 ILE 70 -19.182 -22.886 -1.932 586 HD11 ILE 103 HD11 ILE 70 -18.164 -18.748 0.824 587 HD12 ILE 103 HD12 ILE 70 -17.329 -19.947 -0.179 588 HD13 ILE 103 HD13 ILE 70 -18.770 -19.104 -0.776 589 H VAL 104 H VAL 71 -21.825 -19.082 0.545 590 HA VAL 104 HA VAL 71 -21.361 -17.141 -1.658 591 HB VAL 104 HB VAL 71 -23.262 -16.785 0.700 592 HG11 VAL 104 HG11 VAL 71 -23.129 -15.477 -2.058 593 HG12 VAL 104 HG12 VAL 71 -24.275 -15.080 -0.761 594 HG13 VAL 104 HG13 VAL 71 -22.550 -14.760 -0.533 595 HG21 VAL 104 HG21 VAL 71 -23.997 -17.949 -2.029 596 HG22 VAL 104 HG22 VAL 71 -24.152 -18.757 -0.457 597 HG23 VAL 104 HG23 VAL 71 -25.150 -17.355 -0.825 598 H CYS 105 H CYS 72 -19.746 -15.714 -1.225 599 HA CYS 105 HA CYS 72 -18.416 -15.831 1.398 600 HB2 CYS 105 HB2 CYS 72 -17.557 -14.298 -1.084 601 HB3 CYS 105 HB3 CYS 72 -16.524 -14.935 0.221 602 HG CYS 105 HG CYS 72 -17.034 -17.483 -0.356 603 H TYR 106 H TYR 73 -17.882 -13.962 2.598 604 HA TYR 106 HA TYR 73 -19.135 -11.361 1.914 605 HB2 TYR 106 HB2 TYR 73 -19.508 -12.962 4.483 606 HB3 TYR 106 HB3 TYR 73 -19.965 -11.273 4.306 607 HD1 TYR 106 HD1 TYR 73 -21.653 -10.622 2.504 608 HD2 TYR 106 HD2 TYR 73 -20.999 -14.702 3.811 609 HE1 TYR 106 HE1 TYR 73 -23.943 -11.203 1.803 610 HE2 TYR 106 HE2 TYR 73 -23.238 -15.326 3.009 611 HH TYR 106 HH TYR 73 -25.290 -14.551 2.154 612 H ALA 107 H ALA 74 -18.356 -9.686 3.582 613 HA ALA 107 HA ALA 74 -15.474 -10.159 4.184 614 HB1 ALA 107 HB1 ALA 74 -17.124 -7.597 4.385 615 HB2 ALA 107 HB2 ALA 74 -15.354 -7.761 4.521 616 HB3 ALA 107 HB3 ALA 74 -16.145 -8.061 2.981 617 H VAL 108 H VAL 75 -14.708 -9.365 6.278 618 HA VAL 108 HA VAL 75 -16.717 -9.049 8.423 619 HB VAL 108 HB VAL 75 -15.075 -11.404 8.067 620 HG11 VAL 108 HG11 VAL 75 -14.658 -10.138 10.798 621 HG12 VAL 108 HG12 VAL 75 -14.180 -11.768 10.273 622 HG13 VAL 108 HG13 VAL 75 -13.401 -10.353 9.561 623 HG21 VAL 108 HG21 VAL 75 -17.085 -10.655 10.234 624 HG22 VAL 108 HG22 VAL 75 -17.474 -11.349 8.651 625 HG23 VAL 108 HG23 VAL 75 -16.540 -12.294 9.822 626 H ALA 109 H ALA 76 -13.446 -8.366 7.188 627 HA ALA 109 HA ALA 76 -13.402 -5.964 8.848 628 HB1 ALA 109 HB1 ALA 76 -12.193 -7.684 10.257 629 HB2 ALA 109 HB2 ALA 76 -11.039 -7.897 8.913 630 HB3 ALA 109 HB3 ALA 76 -11.173 -6.340 9.734 Start of MODEL 15 1 H1 GLY -2 H1 GLY -2 7.818 0.088 -2.677 2 H2 GLY -2 H2 GLY -2 6.937 1.351 -2.120 3 H3 GLY -2 H3 GLY -2 8.297 0.883 -1.326 4 HA2 GLY -2 HA2 GLY -2 7.291 -1.224 -0.731 5 HA3 GLY -2 HA3 GLY -2 6.355 0.149 -0.114 6 H HIS -1 H HIS -1 5.693 -2.744 -1.084 7 HA HIS -1 HA HIS -1 3.137 -2.062 -2.344 8 HB2 HIS -1 HB2 HIS -1 4.716 -2.444 -4.258 9 HB3 HIS -1 HB3 HIS -1 5.036 -4.065 -3.630 10 HD2 HIS -1 HD2 HIS -1 3.663 -5.806 -4.917 11 HE1 HIS -1 HE1 HIS -1 0.113 -3.593 -5.738 12 HE2 HIS -1 HE2 HIS -1 1.293 -5.833 -6.055 13 H MET 34 H MET 1 1.675 -3.975 -2.197 14 HA MET 34 HA MET 1 1.885 -5.312 0.339 15 HB2 MET 34 HB2 MET 1 0.089 -5.751 -2.092 16 HB3 MET 34 HB3 MET 1 -0.071 -6.652 -0.571 17 HG2 MET 34 HG2 MET 1 -1.306 -5.041 0.312 18 HG3 MET 34 HG3 MET 1 0.017 -3.902 0.130 19 HE1 MET 34 HE1 MET 1 -2.610 -5.559 -2.604 20 HE2 MET 34 HE2 MET 1 -3.416 -5.155 -1.064 21 HE3 MET 34 HE3 MET 1 -3.753 -4.222 -2.533 22 H LEU 35 H LEU 2 2.359 -7.458 0.819 23 HA LEU 35 HA LEU 2 4.146 -8.969 -0.960 24 HB2 LEU 35 HB2 LEU 2 2.772 -9.750 1.659 25 HB3 LEU 35 HB3 LEU 2 4.002 -10.691 0.837 26 HG LEU 35 HG LEU 2 4.419 -7.933 2.065 27 HD11 LEU 35 HD11 LEU 2 5.398 -10.683 2.947 28 HD12 LEU 35 HD12 LEU 2 5.762 -9.133 3.735 29 HD13 LEU 35 HD13 LEU 2 4.099 -9.739 3.717 30 HD21 LEU 35 HD21 LEU 2 5.936 -8.190 0.164 31 HD22 LEU 35 HD22 LEU 2 6.846 -8.370 1.661 32 HD23 LEU 35 HD23 LEU 2 6.407 -9.814 0.711 33 H GLU 36 H GLU 3 3.490 -11.358 -1.478 34 HA GLU 36 HA GLU 3 1.256 -11.225 -3.178 35 HB2 GLU 36 HB2 GLU 3 3.119 -12.777 -3.524 36 HB3 GLU 36 HB3 GLU 3 2.638 -13.705 -2.095 37 HG2 GLU 36 HG2 GLU 3 0.514 -14.322 -3.173 38 HG3 GLU 36 HG3 GLU 3 0.891 -13.292 -4.558 39 H ALA 37 H ALA 4 1.434 -13.070 -0.127 40 HA ALA 37 HA ALA 4 -1.301 -13.801 -0.266 41 HB1 ALA 37 HB1 ALA 4 -1.115 -14.519 2.054 42 HB2 ALA 37 HB2 ALA 4 0.288 -15.044 1.109 43 HB3 ALA 37 HB3 ALA 4 0.435 -13.655 2.226 44 H ASP 38 H ASP 5 0.339 -11.010 1.214 45 HA ASP 38 HA ASP 5 -1.888 -9.961 2.668 46 HB2 ASP 38 HB2 ASP 5 0.511 -9.321 2.995 47 HB3 ASP 38 HB3 ASP 5 0.462 -8.468 1.451 48 H LEU 39 H LEU 6 -0.730 -9.423 -0.677 49 HA LEU 39 HA LEU 6 -2.546 -7.369 -1.380 50 HB2 LEU 39 HB2 LEU 6 -0.540 -7.879 -2.694 51 HB3 LEU 39 HB3 LEU 6 -1.129 -9.473 -3.090 52 HG LEU 39 HG LEU 6 -2.924 -7.199 -3.884 53 HD11 LEU 39 HD11 LEU 6 -0.309 -7.764 -5.328 54 HD12 LEU 39 HD12 LEU 6 -1.607 -6.683 -5.894 55 HD13 LEU 39 HD13 LEU 6 -0.709 -6.289 -4.421 56 HD21 LEU 39 HD21 LEU 6 -2.020 -9.723 -5.322 57 HD22 LEU 39 HD22 LEU 6 -3.598 -9.435 -4.554 58 HD23 LEU 39 HD23 LEU 6 -3.142 -8.517 -5.975 59 H VAL 40 H VAL 7 -2.672 -10.938 -1.939 60 HA VAL 40 HA VAL 7 -5.159 -10.703 -3.284 61 HB VAL 40 HB VAL 7 -5.231 -13.118 -3.279 62 HG11 VAL 40 HG11 VAL 7 -2.370 -12.163 -3.740 63 HG12 VAL 40 HG12 VAL 7 -3.192 -13.529 -4.508 64 HG13 VAL 40 HG13 VAL 7 -3.717 -11.882 -4.842 65 HG21 VAL 40 HG21 VAL 7 -2.865 -13.041 -1.408 66 HG22 VAL 40 HG22 VAL 7 -4.477 -13.644 -1.000 67 HG23 VAL 40 HG23 VAL 7 -3.502 -14.490 -2.203 68 H SER 41 H SER 8 -4.438 -11.519 0.186 69 HA SER 41 HA SER 8 -7.161 -11.860 0.855 70 HB2 SER 41 HB2 SER 8 -4.785 -11.060 2.561 71 HB3 SER 41 HB3 SER 8 -6.371 -11.578 3.187 72 HG SER 41 HG SER 8 -4.764 -13.311 2.964 73 H LYS 42 H LYS 9 -5.171 -8.783 0.905 74 HA LYS 42 HA LYS 9 -7.359 -7.244 2.071 75 HB2 LYS 42 HB2 LYS 9 -4.860 -6.512 0.489 76 HB3 LYS 42 HB3 LYS 9 -6.059 -5.298 0.945 77 HG2 LYS 42 HG2 LYS 9 -5.825 -5.790 3.307 78 HG3 LYS 42 HG3 LYS 9 -4.729 -7.146 2.961 79 HD2 LYS 42 HD2 LYS 9 -3.086 -5.629 1.966 80 HD3 LYS 42 HD3 LYS 9 -4.144 -4.228 2.263 81 HE2 LYS 42 HE2 LYS 9 -3.945 -4.462 4.650 82 HE3 LYS 42 HE3 LYS 9 -3.245 -6.080 4.498 83 HZ1 LYS 42 HZ1 LYS 9 -1.283 -5.129 3.512 84 HZ2 LYS 42 HZ2 LYS 9 -1.882 -3.588 3.637 85 HZ3 LYS 42 HZ3 LYS 9 -1.543 -4.457 4.988 86 H MET 43 H MET 10 -6.375 -7.826 -1.390 87 HA MET 43 HA MET 10 -8.481 -6.106 -2.351 88 HB2 MET 43 HB2 MET 10 -6.837 -8.265 -3.736 89 HB3 MET 43 HB3 MET 10 -8.021 -7.240 -4.558 90 HG2 MET 43 HG2 MET 10 -6.766 -5.221 -3.536 91 HG3 MET 43 HG3 MET 10 -5.468 -6.355 -3.173 92 HE1 MET 43 HE1 MET 10 -4.918 -3.779 -4.723 93 HE2 MET 43 HE2 MET 10 -3.609 -4.994 -4.693 94 HE3 MET 43 HE3 MET 10 -4.097 -4.246 -6.228 95 H LEU 44 H LEU 11 -8.337 -9.669 -1.809 96 HA LEU 44 HA LEU 11 -10.941 -10.435 -2.553 97 HB2 LEU 44 HB2 LEU 11 -9.258 -12.041 -1.724 98 HB3 LEU 44 HB3 LEU 11 -9.139 -11.189 -0.202 99 HG LEU 44 HG LEU 11 -11.556 -11.834 0.258 100 HD11 LEU 44 HD11 LEU 11 -12.369 -13.812 -0.950 101 HD12 LEU 44 HD12 LEU 11 -12.096 -12.469 -2.092 102 HD13 LEU 44 HD13 LEU 11 -10.923 -13.794 -1.993 103 HD21 LEU 44 HD21 LEU 11 -9.381 -13.918 0.086 104 HD22 LEU 44 HD22 LEU 11 -9.739 -12.861 1.454 105 HD23 LEU 44 HD23 LEU 11 -10.900 -14.118 0.996 106 H ARG 45 H ARG 12 -9.869 -9.278 0.654 107 HA ARG 45 HA ARG 12 -12.371 -9.001 1.880 108 HB2 ARG 45 HB2 ARG 12 -10.447 -8.997 3.161 109 HB3 ARG 45 HB3 ARG 12 -9.619 -7.802 2.192 110 HG2 ARG 45 HG2 ARG 12 -12.055 -6.938 3.723 111 HG3 ARG 45 HG3 ARG 12 -10.526 -7.226 4.558 112 HD2 ARG 45 HD2 ARG 12 -9.442 -5.649 2.794 113 HD3 ARG 45 HD3 ARG 12 -11.115 -5.109 2.487 114 HE ARG 45 HE ARG 12 -10.083 -5.289 5.251 115 HH11 ARG 45 HH12 ARG 12 -10.494 -2.943 2.630 116 HH12 ARG 45 HH11 ARG 12 -10.929 -1.646 3.684 117 HH21 ARG 45 HH21 ARG 12 -10.975 -3.746 6.581 118 HH22 ARG 45 HH22 ARG 12 -11.063 -2.073 6.061 119 H ALA 46 H ALA 13 -10.602 -6.551 -0.122 120 HA ALA 46 HA ALA 13 -12.520 -4.563 0.430 121 HB1 ALA 46 HB1 ALA 13 -10.228 -4.096 -0.483 122 HB2 ALA 46 HB2 ALA 13 -10.697 -4.836 -2.029 123 HB3 ALA 46 HB3 ALA 13 -11.487 -3.340 -1.483 124 H VAL 47 H VAL 14 -12.362 -6.928 -2.312 125 HA VAL 47 HA VAL 14 -14.656 -5.888 -3.690 126 HB VAL 47 HB VAL 14 -13.478 -8.710 -3.556 127 HG11 VAL 47 HG11 VAL 14 -15.500 -7.602 -5.536 128 HG12 VAL 47 HG12 VAL 14 -14.711 -9.206 -5.583 129 HG13 VAL 47 HG13 VAL 14 -15.847 -8.816 -4.289 130 HG21 VAL 47 HG21 VAL 14 -12.634 -8.061 -5.850 131 HG22 VAL 47 HG22 VAL 14 -13.223 -6.419 -5.564 132 HG23 VAL 47 HG23 VAL 14 -11.937 -7.106 -4.546 133 H LEU 48 H LEU 15 -14.315 -8.292 -1.037 134 HA LEU 48 HA LEU 15 -17.095 -8.939 -0.906 135 HB2 LEU 48 HB2 LEU 15 -14.891 -9.000 1.215 136 HB3 LEU 48 HB3 LEU 15 -16.469 -9.728 1.424 137 HG LEU 48 HG LEU 15 -14.736 -10.546 -0.949 138 HD11 LEU 48 HD11 LEU 15 -14.717 -11.634 1.890 139 HD12 LEU 48 HD12 LEU 15 -13.905 -12.386 0.491 140 HD13 LEU 48 HD13 LEU 15 -13.387 -10.785 1.073 141 HD21 LEU 48 HD21 LEU 15 -17.164 -11.227 -0.865 142 HD22 LEU 48 HD22 LEU 15 -16.039 -12.608 -0.744 143 HD23 LEU 48 HD23 LEU 15 -16.842 -11.992 0.696 144 H GLN 49 H GLN 16 -15.193 -6.342 0.718 145 HA GLN 49 HA GLN 16 -17.329 -5.474 2.424 146 HB2 GLN 49 HB2 GLN 16 -14.811 -4.113 1.386 147 HB3 GLN 49 HB3 GLN 16 -15.958 -3.268 2.407 148 HG2 GLN 49 HG2 GLN 16 -14.557 -5.853 3.222 149 HG3 GLN 49 HG3 GLN 16 -13.992 -4.241 3.626 150 HE21 GLN 49 HE22 GLN 16 -14.333 -5.802 5.767 151 HE22 GLN 49 HE21 GLN 16 -15.818 -5.415 6.624 152 H SER 50 H SER 17 -16.359 -4.490 -0.932 153 HA SER 50 HA SER 17 -18.414 -2.520 -1.213 154 HB2 SER 50 HB2 SER 17 -17.097 -4.295 -3.314 155 HB3 SER 50 HB3 SER 17 -18.023 -2.818 -3.627 156 HG SER 50 HG SER 17 -15.771 -2.385 -3.587 157 H HIS 51 H HIS 18 -18.378 -6.056 -1.758 158 HA HIS 51 HA HIS 18 -21.108 -5.990 -2.860 159 HB2 HIS 51 HB2 HIS 18 -18.984 -8.141 -2.777 160 HB3 HIS 51 HB3 HIS 18 -20.571 -8.299 -3.518 161 HD2 HIS 51 HD2 HIS 18 -18.909 -8.843 -5.686 162 HE1 HIS 51 HE1 HIS 18 -18.326 -4.773 -6.718 163 HE2 HIS 51 HE2 HIS 18 -18.154 -7.149 -7.568 164 H LYS 52 H LYS 19 -21.714 -5.376 -0.439 165 HA LYS 52 HA LYS 19 -21.628 -7.351 1.584 166 HB2 LYS 52 HB2 LYS 19 -23.579 -5.045 1.111 167 HB3 LYS 52 HB3 LYS 19 -23.599 -6.029 2.576 168 HG2 LYS 52 HG2 LYS 19 -21.258 -4.318 1.642 169 HG3 LYS 52 HG3 LYS 19 -22.417 -3.921 2.910 170 HD2 LYS 52 HD2 LYS 19 -21.662 -6.027 4.154 171 HD3 LYS 52 HD3 LYS 19 -20.399 -6.210 2.940 172 HE2 LYS 52 HE2 LYS 19 -19.355 -5.146 4.769 173 HE3 LYS 52 HE3 LYS 19 -19.514 -3.941 3.496 174 HZ1 LYS 52 HZ1 LYS 19 -20.110 -3.075 5.695 175 HZ2 LYS 52 HZ2 LYS 19 -21.408 -2.992 4.714 176 HZ3 LYS 52 HZ3 LYS 19 -21.311 -4.161 5.864 177 H ASN 53 H ASN 20 -23.800 -7.263 -1.161 178 HA ASN 53 HA ASN 20 -25.789 -9.015 -0.053 179 HB2 ASN 53 HB2 ASN 20 -25.704 -7.577 -2.306 180 HB3 ASN 53 HB3 ASN 20 -25.053 -9.062 -2.990 181 HD21 ASN 53 HD22 ASN 20 -26.569 -11.122 -2.016 182 HD22 ASN 53 HD21 ASN 20 -28.271 -10.848 -2.348 183 H GLY 54 H GLY 21 -22.471 -9.613 -0.732 184 HA2 GLY 54 HA2 GLY 21 -21.297 -11.506 -0.396 185 HA3 GLY 54 HA3 GLY 21 -22.766 -12.490 -0.346 186 H ILE 55 H ILE 22 -20.550 -13.335 -1.741 187 HA ILE 55 HA ILE 22 -21.516 -13.375 -4.542 188 HB ILE 55 HB ILE 22 -18.944 -13.232 -5.124 189 HG12 ILE 55 HG12 ILE 22 -18.970 -11.588 -2.543 190 HG13 ILE 55 HG13 ILE 22 -17.968 -12.980 -2.923 191 HG21 ILE 55 HG21 ILE 22 -19.210 -11.058 -5.872 192 HG22 ILE 55 HG22 ILE 22 -20.861 -11.660 -5.813 193 HG23 ILE 55 HG23 ILE 22 -20.293 -10.599 -4.515 194 HD11 ILE 55 HD11 ILE 22 -16.619 -10.974 -3.136 195 HD12 ILE 55 HD12 ILE 22 -16.937 -11.499 -4.800 196 HD13 ILE 55 HD13 ILE 22 -17.848 -10.158 -4.080 197 H VAL 56 H VAL 23 -21.726 -15.359 -5.174 198 HA VAL 56 HA VAL 23 -21.014 -17.589 -3.597 199 HB VAL 56 HB VAL 23 -21.636 -18.881 -5.672 200 HG11 VAL 56 HG11 VAL 23 -23.315 -18.330 -4.014 201 HG12 VAL 56 HG12 VAL 23 -23.605 -16.738 -4.758 202 HG13 VAL 56 HG13 VAL 23 -24.008 -18.230 -5.631 203 HG21 VAL 56 HG21 VAL 23 -22.222 -16.136 -6.906 204 HG22 VAL 56 HG22 VAL 23 -20.914 -17.222 -7.394 205 HG23 VAL 56 HG23 VAL 23 -22.593 -17.724 -7.596 206 H LEU 57 H LEU 24 -19.248 -19.229 -3.889 207 HA LEU 57 HA LEU 24 -16.870 -18.040 -4.224 208 HB2 LEU 57 HB2 LEU 24 -15.658 -19.877 -3.922 209 HB3 LEU 57 HB3 LEU 24 -17.169 -20.226 -3.169 210 HG LEU 57 HG LEU 24 -17.748 -21.692 -5.211 211 HD11 LEU 57 HD11 LEU 24 -15.520 -22.566 -6.341 212 HD12 LEU 57 HD12 LEU 24 -16.291 -21.160 -7.014 213 HD13 LEU 57 HD13 LEU 24 -14.893 -20.953 -5.952 214 HD21 LEU 57 HD21 LEU 24 -16.990 -22.673 -3.122 215 HD22 LEU 57 HD22 LEU 24 -16.220 -23.527 -4.436 216 HD23 LEU 57 HD23 LEU 24 -15.300 -22.316 -3.507 217 HA PRO 58 HA PRO 25 -16.038 -18.908 -8.796 218 HB2 PRO 58 HB2 PRO 25 -18.106 -18.985 -10.614 219 HB3 PRO 58 HB3 PRO 25 -17.410 -20.428 -9.823 220 HG2 PRO 58 HG2 PRO 25 -19.916 -18.911 -9.060 221 HG3 PRO 58 HG3 PRO 25 -19.678 -20.682 -9.202 222 HD2 PRO 58 HD2 PRO 25 -19.587 -19.416 -6.810 223 HD3 PRO 58 HD3 PRO 25 -18.532 -20.802 -7.162 224 H ARG 59 H ARG 26 -18.957 -16.991 -7.987 225 HA ARG 59 HA ARG 26 -18.294 -14.720 -9.671 226 HB2 ARG 59 HB2 ARG 26 -20.578 -15.315 -8.806 227 HB3 ARG 59 HB3 ARG 26 -20.048 -14.857 -7.175 228 HG2 ARG 59 HG2 ARG 26 -19.663 -12.559 -7.958 229 HG3 ARG 59 HG3 ARG 26 -20.102 -13.044 -9.612 230 HD2 ARG 59 HD2 ARG 26 -22.382 -13.602 -8.851 231 HD3 ARG 59 HD3 ARG 26 -21.962 -13.103 -7.198 232 HE ARG 59 HE ARG 26 -21.341 -10.965 -8.943 233 HH11 ARG 59 HH11 ARG 26 -24.278 -12.669 -7.843 234 HH12 ARG 59 HH12 ARG 26 -25.291 -11.279 -7.960 235 HH21 ARG 59 HH21 ARG 26 -22.708 -9.116 -9.108 236 HH22 ARG 59 HH22 ARG 26 -24.380 -9.224 -8.704 237 H LEU 60 H LEU 27 -17.509 -15.749 -6.347 238 HA LEU 60 HA LEU 27 -16.262 -13.411 -5.444 239 HB2 LEU 60 HB2 LEU 27 -16.725 -15.388 -3.985 240 HB3 LEU 60 HB3 LEU 27 -15.501 -16.332 -4.806 241 HG LEU 60 HG LEU 27 -14.870 -15.460 -2.604 242 HD11 LEU 60 HD11 LEU 27 -12.917 -14.508 -4.710 243 HD12 LEU 60 HD12 LEU 27 -12.615 -15.158 -3.095 244 HD13 LEU 60 HD13 LEU 27 -13.228 -16.226 -4.354 245 HD21 LEU 60 HD21 LEU 27 -14.435 -12.765 -3.959 246 HD22 LEU 60 HD22 LEU 27 -15.829 -13.169 -2.932 247 HD23 LEU 60 HD23 LEU 27 -14.218 -13.196 -2.251 248 H GLN 61 H GLN 28 -14.784 -16.276 -7.118 249 HA GLN 61 HA GLN 28 -12.244 -15.162 -7.573 250 HB2 GLN 61 HB2 GLN 28 -13.908 -17.290 -8.857 251 HB3 GLN 61 HB3 GLN 28 -12.559 -16.693 -9.814 252 HG2 GLN 61 HG2 GLN 28 -12.059 -17.500 -6.936 253 HG3 GLN 61 HG3 GLN 28 -12.295 -18.738 -8.166 254 HE21 GLN 61 HE22 GLN 28 -10.316 -19.513 -8.990 255 HE22 GLN 61 HE21 GLN 28 -8.894 -18.537 -9.213 256 H GLY 62 H GLY 29 -15.177 -14.847 -9.699 257 HA2 GLY 62 HA2 GLY 29 -13.889 -13.469 -11.773 258 HA3 GLY 62 HA3 GLY 29 -15.610 -13.324 -11.372 259 H GLU 63 H GLU 30 -15.687 -12.024 -8.978 260 HA GLU 63 HA GLU 30 -15.099 -9.324 -9.810 261 HB2 GLU 63 HB2 GLU 30 -16.084 -10.464 -7.161 262 HB3 GLU 63 HB3 GLU 30 -16.026 -8.741 -7.567 263 HG2 GLU 63 HG2 GLU 30 -17.672 -10.820 -9.069 264 HG3 GLU 63 HG3 GLU 30 -18.281 -9.722 -7.846 265 H TYR 64 H TYR 31 -13.626 -11.540 -7.397 266 HA TYR 64 HA TYR 31 -11.624 -9.874 -6.291 267 HB2 TYR 64 HB2 TYR 31 -11.945 -12.030 -5.354 268 HB3 TYR 64 HB3 TYR 31 -11.791 -12.826 -6.926 269 HD1 TYR 64 HD1 TYR 31 -9.835 -11.321 -4.171 270 HD2 TYR 64 HD2 TYR 31 -9.740 -13.319 -7.995 271 HE1 TYR 64 HE1 TYR 31 -7.420 -11.771 -3.882 272 HE2 TYR 64 HE2 TYR 31 -7.350 -13.707 -7.728 273 HH TYR 64 HH TYR 31 -5.459 -13.368 -6.483 274 H ARG 65 H ARG 32 -11.463 -11.989 -9.224 275 HA ARG 65 HA ARG 32 -8.822 -11.198 -9.816 276 HB2 ARG 65 HB2 ARG 32 -9.934 -13.306 -10.537 277 HB3 ARG 65 HB3 ARG 32 -10.867 -12.403 -11.738 278 HG2 ARG 65 HG2 ARG 32 -7.941 -11.848 -11.832 279 HG3 ARG 65 HG3 ARG 32 -8.323 -13.554 -12.028 280 HD2 ARG 65 HD2 ARG 32 -9.812 -12.997 -13.915 281 HD3 ARG 65 HD3 ARG 32 -9.408 -11.270 -13.709 282 HE ARG 65 HE ARG 32 -7.013 -12.755 -13.840 283 HH11 ARG 65 HH11 ARG 32 -9.677 -11.854 -16.019 284 HH12 ARG 65 HH12 ARG 32 -8.715 -11.884 -17.456 285 HH21 ARG 65 HH21 ARG 32 -5.719 -12.795 -15.760 286 HH22 ARG 65 HH22 ARG 32 -6.419 -12.459 -17.301 287 H SER 66 H SER 33 -11.945 -9.834 -10.791 288 HA SER 66 HA SER 33 -10.939 -8.057 -12.789 289 HB2 SER 66 HB2 SER 33 -13.306 -7.691 -10.900 290 HB3 SER 66 HB3 SER 33 -12.993 -6.766 -12.368 291 HG SER 66 HG SER 33 -13.516 -9.575 -12.175 292 H LEU 67 H LEU 34 -10.999 -7.814 -9.178 293 HA LEU 67 HA LEU 34 -9.913 -5.111 -9.291 294 HB2 LEU 67 HB2 LEU 34 -11.302 -5.837 -7.400 295 HB3 LEU 67 HB3 LEU 34 -10.087 -7.034 -6.945 296 HG LEU 67 HG LEU 34 -8.443 -5.251 -6.489 297 HD11 LEU 67 HD11 LEU 34 -10.677 -3.323 -7.269 298 HD12 LEU 67 HD12 LEU 34 -9.186 -2.855 -6.412 299 HD13 LEU 67 HD13 LEU 34 -9.088 -3.483 -8.056 300 HD21 LEU 67 HD21 LEU 34 -11.111 -4.704 -5.128 301 HD22 LEU 67 HD22 LEU 34 -9.957 -5.985 -4.692 302 HD23 LEU 67 HD23 LEU 34 -9.505 -4.286 -4.503 303 H THR 68 H THR 35 -8.431 -8.376 -8.471 304 HA THR 68 HA THR 35 -5.863 -7.186 -7.912 305 HB THR 68 HB THR 35 -5.155 -9.654 -8.052 306 HG1 THR 68 HG1 THR 35 -6.915 -11.127 -8.266 307 HG21 THR 68 HG21 THR 35 -6.256 -10.313 -6.027 308 HG22 THR 68 HG22 THR 35 -5.842 -8.615 -5.908 309 HG23 THR 68 HG23 THR 35 -7.539 -9.100 -6.254 310 H GLY 69 H GLY 36 -7.268 -8.743 -10.809 311 HA2 GLY 69 HA2 GLY 36 -6.451 -8.861 -12.970 312 HA3 GLY 69 HA3 GLY 36 -4.965 -8.009 -12.491 313 H ASP 70 H ASP 37 -6.065 -10.724 -10.485 314 HA ASP 70 HA ASP 37 -4.321 -12.699 -11.808 315 HB2 ASP 70 HB2 ASP 37 -2.951 -11.430 -10.029 316 HB3 ASP 70 HB3 ASP 37 -4.087 -12.057 -8.824 317 H TRP 71 H TRP 38 -4.898 -14.898 -11.016 318 HA TRP 71 HA TRP 38 -7.693 -15.071 -10.024 319 HB2 TRP 71 HB2 TRP 38 -5.755 -17.220 -10.974 320 HB3 TRP 71 HB3 TRP 38 -7.445 -17.465 -10.578 321 HD1 TRP 71 HD1 TRP 38 -5.226 -16.609 -13.412 322 HE1 TRP 71 HE1 TRP 38 -6.560 -16.110 -15.527 323 HE3 TRP 71 HE3 TRP 38 -9.853 -16.057 -11.303 324 HZ2 TRP 71 HZ2 TRP 38 -9.321 -15.526 -16.228 325 HZ3 TRP 71 HZ3 TRP 38 -11.791 -15.423 -12.704 326 HH2 TRP 71 HH2 TRP 38 -11.559 -15.202 -15.165 327 H ILE 72 H ILE 39 -8.156 -16.381 -8.091 328 HA ILE 72 HA ILE 39 -6.508 -15.783 -5.939 329 HB ILE 72 HB ILE 39 -8.790 -17.713 -6.290 330 HG12 ILE 72 HG12 ILE 39 -8.216 -15.200 -4.658 331 HG13 ILE 72 HG13 ILE 39 -9.218 -15.342 -6.115 332 HG21 ILE 72 HG21 ILE 39 -7.210 -17.493 -3.686 333 HG22 ILE 72 HG22 ILE 39 -8.771 -18.321 -3.902 334 HG23 ILE 72 HG23 ILE 39 -7.365 -18.925 -4.734 335 HD11 ILE 72 HD11 ILE 39 -10.563 -15.054 -4.157 336 HD12 ILE 72 HD12 ILE 39 -10.865 -16.658 -4.878 337 HD13 ILE 72 HD13 ILE 39 -9.882 -16.491 -3.397 338 HA PRO 73 HA PRO 40 -3.424 -18.930 -6.381 339 HB2 PRO 73 HB2 PRO 40 -1.684 -18.229 -4.421 340 HB3 PRO 73 HB3 PRO 40 -2.000 -17.171 -5.812 341 HG2 PRO 73 HG2 PRO 40 -3.338 -17.067 -3.097 342 HG3 PRO 73 HG3 PRO 40 -2.497 -15.733 -3.961 343 HD2 PRO 73 HD2 PRO 40 -5.212 -16.118 -4.079 344 HD3 PRO 73 HD3 PRO 40 -4.280 -15.520 -5.488 345 H PHE 74 H PHE 41 -5.780 -20.126 -5.371 346 HA PHE 74 HA PHE 41 -5.613 -20.787 -2.555 347 HB2 PHE 74 HB2 PHE 41 -7.419 -22.319 -2.904 348 HB3 PHE 74 HB3 PHE 41 -7.787 -20.798 -3.661 349 HD1 PHE 74 HD2 PHE 41 -7.589 -20.642 -6.270 350 HD2 PHE 74 HD1 PHE 41 -7.429 -24.358 -4.080 351 HE1 PHE 74 HE2 PHE 41 -8.095 -21.888 -8.341 352 HE2 PHE 74 HE1 PHE 41 -8.011 -25.590 -6.147 353 HZ PHE 74 HZ PHE 41 -8.336 -24.359 -8.289 354 H LYS 75 H LYS 42 -5.144 -22.914 -5.415 355 HA LYS 75 HA LYS 42 -3.991 -25.045 -3.901 356 HB2 LYS 75 HB2 LYS 42 -5.191 -25.071 -6.146 357 HB3 LYS 75 HB3 LYS 42 -3.727 -24.416 -6.874 358 HG2 LYS 75 HG2 LYS 42 -2.473 -26.440 -6.075 359 HG3 LYS 75 HG3 LYS 42 -3.968 -27.063 -5.346 360 HD2 LYS 75 HD2 LYS 42 -5.029 -27.143 -7.577 361 HD3 LYS 75 HD3 LYS 42 -3.556 -26.482 -8.314 362 HE2 LYS 75 HE2 LYS 42 -2.280 -28.465 -7.491 363 HE3 LYS 75 HE3 LYS 42 -3.767 -29.116 -6.780 364 HZ1 LYS 75 HZ1 LYS 42 -3.307 -28.649 -9.682 365 HZ2 LYS 75 HZ2 LYS 42 -3.302 -30.102 -8.938 366 HZ3 LYS 75 HZ3 LYS 42 -4.690 -29.249 -9.035 367 H GLN 76 H GLN 43 -2.735 -22.171 -5.364 368 HA GLN 76 HA GLN 43 0.020 -22.911 -5.554 369 HB2 GLN 76 HB2 GLN 43 -1.270 -20.147 -5.567 370 HB3 GLN 76 HB3 GLN 43 0.319 -20.584 -6.160 371 HG2 GLN 76 HG2 GLN 43 -0.804 -20.482 -8.144 372 HG3 GLN 76 HG3 GLN 43 -1.015 -22.187 -7.812 373 HE21 GLN 76 HE22 GLN 43 -2.700 -19.880 -9.319 374 HE22 GLN 76 HE21 GLN 43 -4.306 -20.103 -8.638 375 H LEU 77 H LEU 44 -1.953 -21.119 -3.119 376 HA LEU 77 HA LEU 44 0.238 -20.789 -1.219 377 HB2 LEU 77 HB2 LEU 44 -2.749 -20.469 -1.014 378 HB3 LEU 77 HB3 LEU 44 -1.637 -20.234 0.342 379 HG LEU 77 HG LEU 44 -1.506 -18.623 -2.229 380 HD11 LEU 77 HD11 LEU 44 -2.714 -17.818 0.464 381 HD12 LEU 77 HD12 LEU 44 -2.579 -16.791 -0.967 382 HD13 LEU 77 HD13 LEU 44 -3.642 -18.197 -1.007 383 HD21 LEU 77 HD21 LEU 44 0.634 -18.630 -1.058 384 HD22 LEU 77 HD22 LEU 44 -0.143 -17.055 -0.888 385 HD23 LEU 77 HD23 LEU 44 -0.163 -18.199 0.472 386 H GLY 78 H GLY 45 -2.221 -23.240 -1.956 387 HA2 GLY 78 HA2 GLY 45 -1.418 -25.526 -1.541 388 HA3 GLY 78 HA3 GLY 45 -0.937 -25.029 0.080 389 H TYR 79 H TYR 46 -3.937 -23.620 -0.871 390 HA TYR 79 HA TYR 46 -5.469 -25.326 0.965 391 HB2 TYR 79 HB2 TYR 46 -6.359 -23.016 -0.807 392 HB3 TYR 79 HB3 TYR 46 -7.270 -23.755 0.502 393 HD1 TYR 79 HD2 TYR 46 -6.336 -23.624 2.887 394 HD2 TYR 79 HD1 TYR 46 -4.807 -21.258 -0.372 395 HE1 TYR 79 HE2 TYR 46 -5.229 -22.137 4.495 396 HE2 TYR 79 HE1 TYR 46 -3.704 -19.741 1.222 397 HH TYR 79 HH TYR 46 -3.297 -19.257 3.509 398 HA PRO 80 HA PRO 47 -6.369 -27.855 -2.543 399 HB2 PRO 80 HB2 PRO 47 -8.614 -29.298 -1.767 400 HB3 PRO 80 HB3 PRO 47 -6.984 -29.562 -1.085 401 HG2 PRO 80 HG2 PRO 47 -9.206 -27.801 0.035 402 HG3 PRO 80 HG3 PRO 47 -8.272 -29.067 0.899 403 HD2 PRO 80 HD2 PRO 47 -7.515 -26.482 1.101 404 HD3 PRO 80 HD3 PRO 47 -6.280 -27.747 0.861 405 H THR 81 H THR 48 -9.005 -25.732 -1.388 406 HA THR 81 HA THR 48 -10.079 -25.567 -4.147 407 HB THR 81 HB THR 48 -12.356 -25.736 -3.005 408 HG1 THR 81 HG1 THR 48 -12.108 -26.860 -0.862 409 HG21 THR 81 HG21 THR 48 -12.456 -28.112 -2.819 410 HG22 THR 81 HG22 THR 48 -11.297 -27.753 -4.107 411 HG23 THR 81 HG23 THR 48 -10.723 -28.248 -2.497 412 H LEU 82 H LEU 49 -11.619 -23.709 -4.348 413 HA LEU 82 HA LEU 49 -10.652 -21.255 -3.195 414 HB2 LEU 82 HB2 LEU 49 -13.291 -22.001 -4.555 415 HB3 LEU 82 HB3 LEU 49 -12.989 -20.399 -3.929 416 HG LEU 82 HG LEU 49 -12.613 -20.313 -6.256 417 HD11 LEU 82 HD11 LEU 49 -9.854 -20.392 -4.972 418 HD12 LEU 82 HD12 LEU 49 -10.324 -19.504 -6.408 419 HD13 LEU 82 HD13 LEU 49 -11.016 -19.043 -4.835 420 HD21 LEU 82 HD21 LEU 49 -12.204 -22.725 -6.682 421 HD22 LEU 82 HD22 LEU 49 -11.059 -21.676 -7.514 422 HD23 LEU 82 HD23 LEU 49 -10.543 -22.531 -6.059 423 H GLU 83 H GLU 50 -13.319 -23.490 -2.277 424 HA GLU 83 HA GLU 50 -14.242 -21.781 -0.201 425 HB2 GLU 83 HB2 GLU 50 -15.464 -23.596 0.698 426 HB3 GLU 83 HB3 GLU 50 -15.588 -23.638 -1.055 427 HG2 GLU 83 HG2 GLU 50 -14.009 -25.503 -1.169 428 HG3 GLU 83 HG3 GLU 50 -13.757 -25.434 0.585 429 H ALA 84 H ALA 51 -11.712 -24.413 -0.113 430 HA ALA 84 HA ALA 51 -11.246 -24.190 2.671 431 HB1 ALA 84 HB1 ALA 51 -9.115 -25.299 2.192 432 HB2 ALA 84 HB2 ALA 51 -10.471 -26.063 1.329 433 HB3 ALA 84 HB3 ALA 51 -9.343 -25.002 0.448 434 H TYR 85 H TYR 52 -9.725 -22.411 -0.063 435 HA TYR 85 HA TYR 52 -7.953 -20.828 1.488 436 HB2 TYR 85 HB2 TYR 52 -7.747 -20.831 -0.887 437 HB3 TYR 85 HB3 TYR 52 -9.425 -20.345 -1.125 438 HD1 TYR 85 HD1 TYR 52 -6.162 -19.160 0.277 439 HD2 TYR 85 HD2 TYR 52 -10.024 -18.063 -1.291 440 HE1 TYR 85 HE1 TYR 52 -5.467 -16.808 0.321 441 HE2 TYR 85 HE2 TYR 52 -9.338 -15.683 -1.282 442 HH TYR 85 HH TYR 52 -6.156 -14.587 0.014 443 H LEU 86 H LEU 53 -11.416 -20.123 0.547 444 HA LEU 86 HA LEU 53 -11.598 -17.743 2.070 445 HB2 LEU 86 HB2 LEU 53 -13.720 -19.740 1.183 446 HB3 LEU 86 HB3 LEU 53 -14.078 -18.154 1.862 447 HG LEU 86 HG LEU 53 -12.298 -18.355 -0.592 448 HD11 LEU 86 HD11 LEU 53 -14.375 -17.998 -1.963 449 HD12 LEU 86 HD12 LEU 53 -14.232 -19.609 -1.261 450 HD13 LEU 86 HD13 LEU 53 -15.322 -18.442 -0.510 451 HD21 LEU 86 HD21 LEU 53 -13.137 -16.119 -1.013 452 HD22 LEU 86 HD22 LEU 53 -14.203 -16.194 0.406 453 HD23 LEU 86 HD23 LEU 53 -12.429 -16.193 0.602 454 H ARG 87 H ARG 54 -12.227 -21.116 3.095 455 HA ARG 87 HA ARG 54 -13.197 -20.536 5.759 456 HB2 ARG 87 HB2 ARG 54 -11.541 -22.893 4.715 457 HB3 ARG 87 HB3 ARG 54 -11.872 -22.694 6.410 458 HG2 ARG 87 HG2 ARG 54 -13.414 -24.250 5.750 459 HG3 ARG 87 HG3 ARG 54 -14.346 -22.760 5.923 460 HD2 ARG 87 HD2 ARG 54 -14.490 -22.522 3.498 461 HD3 ARG 87 HD3 ARG 54 -13.185 -23.675 3.303 462 HE ARG 87 HE ARG 54 -14.656 -25.211 2.900 463 HH11 ARG 87 HH11 ARG 54 -16.087 -23.520 5.724 464 HH12 ARG 87 HH12 ARG 54 -17.505 -24.510 5.721 465 HH21 ARG 87 HH21 ARG 54 -16.566 -26.321 2.810 466 HH22 ARG 87 HH22 ARG 54 -17.752 -26.199 4.084 467 H SER 88 H SER 55 -9.925 -20.544 4.400 468 HA SER 88 HA SER 55 -8.639 -20.426 6.978 469 HB2 SER 88 HB2 SER 55 -7.509 -20.250 4.167 470 HB3 SER 88 HB3 SER 55 -6.598 -20.514 5.669 471 HG SER 88 HG SER 55 -8.480 -22.215 4.396 472 H VAL 89 H VAL 56 -10.310 -17.956 5.741 473 HA VAL 89 HA VAL 56 -8.399 -15.965 6.858 474 HB VAL 89 HB VAL 56 -8.253 -15.776 4.502 475 HG11 VAL 89 HG11 VAL 56 -10.324 -15.083 3.128 476 HG12 VAL 89 HG12 VAL 56 -10.068 -16.773 3.521 477 HG13 VAL 89 HG13 VAL 56 -11.263 -15.847 4.433 478 HG21 VAL 89 HG21 VAL 56 -10.000 -13.444 5.249 479 HG22 VAL 89 HG22 VAL 56 -8.326 -13.642 5.832 480 HG23 VAL 89 HG23 VAL 56 -8.665 -13.511 4.094 481 HA PRO 90 HA PRO 57 -12.832 -16.193 8.508 482 HB2 PRO 90 HB2 PRO 57 -12.583 -17.169 11.036 483 HB3 PRO 90 HB3 PRO 57 -12.582 -18.232 9.594 484 HG2 PRO 90 HG2 PRO 57 -10.183 -17.182 11.128 485 HG3 PRO 90 HG3 PRO 57 -10.519 -18.856 10.588 486 HD2 PRO 90 HD2 PRO 57 -8.923 -17.136 9.156 487 HD3 PRO 90 HD3 PRO 57 -9.944 -18.385 8.401 488 H ALA 91 H ALA 58 -9.887 -14.736 9.786 489 HA ALA 91 HA ALA 58 -11.261 -13.033 11.714 490 HB1 ALA 91 HB1 ALA 58 -9.015 -12.071 12.033 491 HB2 ALA 91 HB2 ALA 58 -8.941 -13.842 12.062 492 HB3 ALA 91 HB3 ALA 58 -8.410 -12.952 10.618 493 H VAL 92 H VAL 59 -11.009 -12.913 8.314 494 HA VAL 92 HA VAL 59 -11.476 -9.966 8.311 495 HB VAL 92 HB VAL 59 -9.739 -11.450 6.318 496 HG11 VAL 92 HG11 VAL 59 -10.740 -9.362 5.466 497 HG12 VAL 92 HG12 VAL 59 -10.071 -8.462 6.845 498 HG13 VAL 92 HG13 VAL 59 -8.989 -9.204 5.648 499 HG21 VAL 92 HG21 VAL 59 -7.778 -10.298 7.353 500 HG22 VAL 92 HG22 VAL 59 -8.822 -9.800 8.703 501 HG23 VAL 92 HG23 VAL 59 -8.481 -11.521 8.400 502 H VAL 93 H VAL 60 -12.303 -13.147 7.067 503 HA VAL 93 HA VAL 60 -14.386 -11.993 5.297 504 HB VAL 93 HB VAL 60 -12.195 -13.995 4.756 505 HG11 VAL 93 HG11 VAL 60 -14.609 -13.650 2.954 506 HG12 VAL 93 HG12 VAL 60 -13.114 -14.503 2.540 507 HG13 VAL 93 HG13 VAL 60 -14.138 -15.119 3.832 508 HG21 VAL 93 HG21 VAL 60 -11.877 -12.517 2.708 509 HG22 VAL 93 HG22 VAL 60 -13.026 -11.388 3.466 510 HG23 VAL 93 HG23 VAL 60 -11.493 -11.776 4.256 511 H ARG 94 H ARG 61 -16.007 -13.698 4.802 512 HA ARG 94 HA ARG 61 -16.500 -15.644 6.982 513 HB2 ARG 94 HB2 ARG 61 -17.365 -13.702 7.972 514 HB3 ARG 94 HB3 ARG 61 -17.997 -13.064 6.455 515 HG2 ARG 94 HG2 ARG 61 -19.849 -14.662 6.492 516 HG3 ARG 94 HG3 ARG 61 -19.142 -15.504 7.884 517 HD2 ARG 94 HD2 ARG 61 -21.039 -14.017 8.498 518 HD3 ARG 94 HD3 ARG 61 -19.525 -13.619 9.328 519 HE ARG 94 HE ARG 61 -19.957 -12.081 6.880 520 HH11 ARG 94 HH11 ARG 61 -21.147 -12.217 10.207 521 HH12 ARG 94 HH12 ARG 61 -21.158 -10.500 10.430 522 HH21 ARG 94 HH21 ARG 61 -19.616 -9.808 7.304 523 HH22 ARG 94 HH22 ARG 61 -20.426 -9.093 8.663 524 H ILE 95 H ILE 62 -18.241 -17.157 6.298 525 HA ILE 95 HA ILE 62 -19.120 -16.925 3.501 526 HB ILE 95 HB ILE 62 -18.396 -19.234 3.008 527 HG12 ILE 95 HG12 ILE 62 -16.767 -19.057 5.577 528 HG13 ILE 95 HG13 ILE 62 -18.141 -20.139 5.274 529 HG21 ILE 95 HG21 ILE 62 -15.929 -17.592 3.704 530 HG22 ILE 95 HG22 ILE 62 -16.189 -18.730 2.351 531 HG23 ILE 95 HG23 ILE 62 -17.015 -17.182 2.356 532 HD11 ILE 95 HD11 ILE 62 -16.129 -21.393 5.051 533 HD12 ILE 95 HD12 ILE 62 -16.830 -21.214 3.428 534 HD13 ILE 95 HD13 ILE 62 -15.423 -20.225 3.925 535 H GLU 96 H GLU 63 -20.949 -18.194 3.036 536 HA GLU 96 HA GLU 63 -22.117 -19.828 5.244 537 HB2 GLU 96 HB2 GLU 63 -23.603 -17.900 3.412 538 HB3 GLU 96 HB3 GLU 63 -24.354 -19.132 4.434 539 HG2 GLU 96 HG2 GLU 63 -23.218 -18.016 6.424 540 HG3 GLU 96 HG3 GLU 63 -22.811 -16.678 5.334 541 H ALA 97 H ALA 64 -21.565 -21.799 4.421 542 HA ALA 97 HA ALA 64 -21.978 -22.509 1.597 543 HB1 ALA 97 HB1 ALA 64 -20.184 -23.608 2.842 544 HB2 ALA 97 HB2 ALA 64 -21.361 -24.205 4.047 545 HB3 ALA 97 HB3 ALA 64 -21.421 -24.780 2.367 546 H SER 98 H SER 65 -23.981 -22.760 0.841 547 HA SER 98 HA SER 65 -26.288 -22.851 2.633 548 HB2 SER 98 HB2 SER 65 -26.152 -21.411 0.592 549 HB3 SER 98 HB3 SER 65 -26.079 -22.869 -0.415 550 HG SER 98 HG SER 65 -28.230 -21.937 -0.147 551 H ARG 99 H ARG 66 -27.960 -24.432 2.283 552 HA ARG 99 HA ARG 66 -27.060 -27.152 2.377 553 HB2 ARG 99 HB2 ARG 66 -29.406 -27.762 2.569 554 HB3 ARG 99 HB3 ARG 66 -28.985 -26.434 3.621 555 HG2 ARG 99 HG2 ARG 66 -31.114 -25.938 2.835 556 HG3 ARG 99 HG3 ARG 66 -30.054 -24.832 1.984 557 HD2 ARG 99 HD2 ARG 66 -31.863 -25.711 0.548 558 HD3 ARG 99 HD3 ARG 66 -30.291 -26.116 -0.080 559 HE ARG 99 HE ARG 66 -30.641 -28.364 0.311 560 HH11 ARG 99 HH11 ARG 66 -33.324 -26.543 1.786 561 HH12 ARG 99 HH12 ARG 66 -34.300 -27.943 2.061 562 HH21 ARG 99 HH21 ARG 66 -31.939 -30.222 0.683 563 HH22 ARG 99 HH22 ARG 66 -33.483 -30.075 1.433 564 H SER 100 H SER 67 -27.855 -25.136 -0.348 565 HA SER 100 HA SER 67 -28.440 -27.201 -2.225 566 HB2 SER 100 HB2 SER 67 -27.169 -24.490 -2.746 567 HB3 SER 100 HB3 SER 67 -28.147 -25.461 -3.866 568 HG SER 100 HG SER 67 -29.384 -23.781 -2.880 569 H GLY 101 H GLY 68 -25.471 -26.576 -0.582 570 HA2 GLY 101 HA2 GLY 68 -23.393 -27.491 -0.877 571 HA3 GLY 101 HA3 GLY 68 -23.940 -28.321 -2.346 572 H GLU 102 H GLU 69 -24.199 -24.830 -1.639 573 HA GLU 102 HA GLU 69 -21.988 -24.149 -3.474 574 HB2 GLU 102 HB2 GLU 69 -24.750 -22.834 -3.388 575 HB3 GLU 102 HB3 GLU 69 -23.339 -22.157 -4.205 576 HG2 GLU 102 HG2 GLU 69 -23.222 -24.185 -5.661 577 HG3 GLU 102 HG3 GLU 69 -24.697 -24.800 -4.900 578 H ILE 103 H ILE 70 -21.293 -21.800 -2.808 579 HA ILE 103 HA ILE 70 -21.886 -21.246 0.016 580 HB ILE 103 HB ILE 70 -20.002 -22.592 0.307 581 HG12 ILE 103 HG12 ILE 70 -19.897 -20.232 1.350 582 HG13 ILE 103 HG13 ILE 70 -18.515 -21.309 1.444 583 HG21 ILE 103 HG21 ILE 70 -18.695 -21.343 -2.077 584 HG22 ILE 103 HG22 ILE 70 -17.830 -22.345 -0.886 585 HG23 ILE 103 HG23 ILE 70 -19.159 -23.039 -1.817 586 HD11 ILE 103 HD11 ILE 70 -18.658 -19.231 -0.775 587 HD12 ILE 103 HD12 ILE 70 -18.057 -18.847 0.829 588 HD13 ILE 103 HD13 ILE 70 -17.249 -20.093 -0.132 589 H VAL 104 H VAL 71 -21.949 -19.184 0.524 590 HA VAL 104 HA VAL 71 -21.431 -17.172 -1.609 591 HB VAL 104 HB VAL 71 -23.228 -16.936 0.843 592 HG11 VAL 104 HG11 VAL 71 -24.232 -15.069 -0.451 593 HG12 VAL 104 HG12 VAL 71 -22.506 -14.806 -0.166 594 HG13 VAL 104 HG13 VAL 71 -23.074 -15.344 -1.766 595 HG21 VAL 104 HG21 VAL 71 -24.189 -18.758 -0.515 596 HG22 VAL 104 HG22 VAL 71 -25.174 -17.308 -0.630 597 HG23 VAL 104 HG23 VAL 71 -24.096 -17.739 -1.967 598 H CYS 105 H CYS 72 -19.885 -15.650 -1.140 599 HA CYS 105 HA CYS 72 -18.425 -15.898 1.430 600 HB2 CYS 105 HB2 CYS 72 -17.543 -14.369 -1.043 601 HB3 CYS 105 HB3 CYS 72 -16.533 -15.059 0.246 602 HG CYS 105 HG CYS 72 -18.261 -16.487 -2.189 603 H TYR 106 H TYR 73 -17.890 -14.030 2.655 604 HA TYR 106 HA TYR 73 -19.174 -11.430 1.991 605 HB2 TYR 106 HB2 TYR 73 -19.493 -13.083 4.537 606 HB3 TYR 106 HB3 TYR 73 -19.972 -11.403 4.401 607 HD1 TYR 106 HD1 TYR 73 -21.701 -10.738 2.613 608 HD2 TYR 106 HD2 TYR 73 -20.982 -14.829 3.845 609 HE1 TYR 106 HE1 TYR 73 -23.987 -11.328 1.932 610 HE2 TYR 106 HE2 TYR 73 -23.237 -15.461 3.079 611 HH TYR 106 HH TYR 73 -25.319 -14.676 2.280 612 H ALA 107 H ALA 74 -18.401 -9.742 3.612 613 HA ALA 107 HA ALA 74 -15.516 -10.178 4.243 614 HB1 ALA 107 HB1 ALA 74 -17.201 -7.640 4.432 615 HB2 ALA 107 HB2 ALA 74 -15.427 -7.789 4.581 616 HB3 ALA 107 HB3 ALA 74 -16.202 -8.088 3.034 617 H VAL 108 H VAL 75 -14.779 -9.394 6.331 618 HA VAL 108 HA VAL 75 -16.787 -9.148 8.494 619 HB VAL 108 HB VAL 75 -15.119 -11.470 8.068 620 HG11 VAL 108 HG11 VAL 75 -14.686 -10.267 10.827 621 HG12 VAL 108 HG12 VAL 75 -14.195 -11.878 10.256 622 HG13 VAL 108 HG13 VAL 75 -13.444 -10.439 9.568 623 HG21 VAL 108 HG21 VAL 75 -17.504 -11.468 8.681 624 HG22 VAL 108 HG22 VAL 75 -16.545 -12.412 9.833 625 HG23 VAL 108 HG23 VAL 75 -17.103 -10.787 10.274 626 H ALA 109 H ALA 76 -13.567 -8.312 7.235 627 HA ALA 109 HA ALA 76 -13.533 -6.001 9.011 628 HB1 ALA 109 HB1 ALA 76 -12.299 -7.776 10.327 629 HB2 ALA 109 HB2 ALA 76 -11.144 -7.894 8.981 630 HB3 ALA 109 HB3 ALA 76 -11.308 -6.377 9.879 Start of MODEL 16 1 H1 GLY -2 H1 GLY -2 8.317 0.721 0.342 2 H2 GLY -2 H2 GLY -2 7.903 0.206 -1.160 3 H3 GLY -2 H3 GLY -2 6.996 1.346 -0.412 4 HA2 GLY -2 HA2 GLY -2 7.286 -1.448 0.483 5 HA3 GLY -2 HA3 GLY -2 6.306 -0.215 1.287 6 H HIS -1 H HIS -1 5.620 -2.850 -0.055 7 HA HIS -1 HA HIS -1 3.172 -1.927 -1.350 8 HB2 HIS -1 HB2 HIS -1 4.798 -2.162 -3.245 9 HB3 HIS -1 HB3 HIS -1 5.025 -3.857 -2.786 10 HD2 HIS -1 HD2 HIS -1 3.657 -5.320 -4.396 11 HE1 HIS -1 HE1 HIS -1 0.162 -2.929 -4.890 12 HE2 HIS -1 HE2 HIS -1 1.297 -5.117 -5.552 13 H MET 34 H MET 1 1.676 -3.855 -1.577 14 HA MET 34 HA MET 1 1.603 -5.390 0.839 15 HB2 MET 34 HB2 MET 1 0.167 -5.752 -1.825 16 HB3 MET 34 HB3 MET 1 -0.217 -6.626 -0.340 17 HG2 MET 34 HG2 MET 1 -1.508 -4.967 0.418 18 HG3 MET 34 HG3 MET 1 -0.235 -3.786 0.181 19 HE1 MET 34 HE1 MET 1 -4.088 -4.049 -2.212 20 HE2 MET 34 HE2 MET 1 -3.297 -5.612 -2.102 21 HE3 MET 34 HE3 MET 1 -3.716 -4.724 -0.612 22 H LEU 35 H LEU 2 2.199 -7.520 1.241 23 HA LEU 35 HA LEU 2 4.065 -8.895 -0.593 24 HB2 LEU 35 HB2 LEU 2 2.868 -9.593 2.134 25 HB3 LEU 35 HB3 LEU 2 3.779 -10.748 1.196 26 HG LEU 35 HG LEU 2 5.175 -9.846 2.893 27 HD11 LEU 35 HD11 LEU 2 7.112 -9.181 1.607 28 HD12 LEU 35 HD12 LEU 2 6.214 -10.413 0.705 29 HD13 LEU 35 HD13 LEU 2 6.107 -8.702 0.229 30 HD21 LEU 35 HD21 LEU 2 4.872 -7.065 1.696 31 HD22 LEU 35 HD22 LEU 2 4.082 -7.628 3.188 32 HD23 LEU 35 HD23 LEU 2 5.851 -7.544 3.095 33 H GLU 36 H GLU 3 3.430 -11.302 -1.210 34 HA GLU 36 HA GLU 3 1.159 -11.084 -2.825 35 HB2 GLU 36 HB2 GLU 3 2.989 -12.668 -3.264 36 HB3 GLU 36 HB3 GLU 3 2.475 -13.657 -1.886 37 HG2 GLU 36 HG2 GLU 3 0.344 -14.156 -2.948 38 HG3 GLU 36 HG3 GLU 3 0.704 -13.044 -4.276 39 H ALA 37 H ALA 4 1.365 -12.954 0.206 40 HA ALA 37 HA ALA 4 -1.370 -13.724 0.033 41 HB1 ALA 37 HB1 ALA 4 0.265 -15.004 1.352 42 HB2 ALA 37 HB2 ALA 4 0.361 -13.672 2.533 43 HB3 ALA 37 HB3 ALA 4 -1.161 -14.568 2.304 44 H ASP 38 H ASP 5 0.195 -10.891 1.447 45 HA ASP 38 HA ASP 5 -2.093 -9.951 2.952 46 HB2 ASP 38 HB2 ASP 5 0.287 -9.277 3.364 47 HB3 ASP 38 HB3 ASP 5 0.281 -8.398 1.832 48 H LEU 39 H LEU 6 -0.804 -9.358 -0.339 49 HA LEU 39 HA LEU 6 -2.553 -7.288 -1.114 50 HB2 LEU 39 HB2 LEU 6 -0.485 -7.905 -2.312 51 HB3 LEU 39 HB3 LEU 6 -1.149 -9.441 -2.778 52 HG LEU 39 HG LEU 6 -2.623 -6.935 -3.609 53 HD11 LEU 39 HD11 LEU 6 -0.265 -6.479 -4.144 54 HD12 LEU 39 HD12 LEU 6 -0.163 -8.028 -5.023 55 HD13 LEU 39 HD13 LEU 6 -1.223 -6.729 -5.610 56 HD21 LEU 39 HD21 LEU 6 -3.059 -8.268 -5.685 57 HD22 LEU 39 HD22 LEU 6 -2.213 -9.643 -4.955 58 HD23 LEU 39 HD23 LEU 6 -3.719 -9.021 -4.245 59 H VAL 40 H VAL 7 -2.676 -10.814 -1.770 60 HA VAL 40 HA VAL 7 -5.149 -10.652 -3.122 61 HB VAL 40 HB VAL 7 -5.185 -13.109 -2.990 62 HG11 VAL 40 HG11 VAL 7 -3.700 -11.892 -4.604 63 HG12 VAL 40 HG12 VAL 7 -2.353 -12.074 -3.477 64 HG13 VAL 40 HG13 VAL 7 -3.122 -13.504 -4.180 65 HG21 VAL 40 HG21 VAL 7 -4.517 -13.573 -0.736 66 HG22 VAL 40 HG22 VAL 7 -3.330 -14.311 -1.811 67 HG23 VAL 40 HG23 VAL 7 -2.957 -12.795 -0.989 68 H SER 41 H SER 8 -4.454 -11.278 0.379 69 HA SER 41 HA SER 8 -7.169 -11.781 1.067 70 HB2 SER 41 HB2 SER 8 -4.921 -10.672 2.805 71 HB3 SER 41 HB3 SER 8 -6.450 -11.370 3.375 72 HG SER 41 HG SER 8 -4.211 -12.608 2.208 73 H LYS 42 H LYS 9 -5.305 -8.629 1.167 74 HA LYS 42 HA LYS 9 -7.579 -7.184 2.252 75 HB2 LYS 42 HB2 LYS 9 -5.027 -6.339 0.817 76 HB3 LYS 42 HB3 LYS 9 -6.262 -5.168 1.308 77 HG2 LYS 42 HG2 LYS 9 -6.087 -5.814 3.652 78 HG3 LYS 42 HG3 LYS 9 -4.938 -7.113 3.241 79 HD2 LYS 42 HD2 LYS 9 -3.338 -5.474 2.363 80 HD3 LYS 42 HD3 LYS 9 -4.439 -4.141 2.763 81 HE2 LYS 42 HE2 LYS 9 -4.216 -4.513 5.114 82 HE3 LYS 42 HE3 LYS 9 -3.523 -6.123 4.868 83 HZ1 LYS 42 HZ1 LYS 9 -1.556 -5.133 3.941 84 HZ2 LYS 42 HZ2 LYS 9 -2.139 -3.593 4.167 85 HZ3 LYS 42 HZ3 LYS 9 -1.810 -4.552 5.457 86 H MET 43 H MET 10 -6.443 -7.745 -1.159 87 HA MET 43 HA MET 10 -8.486 -5.987 -2.220 88 HB2 MET 43 HB2 MET 10 -6.794 -8.161 -3.500 89 HB3 MET 43 HB3 MET 10 -7.949 -7.160 -4.391 90 HG2 MET 43 HG2 MET 10 -6.745 -5.110 -3.481 91 HG3 MET 43 HG3 MET 10 -5.489 -6.197 -2.894 92 HE1 MET 43 HE1 MET 10 -4.873 -3.726 -4.668 93 HE2 MET 43 HE2 MET 10 -3.530 -4.873 -4.369 94 HE3 MET 43 HE3 MET 10 -3.888 -4.330 -6.020 95 H LEU 44 H LEU 11 -8.367 -9.575 -1.754 96 HA LEU 44 HA LEU 11 -10.935 -10.293 -2.635 97 HB2 LEU 44 HB2 LEU 11 -9.279 -11.917 -1.827 98 HB3 LEU 44 HB3 LEU 11 -9.206 -11.129 -0.269 99 HG LEU 44 HG LEU 11 -11.577 -11.854 0.161 100 HD11 LEU 44 HD11 LEU 11 -10.977 -13.589 -2.276 101 HD12 LEU 44 HD12 LEU 11 -12.359 -13.782 -1.170 102 HD13 LEU 44 HD13 LEU 11 -12.229 -12.323 -2.189 103 HD21 LEU 44 HD21 LEU 11 -10.872 -14.180 0.703 104 HD22 LEU 44 HD22 LEU 11 -9.384 -13.900 -0.237 105 HD23 LEU 44 HD23 LEU 11 -9.703 -12.954 1.215 106 H ARG 45 H ARG 12 -9.974 -9.243 0.632 107 HA ARG 45 HA ARG 12 -12.522 -8.968 1.792 108 HB2 ARG 45 HB2 ARG 12 -10.627 -9.046 3.105 109 HB3 ARG 45 HB3 ARG 12 -9.774 -7.813 2.219 110 HG2 ARG 45 HG2 ARG 12 -12.223 -7.007 3.785 111 HG3 ARG 45 HG3 ARG 12 -10.688 -7.369 4.572 112 HD2 ARG 45 HD2 ARG 12 -9.604 -5.703 2.878 113 HD3 ARG 45 HD3 ARG 12 -11.274 -5.107 2.663 114 HE ARG 45 HE ARG 12 -10.483 -5.492 5.431 115 HH11 ARG 45 HH11 ARG 12 -9.818 -3.164 2.832 116 HH12 ARG 45 HH12 ARG 12 -9.905 -1.780 3.855 117 HH21 ARG 45 HH21 ARG 12 -10.949 -3.663 6.703 118 HH22 ARG 45 HH22 ARG 12 -10.423 -2.081 6.174 119 H ALA 46 H ALA 13 -10.679 -6.501 -0.122 120 HA ALA 46 HA ALA 13 -12.600 -4.503 0.406 121 HB1 ALA 46 HB1 ALA 13 -10.711 -4.763 -1.988 122 HB2 ALA 46 HB2 ALA 13 -11.514 -3.271 -1.466 123 HB3 ALA 46 HB3 ALA 13 -10.295 -4.033 -0.420 124 H VAL 47 H VAL 14 -12.377 -6.852 -2.330 125 HA VAL 47 HA VAL 14 -14.627 -5.828 -3.766 126 HB VAL 47 HB VAL 14 -13.490 -8.660 -3.547 127 HG11 VAL 47 HG11 VAL 14 -14.652 -9.169 -5.625 128 HG12 VAL 47 HG12 VAL 14 -15.812 -8.778 -4.356 129 HG13 VAL 47 HG13 VAL 14 -15.451 -7.571 -5.604 130 HG21 VAL 47 HG21 VAL 14 -13.151 -6.431 -5.618 131 HG22 VAL 47 HG22 VAL 14 -11.903 -7.040 -4.523 132 HG23 VAL 47 HG23 VAL 14 -12.517 -8.075 -5.803 133 H LEU 48 H LEU 15 -14.347 -8.249 -1.117 134 HA LEU 48 HA LEU 15 -17.110 -8.908 -1.009 135 HB2 LEU 48 HB2 LEU 15 -14.938 -8.950 1.144 136 HB3 LEU 48 HB3 LEU 15 -16.520 -9.685 1.323 137 HG LEU 48 HG LEU 15 -14.758 -10.469 -1.028 138 HD11 LEU 48 HD11 LEU 15 -13.953 -12.349 0.403 139 HD12 LEU 48 HD12 LEU 15 -13.385 -10.758 0.956 140 HD13 LEU 48 HD13 LEU 15 -14.714 -11.564 1.812 141 HD21 LEU 48 HD21 LEU 15 -17.200 -11.161 -0.919 142 HD22 LEU 48 HD22 LEU 15 -16.036 -12.504 -0.926 143 HD23 LEU 48 HD23 LEU 15 -16.812 -12.007 0.585 144 H GLN 49 H GLN 16 -15.303 -6.243 0.580 145 HA GLN 49 HA GLN 16 -17.551 -5.420 2.200 146 HB2 GLN 49 HB2 GLN 16 -14.901 -4.113 1.480 147 HB3 GLN 49 HB3 GLN 16 -16.125 -3.317 2.495 148 HG2 GLN 49 HG2 GLN 16 -16.157 -5.293 4.015 149 HG3 GLN 49 HG3 GLN 16 -14.874 -6.034 3.036 150 HE21 GLN 49 HE22 GLN 16 -14.502 -5.923 5.714 151 HE22 GLN 49 HE21 GLN 16 -13.267 -4.751 6.091 152 H SER 50 H SER 17 -16.408 -4.452 -1.091 153 HA SER 50 HA SER 17 -18.443 -2.450 -1.434 154 HB2 SER 50 HB2 SER 17 -17.034 -4.218 -3.484 155 HB3 SER 50 HB3 SER 17 -17.956 -2.750 -3.837 156 HG SER 50 HG SER 17 -15.702 -2.311 -3.697 157 H HIS 51 H HIS 18 -18.355 -5.987 -1.938 158 HA HIS 51 HA HIS 18 -21.042 -5.975 -3.140 159 HB2 HIS 51 HB2 HIS 18 -18.928 -8.129 -2.913 160 HB3 HIS 51 HB3 HIS 18 -20.480 -8.282 -3.723 161 HD2 HIS 51 HD2 HIS 18 -18.756 -8.890 -5.815 162 HE1 HIS 51 HE1 HIS 18 -17.987 -4.852 -6.853 163 HE2 HIS 51 HE2 HIS 18 -17.844 -7.243 -7.674 164 H LYS 52 H LYS 19 -21.741 -5.291 -0.776 165 HA LYS 52 HA LYS 19 -21.640 -7.128 1.354 166 HB2 LYS 52 HB2 LYS 19 -23.649 -4.926 0.695 167 HB3 LYS 52 HB3 LYS 19 -23.700 -5.823 2.208 168 HG2 LYS 52 HG2 LYS 19 -21.355 -4.123 1.272 169 HG3 LYS 52 HG3 LYS 19 -22.592 -3.660 2.435 170 HD2 LYS 52 HD2 LYS 19 -21.882 -5.674 3.861 171 HD3 LYS 52 HD3 LYS 19 -20.540 -5.902 2.745 172 HE2 LYS 52 HE2 LYS 19 -19.663 -4.682 4.591 173 HE3 LYS 52 HE3 LYS 19 -19.748 -3.563 3.225 174 HZ1 LYS 52 HZ1 LYS 19 -20.543 -2.574 5.295 175 HZ2 LYS 52 HZ2 LYS 19 -21.760 -2.603 4.220 176 HZ3 LYS 52 HZ3 LYS 19 -21.725 -3.684 5.454 177 H ASN 53 H ASN 20 -23.800 -7.271 -1.414 178 HA ASN 53 HA ASN 20 -25.751 -9.023 -0.236 179 HB2 ASN 53 HB2 ASN 20 -26.028 -7.796 -2.407 180 HB3 ASN 53 HB3 ASN 20 -24.787 -8.825 -3.135 181 HD21 ASN 53 HD22 ASN 20 -27.965 -9.058 -1.381 182 HD22 ASN 53 HD21 ASN 20 -28.527 -10.444 -2.286 183 H GLY 54 H GLY 21 -22.412 -9.581 -0.868 184 HA2 GLY 54 HA2 GLY 21 -21.176 -11.420 -0.471 185 HA3 GLY 54 HA3 GLY 21 -22.616 -12.451 -0.369 186 H ILE 55 H ILE 22 -20.454 -13.345 -1.795 187 HA ILE 55 HA ILE 22 -21.451 -13.361 -4.589 188 HB ILE 55 HB ILE 22 -18.866 -13.310 -5.168 189 HG12 ILE 55 HG12 ILE 22 -18.885 -11.575 -2.639 190 HG13 ILE 55 HG13 ILE 22 -17.931 -13.023 -2.930 191 HG21 ILE 55 HG21 ILE 22 -19.085 -11.121 -5.913 192 HG22 ILE 55 HG22 ILE 22 -20.744 -11.723 -5.896 193 HG23 ILE 55 HG23 ILE 22 -20.213 -10.651 -4.598 194 HD11 ILE 55 HD11 ILE 22 -16.818 -11.673 -4.857 195 HD12 ILE 55 HD12 ILE 22 -17.668 -10.266 -4.206 196 HD13 ILE 55 HD13 ILE 22 -16.492 -11.108 -3.207 197 H VAL 56 H VAL 23 -21.728 -15.314 -5.222 198 HA VAL 56 HA VAL 23 -21.115 -17.617 -3.718 199 HB VAL 56 HB VAL 23 -21.725 -18.797 -5.868 200 HG11 VAL 56 HG11 VAL 23 -24.073 -18.047 -5.882 201 HG12 VAL 56 HG12 VAL 23 -23.444 -18.264 -4.252 202 HG13 VAL 56 HG13 VAL 23 -23.637 -16.622 -4.915 203 HG21 VAL 56 HG21 VAL 23 -20.888 -17.110 -7.499 204 HG22 VAL 56 HG22 VAL 23 -22.583 -17.515 -7.770 205 HG23 VAL 56 HG23 VAL 23 -22.154 -15.977 -7.005 206 H LEU 57 H LEU 24 -19.346 -19.263 -4.001 207 HA LEU 57 HA LEU 24 -16.935 -18.101 -4.373 208 HB2 LEU 57 HB2 LEU 24 -15.768 -19.957 -4.046 209 HB3 LEU 57 HB3 LEU 24 -17.276 -20.259 -3.273 210 HG LEU 57 HG LEU 24 -17.895 -21.763 -5.277 211 HD11 LEU 57 HD11 LEU 24 -15.037 -21.061 -6.053 212 HD12 LEU 57 HD12 LEU 24 -15.689 -22.669 -6.423 213 HD13 LEU 57 HD13 LEU 24 -16.450 -21.276 -7.113 214 HD21 LEU 57 HD21 LEU 24 -16.373 -23.599 -4.494 215 HD22 LEU 57 HD22 LEU 24 -15.423 -22.384 -3.601 216 HD23 LEU 57 HD23 LEU 24 -17.108 -22.712 -3.178 217 HA PRO 58 HA PRO 25 -16.259 -19.117 -8.950 218 HB2 PRO 58 HB2 PRO 25 -18.391 -19.111 -10.694 219 HB3 PRO 58 HB3 PRO 25 -17.727 -20.584 -9.916 220 HG2 PRO 58 HG2 PRO 25 -20.134 -18.956 -9.070 221 HG3 PRO 58 HG3 PRO 25 -19.979 -20.731 -9.216 222 HD2 PRO 58 HD2 PRO 25 -19.738 -19.500 -6.832 223 HD3 PRO 58 HD3 PRO 25 -18.721 -20.899 -7.246 224 H ARG 59 H ARG 26 -19.045 -17.047 -8.057 225 HA ARG 59 HA ARG 26 -18.253 -14.844 -9.794 226 HB2 ARG 59 HB2 ARG 26 -20.592 -15.173 -8.970 227 HB3 ARG 59 HB3 ARG 26 -20.047 -14.804 -7.314 228 HG2 ARG 59 HG2 ARG 26 -19.368 -12.586 -7.983 229 HG3 ARG 59 HG3 ARG 26 -19.647 -12.965 -9.691 230 HD2 ARG 59 HD2 ARG 26 -22.075 -13.078 -9.258 231 HD3 ARG 59 HD3 ARG 26 -21.790 -12.666 -7.552 232 HE ARG 59 HE ARG 26 -20.471 -10.744 -9.221 233 HH11 ARG 59 HH11 ARG 26 -23.838 -11.563 -8.342 234 HH12 ARG 59 HH12 ARG 26 -24.390 -9.939 -8.550 235 HH21 ARG 59 HH21 ARG 26 -21.145 -8.751 -9.498 236 HH22 ARG 59 HH22 ARG 26 -22.805 -8.249 -9.231 237 H LEU 60 H LEU 27 -17.478 -15.881 -6.478 238 HA LEU 60 HA LEU 27 -16.191 -13.585 -5.574 239 HB2 LEU 60 HB2 LEU 27 -16.601 -15.624 -4.178 240 HB3 LEU 60 HB3 LEU 27 -15.362 -16.508 -5.044 241 HG LEU 60 HG LEU 27 -14.677 -15.765 -2.851 242 HD11 LEU 60 HD11 LEU 27 -13.008 -16.253 -4.645 243 HD12 LEU 60 HD12 LEU 27 -12.853 -14.492 -4.891 244 HD13 LEU 60 HD13 LEU 27 -12.461 -15.197 -3.330 245 HD21 LEU 60 HD21 LEU 27 -14.502 -12.938 -3.962 246 HD22 LEU 60 HD22 LEU 27 -15.853 -13.545 -2.974 247 HD23 LEU 60 HD23 LEU 27 -14.243 -13.497 -2.292 248 H GLN 61 H GLN 28 -14.780 -16.422 -7.320 249 HA GLN 61 HA GLN 28 -12.211 -15.433 -7.816 250 HB2 GLN 61 HB2 GLN 28 -14.053 -17.417 -9.125 251 HB3 GLN 61 HB3 GLN 28 -12.685 -16.874 -10.085 252 HG2 GLN 61 HG2 GLN 28 -12.176 -17.793 -7.241 253 HG3 GLN 61 HG3 GLN 28 -12.519 -18.995 -8.490 254 HE21 GLN 61 HE22 GLN 28 -10.596 -19.831 -9.423 255 HE22 GLN 61 HE21 GLN 28 -9.154 -18.885 -9.677 256 H GLY 62 H GLY 29 -15.138 -14.953 -9.899 257 HA2 GLY 62 HA2 GLY 29 -13.847 -13.526 -11.940 258 HA3 GLY 62 HA3 GLY 29 -15.561 -13.370 -11.508 259 H GLU 63 H GLU 30 -15.654 -12.166 -9.123 260 HA GLU 63 HA GLU 30 -15.137 -9.437 -9.845 261 HB2 GLU 63 HB2 GLU 30 -15.955 -10.722 -7.215 262 HB3 GLU 63 HB3 GLU 30 -16.066 -9.005 -7.549 263 HG2 GLU 63 HG2 GLU 30 -17.540 -11.057 -9.266 264 HG3 GLU 63 HG3 GLU 30 -18.168 -10.483 -7.737 265 H TYR 64 H TYR 31 -13.601 -11.699 -7.541 266 HA TYR 64 HA TYR 31 -11.654 -10.044 -6.344 267 HB2 TYR 64 HB2 TYR 31 -12.011 -12.268 -5.545 268 HB3 TYR 64 HB3 TYR 31 -11.708 -12.966 -7.135 269 HD1 TYR 64 HD2 TYR 31 -9.523 -13.308 -8.058 270 HD2 TYR 64 HD1 TYR 31 -10.064 -11.597 -4.136 271 HE1 TYR 64 HE2 TYR 31 -7.139 -13.645 -7.568 272 HE2 TYR 64 HE1 TYR 31 -7.672 -12.019 -3.622 273 HH TYR 64 HH TYR 31 -5.433 -13.425 -6.096 274 H ARG 65 H ARG 32 -11.422 -12.037 -9.364 275 HA ARG 65 HA ARG 32 -8.827 -11.090 -9.954 276 HB2 ARG 65 HB2 ARG 32 -9.867 -13.223 -10.703 277 HB3 ARG 65 HB3 ARG 32 -10.884 -12.335 -11.831 278 HG2 ARG 65 HG2 ARG 32 -7.956 -11.754 -12.112 279 HG3 ARG 65 HG3 ARG 32 -8.356 -13.438 -12.299 280 HD2 ARG 65 HD2 ARG 32 -8.459 -12.669 -14.472 281 HD3 ARG 65 HD3 ARG 32 -10.174 -12.664 -13.990 282 HE ARG 65 HE ARG 32 -9.081 -10.183 -13.343 283 HH11 ARG 65 HH12 ARG 32 -9.934 -12.001 -16.271 284 HH12 ARG 65 HH11 ARG 32 -10.151 -10.606 -17.262 285 HH21 ARG 65 HH21 ARG 32 -9.277 -8.300 -14.687 286 HH22 ARG 65 HH22 ARG 32 -9.796 -8.457 -16.325 287 H SER 66 H SER 33 -12.012 -9.682 -10.759 288 HA SER 66 HA SER 33 -11.025 -7.838 -12.689 289 HB2 SER 66 HB2 SER 33 -13.269 -7.444 -10.673 290 HB3 SER 66 HB3 SER 33 -12.961 -6.463 -12.104 291 HG SER 66 HG SER 33 -14.524 -8.026 -12.590 292 H LEU 67 H LEU 34 -11.068 -7.704 -9.050 293 HA LEU 67 HA LEU 34 -9.837 -5.062 -9.135 294 HB2 LEU 67 HB2 LEU 34 -11.275 -5.725 -7.258 295 HB3 LEU 67 HB3 LEU 34 -10.113 -6.965 -6.779 296 HG LEU 67 HG LEU 34 -8.404 -5.233 -6.321 297 HD11 LEU 67 HD11 LEU 34 -8.977 -3.456 -7.913 298 HD12 LEU 67 HD12 LEU 34 -10.561 -3.230 -7.135 299 HD13 LEU 67 HD13 LEU 34 -9.058 -2.810 -6.274 300 HD21 LEU 67 HD21 LEU 34 -9.952 -5.888 -4.535 301 HD22 LEU 67 HD22 LEU 34 -9.445 -4.207 -4.358 302 HD23 LEU 67 HD23 LEU 34 -11.060 -4.584 -4.989 303 H THR 68 H THR 35 -8.496 -8.386 -8.318 304 HA THR 68 HA THR 35 -5.909 -7.275 -7.651 305 HB THR 68 HB THR 35 -5.292 -9.765 -7.700 306 HG1 THR 68 HG1 THR 35 -7.147 -11.168 -7.897 307 HG21 THR 68 HG21 THR 35 -7.709 -8.999 -6.018 308 HG22 THR 68 HG22 THR 35 -6.550 -10.302 -5.685 309 HG23 THR 68 HG23 THR 35 -5.998 -8.644 -5.631 310 H GLY 69 H GLY 36 -7.342 -8.696 -10.608 311 HA2 GLY 69 HA2 GLY 36 -6.475 -8.881 -12.730 312 HA3 GLY 69 HA3 GLY 36 -4.982 -8.077 -12.222 313 H ASP 70 H ASP 37 -6.214 -10.805 -10.287 314 HA ASP 70 HA ASP 37 -4.524 -12.784 -11.656 315 HB2 ASP 70 HB2 ASP 37 -3.151 -11.664 -9.785 316 HB3 ASP 70 HB3 ASP 37 -4.325 -12.333 -8.643 317 H TRP 71 H TRP 38 -5.109 -14.994 -10.801 318 HA TRP 71 HA TRP 38 -7.953 -15.109 -9.934 319 HB2 TRP 71 HB2 TRP 38 -6.063 -17.305 -10.866 320 HB3 TRP 71 HB3 TRP 38 -7.764 -17.508 -10.454 321 HD1 TRP 71 HD1 TRP 38 -5.586 -16.890 -13.329 322 HE1 TRP 71 HE1 TRP 38 -6.893 -16.181 -15.410 323 HE3 TRP 71 HE3 TRP 38 -10.092 -15.849 -11.130 324 HZ2 TRP 71 HZ2 TRP 38 -9.538 -15.120 -16.012 325 HZ3 TRP 71 HZ3 TRP 38 -11.959 -14.945 -12.471 326 HH2 TRP 71 HH2 TRP 38 -11.738 -14.679 -14.935 327 H ILE 72 H ILE 39 -8.453 -16.554 -8.135 328 HA ILE 72 HA ILE 39 -7.125 -15.890 -5.799 329 HB ILE 72 HB ILE 39 -9.003 -18.132 -6.533 330 HG12 ILE 72 HG12 ILE 39 -9.764 -15.671 -6.450 331 HG13 ILE 72 HG13 ILE 39 -10.728 -16.863 -5.612 332 HG21 ILE 72 HG21 ILE 39 -7.894 -17.609 -3.743 333 HG22 ILE 72 HG22 ILE 39 -9.366 -18.548 -4.075 334 HG23 ILE 72 HG23 ILE 39 -7.816 -19.088 -4.714 335 HD11 ILE 72 HD11 ILE 39 -10.339 -14.676 -4.400 336 HD12 ILE 72 HD12 ILE 39 -10.010 -16.147 -3.479 337 HD13 ILE 72 HD13 ILE 39 -8.660 -15.186 -4.148 338 HA PRO 73 HA PRO 40 -3.696 -18.716 -6.225 339 HB2 PRO 73 HB2 PRO 40 -2.107 -17.968 -4.187 340 HB3 PRO 73 HB3 PRO 40 -2.549 -16.812 -5.466 341 HG2 PRO 73 HG2 PRO 40 -3.951 -17.171 -2.794 342 HG3 PRO 73 HG3 PRO 40 -3.258 -15.673 -3.494 343 HD2 PRO 73 HD2 PRO 40 -5.905 -16.346 -3.775 344 HD3 PRO 73 HD3 PRO 40 -4.998 -15.506 -5.071 345 H PHE 74 H PHE 41 -6.036 -20.092 -5.276 346 HA PHE 74 HA PHE 41 -5.825 -20.943 -2.534 347 HB2 PHE 74 HB2 PHE 41 -7.585 -22.473 -2.967 348 HB3 PHE 74 HB3 PHE 41 -7.991 -20.978 -3.747 349 HD1 PHE 74 HD2 PHE 41 -7.645 -20.832 -6.356 350 HD2 PHE 74 HD1 PHE 41 -7.516 -24.511 -4.116 351 HE1 PHE 74 HE2 PHE 41 -8.106 -22.108 -8.426 352 HE2 PHE 74 HE1 PHE 41 -8.033 -25.781 -6.187 353 HZ PHE 74 HZ PHE 41 -8.325 -24.585 -8.347 354 H LYS 75 H LYS 42 -5.206 -22.832 -5.528 355 HA LYS 75 HA LYS 42 -4.011 -24.999 -4.054 356 HB2 LYS 75 HB2 LYS 42 -5.257 -24.996 -6.297 357 HB3 LYS 75 HB3 LYS 42 -3.788 -24.341 -7.028 358 HG2 LYS 75 HG2 LYS 42 -2.539 -26.366 -6.312 359 HG3 LYS 75 HG3 LYS 42 -3.988 -26.978 -5.479 360 HD2 LYS 75 HD2 LYS 42 -5.186 -27.124 -7.618 361 HD3 LYS 75 HD3 LYS 42 -3.784 -26.441 -8.480 362 HE2 LYS 75 HE2 LYS 42 -2.397 -28.379 -7.752 363 HE3 LYS 75 HE3 LYS 42 -3.794 -29.064 -6.905 364 HZ1 LYS 75 HZ1 LYS 42 -3.495 -30.065 -9.083 365 HZ2 LYS 75 HZ2 LYS 42 -4.917 -29.261 -9.054 366 HZ3 LYS 75 HZ3 LYS 42 -3.624 -28.621 -9.835 367 H GLN 76 H GLN 43 -2.861 -22.051 -5.467 368 HA GLN 76 HA GLN 43 -0.089 -22.675 -5.761 369 HB2 GLN 76 HB2 GLN 43 -1.464 -19.954 -5.503 370 HB3 GLN 76 HB3 GLN 43 0.135 -20.284 -6.149 371 HG2 GLN 76 HG2 GLN 43 -1.014 -20.039 -8.100 372 HG3 GLN 76 HG3 GLN 43 -1.145 -21.776 -7.929 373 HE21 GLN 76 HE22 GLN 43 -2.944 -19.440 -9.215 374 HE22 GLN 76 HE21 GLN 43 -4.534 -19.796 -8.544 375 H LEU 77 H LEU 44 -2.038 -21.098 -3.162 376 HA LEU 77 HA LEU 44 0.240 -20.897 -1.318 377 HB2 LEU 77 HB2 LEU 44 -2.727 -20.481 -0.981 378 HB3 LEU 77 HB3 LEU 44 -1.544 -20.320 0.321 379 HG LEU 77 HG LEU 44 -1.512 -18.664 -2.227 380 HD11 LEU 77 HD11 LEU 44 -3.486 -18.193 -0.785 381 HD12 LEU 77 HD12 LEU 44 -2.388 -17.819 0.566 382 HD13 LEU 77 HD13 LEU 44 -2.385 -16.811 -0.902 383 HD21 LEU 77 HD21 LEU 44 0.733 -18.778 -1.276 384 HD22 LEU 77 HD22 LEU 44 0.044 -17.182 -0.996 385 HD23 LEU 77 HD23 LEU 44 0.107 -18.367 0.337 386 H GLY 78 H GLY 45 -2.279 -23.270 -2.088 387 HA2 GLY 78 HA2 GLY 45 -1.501 -25.565 -1.783 388 HA3 GLY 78 HA3 GLY 45 -0.926 -25.149 -0.174 389 H TYR 79 H TYR 46 -3.983 -23.729 -1.024 390 HA TYR 79 HA TYR 46 -5.452 -25.447 0.849 391 HB2 TYR 79 HB2 TYR 46 -6.383 -23.145 -0.922 392 HB3 TYR 79 HB3 TYR 46 -7.285 -23.898 0.384 393 HD1 TYR 79 HD2 TYR 46 -6.396 -23.745 2.769 394 HD2 TYR 79 HD1 TYR 46 -4.808 -21.394 -0.473 395 HE1 TYR 79 HE2 TYR 46 -5.312 -22.263 4.391 396 HE2 TYR 79 HE1 TYR 46 -3.731 -19.868 1.137 397 HH TYR 79 HH TYR 46 -3.333 -19.395 3.430 398 HA PRO 80 HA PRO 47 -6.384 -28.028 -2.582 399 HB2 PRO 80 HB2 PRO 47 -8.649 -29.429 -1.778 400 HB3 PRO 80 HB3 PRO 47 -7.013 -29.695 -1.088 401 HG2 PRO 80 HG2 PRO 47 -9.237 -27.902 -0.014 402 HG3 PRO 80 HG3 PRO 47 -8.304 -29.150 0.876 403 HD2 PRO 80 HD2 PRO 47 -7.548 -26.564 1.029 404 HD3 PRO 80 HD3 PRO 47 -6.308 -27.831 0.824 405 H THR 81 H THR 48 -9.048 -25.909 -1.465 406 HA THR 81 HA THR 48 -10.086 -25.775 -4.249 407 HB THR 81 HB THR 48 -12.370 -25.952 -3.108 408 HG1 THR 81 HG1 THR 48 -12.144 -27.057 -0.958 409 HG21 THR 81 HG21 THR 48 -12.451 -28.336 -2.938 410 HG22 THR 81 HG22 THR 48 -11.293 -27.963 -4.223 411 HG23 THR 81 HG23 THR 48 -10.715 -28.453 -2.611 412 H LEU 82 H LEU 49 -11.653 -23.978 -4.483 413 HA LEU 82 HA LEU 49 -10.708 -21.476 -3.448 414 HB2 LEU 82 HB2 LEU 49 -13.387 -22.327 -4.692 415 HB3 LEU 82 HB3 LEU 49 -13.043 -20.680 -4.221 416 HG LEU 82 HG LEU 49 -12.770 -20.865 -6.583 417 HD11 LEU 82 HD11 LEU 49 -10.485 -20.047 -6.876 418 HD12 LEU 82 HD12 LEU 49 -11.222 -19.360 -5.414 419 HD13 LEU 82 HD13 LEU 49 -10.016 -20.672 -5.302 420 HD21 LEU 82 HD21 LEU 49 -10.587 -22.946 -6.219 421 HD22 LEU 82 HD22 LEU 49 -12.258 -23.309 -6.732 422 HD23 LEU 82 HD23 LEU 49 -11.219 -22.289 -7.730 423 H GLU 83 H GLU 50 -13.383 -23.671 -2.413 424 HA GLU 83 HA GLU 50 -14.273 -21.879 -0.386 425 HB2 GLU 83 HB2 GLU 50 -15.520 -23.665 0.549 426 HB3 GLU 83 HB3 GLU 50 -15.618 -23.777 -1.205 427 HG2 GLU 83 HG2 GLU 50 -13.958 -25.619 -1.184 428 HG3 GLU 83 HG3 GLU 50 -13.837 -25.485 0.577 429 H ALA 84 H ALA 51 -11.768 -24.534 -0.256 430 HA ALA 84 HA ALA 51 -11.321 -24.272 2.526 431 HB1 ALA 84 HB1 ALA 51 -9.200 -25.424 2.091 432 HB2 ALA 84 HB2 ALA 51 -10.558 -26.177 1.228 433 HB3 ALA 84 HB3 ALA 51 -9.401 -25.148 0.347 434 H TYR 85 H TYR 52 -9.762 -22.540 -0.217 435 HA TYR 85 HA TYR 52 -7.964 -20.965 1.317 436 HB2 TYR 85 HB2 TYR 52 -7.770 -20.955 -1.048 437 HB3 TYR 85 HB3 TYR 52 -9.447 -20.465 -1.285 438 HD1 TYR 85 HD1 TYR 52 -6.167 -19.311 0.107 439 HD2 TYR 85 HD2 TYR 52 -10.031 -18.177 -1.437 440 HE1 TYR 85 HE1 TYR 52 -5.468 -16.942 0.192 441 HE2 TYR 85 HE2 TYR 52 -9.350 -15.800 -1.368 442 HH TYR 85 HH TYR 52 -6.153 -14.736 -0.089 443 H LEU 86 H LEU 53 -11.418 -20.295 0.402 444 HA LEU 86 HA LEU 53 -11.549 -17.850 1.854 445 HB2 LEU 86 HB2 LEU 53 -13.707 -19.785 0.934 446 HB3 LEU 86 HB3 LEU 53 -14.025 -18.171 1.579 447 HG LEU 86 HG LEU 53 -12.216 -18.485 -0.825 448 HD11 LEU 86 HD11 LEU 53 -14.266 -18.061 -2.229 449 HD12 LEU 86 HD12 LEU 53 -14.200 -19.662 -1.490 450 HD13 LEU 86 HD13 LEU 53 -15.244 -18.435 -0.775 451 HD21 LEU 86 HD21 LEU 53 -14.052 -16.228 0.090 452 HD22 LEU 86 HD22 LEU 53 -12.289 -16.295 0.364 453 HD23 LEU 86 HD23 LEU 53 -12.917 -16.214 -1.286 454 H ARG 87 H ARG 54 -12.288 -21.187 2.925 455 HA ARG 87 HA ARG 54 -13.286 -20.558 5.561 456 HB2 ARG 87 HB2 ARG 54 -11.640 -22.934 4.551 457 HB3 ARG 87 HB3 ARG 54 -11.990 -22.722 6.236 458 HG2 ARG 87 HG2 ARG 54 -13.495 -24.297 5.556 459 HG3 ARG 87 HG3 ARG 54 -14.445 -22.815 5.762 460 HD2 ARG 87 HD2 ARG 54 -14.602 -22.550 3.326 461 HD3 ARG 87 HD3 ARG 54 -13.288 -23.706 3.120 462 HE ARG 87 HE ARG 54 -14.746 -25.258 2.747 463 HH11 ARG 87 HH11 ARG 54 -16.216 -23.514 5.525 464 HH12 ARG 87 HH12 ARG 54 -17.630 -24.493 5.516 465 HH21 ARG 87 HH21 ARG 54 -16.666 -26.368 2.656 466 HH22 ARG 87 HH22 ARG 54 -17.846 -26.241 3.934 467 H SER 88 H SER 55 -9.978 -20.672 4.259 468 HA SER 88 HA SER 55 -8.743 -20.567 6.857 469 HB2 SER 88 HB2 SER 55 -7.549 -20.396 4.068 470 HB3 SER 88 HB3 SER 55 -6.677 -20.684 5.586 471 HG SER 88 HG SER 55 -8.549 -22.341 4.253 472 H VAL 89 H VAL 56 -10.311 -18.028 5.598 473 HA VAL 89 HA VAL 56 -8.322 -16.098 6.692 474 HB VAL 89 HB VAL 56 -8.202 -15.955 4.344 475 HG11 VAL 89 HG11 VAL 56 -10.071 -16.919 3.398 476 HG12 VAL 89 HG12 VAL 56 -11.215 -15.925 4.302 477 HG13 VAL 89 HG13 VAL 56 -10.270 -15.221 2.964 478 HG21 VAL 89 HG21 VAL 56 -8.558 -13.692 3.877 479 HG22 VAL 89 HG22 VAL 56 -9.879 -13.553 5.039 480 HG23 VAL 89 HG23 VAL 56 -8.208 -13.788 5.616 481 HA PRO 90 HA PRO 57 -12.756 -16.075 8.375 482 HB2 PRO 90 HB2 PRO 57 -12.572 -17.080 10.903 483 HB3 PRO 90 HB3 PRO 57 -12.652 -18.124 9.443 484 HG2 PRO 90 HG2 PRO 57 -10.182 -17.265 10.982 485 HG3 PRO 90 HG3 PRO 57 -10.641 -18.912 10.434 486 HD2 PRO 90 HD2 PRO 57 -8.922 -17.305 9.019 487 HD3 PRO 90 HD3 PRO 57 -10.037 -18.474 8.258 488 H ALA 91 H ALA 58 -9.713 -14.830 9.631 489 HA ALA 91 HA ALA 58 -10.947 -13.034 11.560 490 HB1 ALA 91 HB1 ALA 58 -8.647 -12.173 11.807 491 HB2 ALA 91 HB2 ALA 58 -8.653 -13.945 11.856 492 HB3 ALA 91 HB3 ALA 58 -8.127 -13.087 10.384 493 H VAL 92 H VAL 59 -10.800 -12.967 8.166 494 HA VAL 92 HA VAL 59 -11.033 -9.986 8.100 495 HB VAL 92 HB VAL 59 -9.526 -11.647 6.071 496 HG11 VAL 92 HG11 VAL 59 -9.482 -8.662 6.618 497 HG12 VAL 92 HG12 VAL 59 -8.583 -9.521 5.346 498 HG13 VAL 92 HG13 VAL 59 -10.351 -9.472 5.296 499 HG21 VAL 92 HG21 VAL 59 -8.320 -10.118 8.416 500 HG22 VAL 92 HG22 VAL 59 -8.191 -11.870 8.094 501 HG23 VAL 92 HG23 VAL 59 -7.405 -10.723 7.024 502 H VAL 93 H VAL 60 -12.110 -13.119 6.938 503 HA VAL 93 HA VAL 60 -14.180 -11.916 5.185 504 HB VAL 93 HB VAL 60 -12.093 -14.037 4.660 505 HG11 VAL 93 HG11 VAL 60 -14.518 -13.646 2.881 506 HG12 VAL 93 HG12 VAL 60 -13.060 -14.564 2.478 507 HG13 VAL 93 HG13 VAL 60 -14.084 -15.109 3.798 508 HG21 VAL 93 HG21 VAL 60 -11.741 -12.643 2.575 509 HG22 VAL 93 HG22 VAL 60 -12.851 -11.449 3.271 510 HG23 VAL 93 HG23 VAL 60 -11.330 -11.843 4.084 511 H ARG 94 H ARG 61 -15.869 -13.610 4.732 512 HA ARG 94 HA ARG 61 -16.382 -15.478 6.969 513 HB2 ARG 94 HB2 ARG 61 -17.256 -13.495 7.873 514 HB3 ARG 94 HB3 ARG 61 -17.898 -12.932 6.339 515 HG2 ARG 94 HG2 ARG 61 -19.735 -14.519 6.439 516 HG3 ARG 94 HG3 ARG 61 -19.015 -15.351 7.830 517 HD2 ARG 94 HD2 ARG 61 -20.908 -13.857 8.439 518 HD3 ARG 94 HD3 ARG 61 -19.387 -13.485 9.268 519 HE ARG 94 HE ARG 61 -19.847 -11.929 6.827 520 HH11 ARG 94 HH11 ARG 61 -20.928 -12.026 10.191 521 HH12 ARG 94 HH12 ARG 61 -20.829 -10.317 10.432 522 HH21 ARG 94 HH22 ARG 61 -19.338 -9.689 7.265 523 HH22 ARG 94 HH21 ARG 61 -20.077 -8.937 8.640 524 H ILE 95 H ILE 62 -18.124 -17.021 6.280 525 HA ILE 95 HA ILE 62 -19.010 -16.797 3.483 526 HB ILE 95 HB ILE 62 -18.305 -19.094 2.970 527 HG12 ILE 95 HG12 ILE 62 -16.734 -19.016 5.559 528 HG13 ILE 95 HG13 ILE 62 -18.099 -20.074 5.166 529 HG21 ILE 95 HG21 ILE 62 -16.872 -17.062 2.350 530 HG22 ILE 95 HG22 ILE 62 -15.810 -17.510 3.694 531 HG23 ILE 95 HG23 ILE 62 -16.073 -18.627 2.338 532 HD11 ILE 95 HD11 ILE 62 -16.729 -21.099 3.339 533 HD12 ILE 95 HD12 ILE 62 -15.335 -20.140 3.909 534 HD13 ILE 95 HD13 ILE 62 -16.086 -21.327 4.980 535 H GLU 96 H GLU 63 -20.847 -18.041 3.031 536 HA GLU 96 HA GLU 63 -22.088 -19.593 5.266 537 HB2 GLU 96 HB2 GLU 63 -23.335 -17.594 3.345 538 HB3 GLU 96 HB3 GLU 63 -24.290 -18.819 4.167 539 HG2 GLU 96 HG2 GLU 63 -22.563 -16.842 5.711 540 HG3 GLU 96 HG3 GLU 63 -24.200 -16.469 5.194 541 H ALA 97 H ALA 64 -21.488 -21.603 4.498 542 HA ALA 97 HA ALA 64 -21.911 -22.375 1.687 543 HB1 ALA 97 HB1 ALA 64 -21.329 -24.623 2.478 544 HB2 ALA 97 HB2 ALA 64 -20.098 -23.434 2.955 545 HB3 ALA 97 HB3 ALA 64 -21.270 -24.034 4.157 546 H SER 98 H SER 65 -23.874 -22.812 0.923 547 HA SER 98 HA SER 65 -26.220 -22.883 2.668 548 HB2 SER 98 HB2 SER 65 -26.246 -21.651 0.534 549 HB3 SER 98 HB3 SER 65 -25.875 -23.138 -0.359 550 HG SER 98 HG SER 65 -28.163 -22.528 -0.257 551 H ARG 99 H ARG 66 -27.693 -24.629 2.623 552 HA ARG 99 HA ARG 66 -26.589 -27.265 2.788 553 HB2 ARG 99 HB2 ARG 66 -28.709 -28.067 3.255 554 HB3 ARG 99 HB3 ARG 66 -28.679 -26.475 3.970 555 HG2 ARG 99 HG2 ARG 66 -30.083 -27.268 1.365 556 HG3 ARG 99 HG3 ARG 66 -30.828 -27.057 2.945 557 HD2 ARG 99 HD2 ARG 66 -29.979 -24.627 2.859 558 HD3 ARG 99 HD3 ARG 66 -29.719 -24.887 1.134 559 HE ARG 99 HE ARG 66 -32.237 -24.661 2.609 560 HH11 ARG 99 HH11 ARG 66 -30.823 -25.476 -0.589 561 HH12 ARG 99 HH12 ARG 66 -32.356 -25.564 -1.359 562 HH21 ARG 99 HH21 ARG 66 -34.233 -24.678 1.521 563 HH22 ARG 99 HH22 ARG 66 -34.320 -25.002 -0.175 564 H SER 100 H SER 67 -27.771 -25.436 0.041 565 HA SER 100 HA SER 67 -28.224 -27.625 -1.731 566 HB2 SER 100 HB2 SER 67 -27.349 -24.806 -2.429 567 HB3 SER 100 HB3 SER 67 -28.324 -25.914 -3.413 568 HG SER 100 HG SER 67 -29.601 -24.323 -2.344 569 H GLY 101 H GLY 68 -25.251 -26.408 -0.397 570 HA2 GLY 101 HA2 GLY 68 -23.192 -27.421 -0.717 571 HA3 GLY 101 HA3 GLY 68 -23.659 -27.991 -2.324 572 H GLU 102 H GLU 69 -24.654 -24.792 -2.261 573 HA GLU 102 HA GLU 69 -22.237 -23.802 -3.621 574 HB2 GLU 102 HB2 GLU 69 -24.925 -22.507 -2.954 575 HB3 GLU 102 HB3 GLU 69 -23.611 -21.717 -3.833 576 HG2 GLU 102 HG2 GLU 69 -23.746 -23.506 -5.582 577 HG3 GLU 102 HG3 GLU 69 -25.134 -24.201 -4.741 578 H ILE 103 H ILE 70 -21.375 -21.639 -2.759 579 HA ILE 103 HA ILE 70 -21.849 -21.150 0.079 580 HB ILE 103 HB ILE 70 -19.978 -22.512 0.355 581 HG12 ILE 103 HG12 ILE 70 -19.823 -20.136 1.365 582 HG13 ILE 103 HG13 ILE 70 -18.445 -21.222 1.448 583 HG21 ILE 103 HG21 ILE 70 -18.700 -21.309 -2.061 584 HG22 ILE 103 HG22 ILE 70 -17.822 -22.303 -0.869 585 HG23 ILE 103 HG23 ILE 70 -19.176 -22.996 -1.770 586 HD11 ILE 103 HD11 ILE 70 -17.196 -20.041 -0.172 587 HD12 ILE 103 HD12 ILE 70 -18.609 -19.173 -0.794 588 HD13 ILE 103 HD13 ILE 70 -17.965 -18.777 0.790 589 H VAL 104 H VAL 71 -21.830 -19.072 0.576 590 HA VAL 104 HA VAL 71 -21.335 -17.127 -1.628 591 HB VAL 104 HB VAL 71 -23.254 -16.871 0.738 592 HG11 VAL 104 HG11 VAL 71 -23.050 -15.374 -1.923 593 HG12 VAL 104 HG12 VAL 71 -24.251 -15.086 -0.649 594 HG13 VAL 104 HG13 VAL 71 -22.550 -14.757 -0.323 595 HG21 VAL 104 HG21 VAL 71 -25.107 -17.353 -0.875 596 HG22 VAL 104 HG22 VAL 71 -23.903 -17.849 -2.081 597 HG23 VAL 104 HG23 VAL 71 -24.108 -18.771 -0.577 598 H CYS 105 H CYS 72 -19.734 -15.701 -1.207 599 HA CYS 105 HA CYS 72 -18.340 -15.851 1.388 600 HB2 CYS 105 HB2 CYS 72 -17.490 -14.290 -1.079 601 HB3 CYS 105 HB3 CYS 72 -16.466 -14.971 0.204 602 HG CYS 105 HG CYS 72 -18.156 -16.413 -2.265 603 H TYR 106 H TYR 73 -17.794 -13.972 2.608 604 HA TYR 106 HA TYR 73 -19.050 -11.368 1.933 605 HB2 TYR 106 HB2 TYR 73 -19.423 -12.969 4.497 606 HB3 TYR 106 HB3 TYR 73 -19.876 -11.279 4.327 607 HD1 TYR 106 HD1 TYR 73 -21.583 -10.633 2.509 608 HD2 TYR 106 HD2 TYR 73 -20.905 -14.701 3.835 609 HE1 TYR 106 HE1 TYR 73 -23.876 -11.210 1.860 610 HE2 TYR 106 HE2 TYR 73 -23.165 -15.329 3.055 611 HH TYR 106 HH TYR 73 -25.219 -14.563 2.185 612 H ALA 107 H ALA 74 -18.282 -9.714 3.627 613 HA ALA 107 HA ALA 74 -15.372 -10.132 4.119 614 HB1 ALA 107 HB1 ALA 74 -17.151 -7.642 4.356 615 HB2 ALA 107 HB2 ALA 74 -15.379 -7.701 4.512 616 HB3 ALA 107 HB3 ALA 74 -16.143 -8.049 2.952 617 H VAL 108 H VAL 75 -14.516 -9.340 6.182 618 HA VAL 108 HA VAL 75 -16.495 -9.069 8.373 619 HB VAL 108 HB VAL 75 -14.791 -11.330 7.949 620 HG11 VAL 108 HG11 VAL 75 -13.781 -11.696 10.116 621 HG12 VAL 108 HG12 VAL 75 -13.082 -10.250 9.381 622 HG13 VAL 108 HG13 VAL 75 -14.289 -10.093 10.676 623 HG21 VAL 108 HG21 VAL 75 -16.687 -10.695 10.248 624 HG22 VAL 108 HG22 VAL 75 -17.172 -11.328 8.668 625 HG23 VAL 108 HG23 VAL 75 -16.145 -12.303 9.731 626 H ALA 109 H ALA 76 -13.161 -8.206 7.289 627 HA ALA 109 HA ALA 76 -13.243 -6.008 9.284 628 HB1 ALA 109 HB1 ALA 76 -11.026 -6.561 10.124 629 HB2 ALA 109 HB2 ALA 76 -12.142 -7.902 10.449 630 HB3 ALA 109 HB3 ALA 76 -10.955 -8.015 9.117 Start of MODEL 17 1 H1 GLY -2 H1 GLY -2 7.226 -6.059 -5.515 2 H2 GLY -2 H2 GLY -2 6.718 -6.532 -7.007 3 H3 GLY -2 H3 GLY -2 6.771 -4.938 -6.622 4 HA2 GLY -2 HA2 GLY -2 4.499 -5.720 -6.583 5 HA3 GLY -2 HA3 GLY -2 4.992 -6.953 -5.405 6 H HIS -1 H HIS -1 3.272 -4.213 -5.521 7 HA HIS -1 HA HIS -1 4.394 -2.549 -3.485 8 HB2 HIS -1 HB2 HIS -1 2.662 -1.868 -5.145 9 HB3 HIS -1 HB3 HIS -1 1.476 -2.878 -4.307 10 HD2 HIS -1 HD2 HIS -1 0.102 -1.653 -2.459 11 HE1 HIS -1 HE1 HIS -1 2.657 1.677 -1.721 12 HE2 HIS -1 HE2 HIS -1 0.424 0.599 -1.144 13 H MET 34 H MET 1 2.322 -5.395 -3.354 14 HA MET 34 HA MET 1 2.485 -5.422 -0.359 15 HB2 MET 34 HB2 MET 1 0.275 -6.357 -2.226 16 HB3 MET 34 HB3 MET 1 0.386 -6.841 -0.523 17 HG2 MET 34 HG2 MET 1 0.352 -4.453 0.105 18 HG3 MET 34 HG3 MET 1 0.104 -4.002 -1.581 19 HE1 MET 34 HE1 MET 1 -3.526 -5.551 -2.218 20 HE2 MET 34 HE2 MET 1 -2.732 -4.009 -2.638 21 HE3 MET 34 HE3 MET 1 -1.890 -5.548 -2.921 22 H LEU 35 H LEU 2 2.615 -7.606 0.542 23 HA LEU 35 HA LEU 2 4.427 -9.405 -0.928 24 HB2 LEU 35 HB2 LEU 2 3.018 -9.509 1.779 25 HB3 LEU 35 HB3 LEU 2 3.767 -10.935 1.078 26 HG LEU 35 HG LEU 2 5.956 -9.810 0.986 27 HD11 LEU 35 HD11 LEU 2 6.333 -7.738 2.313 28 HD12 LEU 35 HD12 LEU 2 5.375 -7.448 0.866 29 HD13 LEU 35 HD13 LEU 2 4.572 -7.521 2.453 30 HD21 LEU 35 HD21 LEU 2 6.372 -9.896 3.420 31 HD22 LEU 35 HD22 LEU 2 4.625 -9.785 3.733 32 HD23 LEU 35 HD23 LEU 2 5.300 -11.210 2.919 33 H GLU 36 H GLU 3 3.728 -11.676 -1.488 34 HA GLU 36 HA GLU 3 1.552 -11.504 -3.209 35 HB2 GLU 36 HB2 GLU 3 3.413 -13.094 -3.462 36 HB3 GLU 36 HB3 GLU 3 2.845 -14.009 -2.061 37 HG2 GLU 36 HG2 GLU 3 0.787 -14.625 -3.243 38 HG3 GLU 36 HG3 GLU 3 1.225 -13.593 -4.609 39 H ALA 37 H ALA 4 1.577 -13.014 0.008 40 HA ALA 37 HA ALA 4 -1.170 -13.928 -0.331 41 HB1 ALA 37 HB1 ALA 4 0.460 -13.818 2.235 42 HB2 ALA 37 HB2 ALA 4 -1.068 -14.694 1.964 43 HB3 ALA 37 HB3 ALA 4 0.396 -15.185 1.089 44 H ASP 38 H ASP 5 0.479 -11.237 1.312 45 HA ASP 38 HA ASP 5 -1.735 -10.096 2.669 46 HB2 ASP 38 HB2 ASP 5 0.665 -9.527 3.027 47 HB3 ASP 38 HB3 ASP 5 0.695 -8.726 1.450 48 H LEU 39 H LEU 6 -0.493 -9.635 -0.639 49 HA LEU 39 HA LEU 6 -2.179 -7.563 -1.501 50 HB2 LEU 39 HB2 LEU 6 -0.174 -8.423 -2.720 51 HB3 LEU 39 HB3 LEU 6 -1.009 -9.903 -3.107 52 HG LEU 39 HG LEU 6 -2.345 -7.343 -3.954 53 HD11 LEU 39 HD11 LEU 6 0.006 -6.933 -4.564 54 HD12 LEU 39 HD12 LEU 6 0.079 -8.511 -5.384 55 HD13 LEU 39 HD13 LEU 6 -0.972 -7.220 -6.005 56 HD21 LEU 39 HD21 LEU 6 -2.886 -8.643 -5.985 57 HD22 LEU 39 HD22 LEU 6 -2.008 -10.042 -5.326 58 HD23 LEU 39 HD23 LEU 6 -3.477 -9.429 -4.532 59 H VAL 40 H VAL 7 -2.543 -11.116 -1.962 60 HA VAL 40 HA VAL 7 -5.020 -10.691 -3.284 61 HB VAL 40 HB VAL 7 -5.220 -13.097 -3.357 62 HG11 VAL 40 HG11 VAL 7 -2.320 -12.235 -3.785 63 HG12 VAL 40 HG12 VAL 7 -3.169 -13.564 -4.578 64 HG13 VAL 40 HG13 VAL 7 -3.651 -11.903 -4.883 65 HG21 VAL 40 HG21 VAL 7 -2.818 -13.234 -1.508 66 HG22 VAL 40 HG22 VAL 7 -4.462 -13.703 -1.059 67 HG23 VAL 40 HG23 VAL 7 -3.602 -14.606 -2.294 68 H SER 41 H SER 8 -4.312 -11.537 0.148 69 HA SER 41 HA SER 8 -7.043 -11.841 0.867 70 HB2 SER 41 HB2 SER 8 -4.600 -11.062 2.511 71 HB3 SER 41 HB3 SER 8 -6.181 -11.520 3.183 72 HG SER 41 HG SER 8 -4.636 -13.297 2.972 73 H LYS 42 H LYS 9 -4.966 -8.839 0.822 74 HA LYS 42 HA LYS 9 -7.052 -7.168 1.942 75 HB2 LYS 42 HB2 LYS 9 -4.566 -6.640 0.278 76 HB3 LYS 42 HB3 LYS 9 -5.701 -5.337 0.668 77 HG2 LYS 42 HG2 LYS 9 -5.444 -5.632 3.033 78 HG3 LYS 42 HG3 LYS 9 -4.479 -7.115 2.820 79 HD2 LYS 42 HD2 LYS 9 -2.691 -5.950 1.809 80 HD3 LYS 42 HD3 LYS 9 -3.599 -4.406 1.743 81 HE2 LYS 42 HE2 LYS 9 -3.549 -4.192 4.128 82 HE3 LYS 42 HE3 LYS 9 -2.937 -5.847 4.330 83 HZ1 LYS 42 HZ1 LYS 9 -0.902 -5.196 3.241 84 HZ2 LYS 42 HZ2 LYS 9 -1.416 -3.633 3.072 85 HZ3 LYS 42 HZ3 LYS 9 -1.148 -4.259 4.566 86 H MET 43 H MET 10 -6.179 -8.006 -1.444 87 HA MET 43 HA MET 10 -8.149 -6.291 -2.602 88 HB2 MET 43 HB2 MET 10 -6.844 -8.827 -3.670 89 HB3 MET 43 HB3 MET 10 -7.799 -7.702 -4.632 90 HG2 MET 43 HG2 MET 10 -5.615 -6.371 -3.120 91 HG3 MET 43 HG3 MET 10 -5.052 -7.592 -4.238 92 HE1 MET 43 HE1 MET 10 -4.190 -4.458 -6.314 93 HE2 MET 43 HE2 MET 10 -4.058 -4.600 -4.552 94 HE3 MET 43 HE3 MET 10 -3.616 -5.979 -5.596 95 H LEU 44 H LEU 11 -8.239 -9.797 -1.770 96 HA LEU 44 HA LEU 11 -10.865 -10.482 -2.398 97 HB2 LEU 44 HB2 LEU 11 -9.260 -12.116 -1.572 98 HB3 LEU 44 HB3 LEU 11 -9.014 -11.229 -0.080 99 HG LEU 44 HG LEU 11 -11.355 -11.719 0.615 100 HD11 LEU 44 HD11 LEU 11 -11.233 -13.513 -1.864 101 HD12 LEU 44 HD12 LEU 11 -12.493 -13.605 -0.606 102 HD13 LEU 44 HD13 LEU 11 -12.341 -12.142 -1.600 103 HD21 LEU 44 HD21 LEU 11 -10.917 -14.087 1.168 104 HD22 LEU 44 HD22 LEU 11 -9.529 -14.062 0.066 105 HD23 LEU 44 HD23 LEU 11 -9.536 -13.019 1.497 106 H ARG 45 H ARG 12 -9.703 -9.221 0.752 107 HA ARG 45 HA ARG 12 -12.141 -8.792 2.058 108 HB2 ARG 45 HB2 ARG 12 -10.107 -8.604 3.233 109 HB3 ARG 45 HB3 ARG 12 -9.423 -7.487 2.088 110 HG2 ARG 45 HG2 ARG 12 -11.593 -6.011 3.117 111 HG3 ARG 45 HG3 ARG 12 -10.994 -6.888 4.507 112 HD2 ARG 45 HD2 ARG 12 -9.180 -5.289 2.623 113 HD3 ARG 45 HD3 ARG 12 -10.005 -4.596 4.030 114 HE ARG 45 HE ARG 12 -8.410 -6.990 4.607 115 HH11 ARG 45 HH11 ARG 12 -8.328 -3.438 4.400 116 HH12 ARG 45 HH12 ARG 12 -7.030 -3.255 5.521 117 HH21 ARG 45 HH21 ARG 12 -6.661 -6.749 6.106 118 HH22 ARG 45 HH22 ARG 12 -6.062 -5.186 6.498 119 H ALA 46 H ALA 13 -10.400 -6.443 -0.094 120 HA ALA 46 HA ALA 13 -12.348 -4.470 0.350 121 HB1 ALA 46 HB1 ALA 13 -11.284 -3.307 -1.579 122 HB2 ALA 46 HB2 ALA 13 -10.065 -4.002 -0.489 123 HB3 ALA 46 HB3 ALA 13 -10.458 -4.813 -2.026 124 H VAL 47 H VAL 14 -12.207 -6.943 -2.263 125 HA VAL 47 HA VAL 14 -14.483 -5.898 -3.680 126 HB VAL 47 HB VAL 14 -13.364 -8.734 -3.500 127 HG11 VAL 47 HG11 VAL 14 -15.317 -7.580 -5.530 128 HG12 VAL 47 HG12 VAL 14 -14.574 -9.205 -5.554 129 HG13 VAL 47 HG13 VAL 14 -15.720 -8.775 -4.285 130 HG21 VAL 47 HG21 VAL 14 -12.487 -8.089 -5.809 131 HG22 VAL 47 HG22 VAL 14 -12.998 -6.429 -5.483 132 HG23 VAL 47 HG23 VAL 14 -11.741 -7.204 -4.491 133 H LEU 48 H LEU 15 -14.182 -8.262 -0.982 134 HA LEU 48 HA LEU 15 -16.975 -8.907 -0.914 135 HB2 LEU 48 HB2 LEU 15 -14.862 -8.907 1.307 136 HB3 LEU 48 HB3 LEU 15 -16.437 -9.642 1.445 137 HG LEU 48 HG LEU 15 -14.572 -10.504 -0.799 138 HD11 LEU 48 HD11 LEU 15 -13.824 -12.292 0.786 139 HD12 LEU 48 HD12 LEU 15 -13.317 -10.652 1.262 140 HD13 LEU 48 HD13 LEU 15 -14.685 -11.438 2.087 141 HD21 LEU 48 HD21 LEU 15 -16.755 -11.959 0.748 142 HD22 LEU 48 HD22 LEU 15 -16.980 -11.234 -0.855 143 HD23 LEU 48 HD23 LEU 15 -15.839 -12.582 -0.628 144 H GLN 49 H GLN 16 -15.059 -6.372 0.782 145 HA GLN 49 HA GLN 16 -17.204 -5.414 2.426 146 HB2 GLN 49 HB2 GLN 16 -14.677 -4.092 1.352 147 HB3 GLN 49 HB3 GLN 16 -15.757 -3.292 2.482 148 HG2 GLN 49 HG2 GLN 16 -14.433 -5.978 3.087 149 HG3 GLN 49 HG3 GLN 16 -13.698 -4.430 3.456 150 HE21 GLN 49 HE22 GLN 16 -13.866 -5.905 5.586 151 HE22 GLN 49 HE21 GLN 16 -15.167 -5.416 6.646 152 H SER 50 H SER 17 -16.218 -4.674 -0.936 153 HA SER 50 HA SER 17 -18.102 -2.510 -1.310 154 HB2 SER 50 HB2 SER 17 -16.784 -4.356 -3.354 155 HB3 SER 50 HB3 SER 17 -17.585 -2.818 -3.682 156 HG SER 50 HG SER 17 -15.176 -3.261 -2.205 157 H HIS 51 H HIS 18 -18.283 -6.041 -1.563 158 HA HIS 51 HA HIS 18 -20.958 -5.894 -2.843 159 HB2 HIS 51 HB2 HIS 18 -18.851 -8.071 -2.797 160 HB3 HIS 51 HB3 HIS 18 -20.440 -8.197 -3.542 161 HD2 HIS 51 HD2 HIS 18 -18.857 -8.746 -5.728 162 HE1 HIS 51 HE1 HIS 18 -18.076 -4.685 -6.685 163 HE2 HIS 51 HE2 HIS 18 -18.022 -7.062 -7.579 164 H LYS 52 H LYS 19 -21.562 -5.326 -0.415 165 HA LYS 52 HA LYS 19 -21.493 -7.363 1.564 166 HB2 LYS 52 HB2 LYS 19 -23.355 -4.971 1.197 167 HB3 LYS 52 HB3 LYS 19 -23.400 -5.995 2.623 168 HG2 LYS 52 HG2 LYS 19 -20.977 -4.389 1.720 169 HG3 LYS 52 HG3 LYS 19 -22.119 -3.938 2.991 170 HD2 LYS 52 HD2 LYS 19 -21.496 -6.091 4.216 171 HD3 LYS 52 HD3 LYS 19 -20.255 -6.360 2.992 172 HE2 LYS 52 HE2 LYS 19 -19.143 -5.359 4.848 173 HE3 LYS 52 HE3 LYS 19 -19.227 -4.131 3.576 174 HZ1 LYS 52 HZ1 LYS 19 -21.063 -3.090 4.798 175 HZ2 LYS 52 HZ2 LYS 19 -21.048 -4.276 5.935 176 HZ3 LYS 52 HZ3 LYS 19 -19.782 -3.267 5.786 177 H ASN 53 H ASN 20 -23.667 -7.112 -1.165 178 HA ASN 53 HA ASN 20 -25.724 -8.851 -0.168 179 HB2 ASN 53 HB2 ASN 20 -25.908 -7.443 -2.235 180 HB3 ASN 53 HB3 ASN 20 -24.696 -8.463 -3.015 181 HD21 ASN 53 HD22 ASN 20 -27.938 -8.684 -1.373 182 HD22 ASN 53 HD21 ASN 20 -28.511 -9.990 -2.377 183 H GLY 54 H GLY 21 -22.408 -9.520 -0.814 184 HA2 GLY 54 HA2 GLY 21 -21.287 -11.452 -0.465 185 HA3 GLY 54 HA3 GLY 21 -22.776 -12.410 -0.475 186 H ILE 55 H ILE 22 -20.513 -13.244 -1.821 187 HA ILE 55 HA ILE 22 -21.432 -13.271 -4.643 188 HB ILE 55 HB ILE 22 -18.833 -13.186 -5.161 189 HG12 ILE 55 HG12 ILE 22 -18.916 -11.477 -2.613 190 HG13 ILE 55 HG13 ILE 22 -17.934 -12.904 -2.911 191 HG21 ILE 55 HG21 ILE 22 -19.044 -10.990 -5.912 192 HG22 ILE 55 HG22 ILE 22 -20.703 -11.596 -5.923 193 HG23 ILE 55 HG23 ILE 22 -20.174 -10.532 -4.602 194 HD11 ILE 55 HD11 ILE 22 -16.529 -10.953 -3.141 195 HD12 ILE 55 HD12 ILE 22 -16.809 -11.509 -4.799 196 HD13 ILE 55 HD13 ILE 22 -17.702 -10.125 -4.157 197 H VAL 56 H VAL 23 -21.675 -15.244 -5.292 198 HA VAL 56 HA VAL 23 -21.037 -17.527 -3.712 199 HB VAL 56 HB VAL 23 -21.689 -18.765 -5.792 200 HG11 VAL 56 HG11 VAL 23 -23.381 -18.142 -4.167 201 HG12 VAL 56 HG12 VAL 23 -23.585 -16.551 -4.924 202 HG13 VAL 56 HG13 VAL 23 -24.032 -18.026 -5.803 203 HG21 VAL 56 HG21 VAL 23 -22.581 -17.585 -7.735 204 HG22 VAL 56 HG22 VAL 23 -22.154 -16.013 -7.047 205 HG23 VAL 56 HG23 VAL 23 -20.885 -17.156 -7.514 206 H LEU 57 H LEU 24 -19.336 -19.131 -3.951 207 HA LEU 57 HA LEU 24 -16.903 -18.113 -4.269 208 HB2 LEU 57 HB2 LEU 24 -15.808 -20.104 -4.153 209 HB3 LEU 57 HB3 LEU 24 -17.242 -20.217 -3.196 210 HG LEU 57 HG LEU 24 -16.894 -21.422 -5.990 211 HD11 LEU 57 HD11 LEU 24 -16.732 -22.779 -3.267 212 HD12 LEU 57 HD12 LEU 24 -16.704 -23.598 -4.843 213 HD13 LEU 57 HD13 LEU 24 -15.393 -22.493 -4.384 214 HD21 LEU 57 HD21 LEU 24 -18.886 -22.721 -5.630 215 HD22 LEU 57 HD22 LEU 24 -19.057 -22.158 -3.962 216 HD23 LEU 57 HD23 LEU 24 -19.345 -21.052 -5.305 217 HA PRO 58 HA PRO 25 -15.973 -18.950 -8.851 218 HB2 PRO 58 HB2 PRO 25 -17.967 -18.934 -10.734 219 HB3 PRO 58 HB3 PRO 25 -17.408 -20.417 -9.901 220 HG2 PRO 58 HG2 PRO 25 -19.804 -18.686 -9.195 221 HG3 PRO 58 HG3 PRO 25 -19.741 -20.464 -9.419 222 HD2 PRO 58 HD2 PRO 25 -19.586 -19.389 -6.957 223 HD3 PRO 58 HD3 PRO 25 -18.573 -20.783 -7.415 224 H ARG 59 H ARG 26 -18.831 -16.967 -8.039 225 HA ARG 59 HA ARG 26 -18.100 -14.708 -9.730 226 HB2 ARG 59 HB2 ARG 26 -20.420 -15.296 -8.974 227 HB3 ARG 59 HB3 ARG 26 -19.966 -14.866 -7.316 228 HG2 ARG 59 HG2 ARG 26 -19.580 -12.567 -7.949 229 HG3 ARG 59 HG3 ARG 26 -19.813 -12.932 -9.664 230 HD2 ARG 59 HD2 ARG 26 -21.968 -13.305 -7.539 231 HD3 ARG 59 HD3 ARG 26 -21.784 -11.836 -8.521 232 HE ARG 59 HE ARG 26 -21.884 -13.998 -10.317 233 HH11 ARG 59 HH21 ARG 26 -24.087 -12.373 -8.037 234 HH12 ARG 59 HH22 ARG 26 -25.520 -12.882 -8.856 235 HH21 ARG 59 HH11 ARG 26 -23.796 -14.654 -11.412 236 HH22 ARG 59 HH12 ARG 26 -25.344 -14.173 -10.829 237 H LEU 60 H LEU 27 -17.412 -15.783 -6.405 238 HA LEU 60 HA LEU 27 -16.181 -13.445 -5.466 239 HB2 LEU 60 HB2 LEU 27 -16.689 -15.437 -4.064 240 HB3 LEU 60 HB3 LEU 27 -15.439 -16.369 -4.855 241 HG LEU 60 HG LEU 27 -14.879 -15.521 -2.607 242 HD11 LEU 60 HD11 LEU 27 -12.897 -14.586 -4.702 243 HD12 LEU 60 HD12 LEU 27 -12.576 -15.117 -3.055 244 HD13 LEU 60 HD13 LEU 27 -13.165 -16.282 -4.241 245 HD21 LEU 60 HD21 LEU 27 -14.459 -12.815 -3.944 246 HD22 LEU 60 HD22 LEU 27 -15.818 -13.238 -2.870 247 HD23 LEU 60 HD23 LEU 27 -14.179 -13.260 -2.249 248 H GLN 61 H GLN 28 -14.707 -16.281 -7.176 249 HA GLN 61 HA GLN 28 -12.142 -15.182 -7.619 250 HB2 GLN 61 HB2 GLN 28 -13.846 -17.274 -8.966 251 HB3 GLN 61 HB3 GLN 28 -12.471 -16.671 -9.872 252 HG2 GLN 61 HG2 GLN 28 -12.072 -17.598 -7.019 253 HG3 GLN 61 HG3 GLN 28 -12.264 -18.777 -8.312 254 HE21 GLN 61 HE22 GLN 28 -10.248 -19.524 -9.074 255 HE22 GLN 61 HE21 GLN 28 -8.821 -18.540 -9.209 256 H GLY 62 H GLY 29 -15.087 -14.885 -9.713 257 HA2 GLY 62 HA2 GLY 29 -13.896 -13.447 -11.793 258 HA3 GLY 62 HA3 GLY 29 -15.601 -13.331 -11.324 259 H GLU 63 H GLU 30 -15.675 -12.032 -8.947 260 HA GLU 63 HA GLU 30 -15.075 -9.332 -9.757 261 HB2 GLU 63 HB2 GLU 30 -16.085 -10.486 -7.124 262 HB3 GLU 63 HB3 GLU 30 -16.000 -8.760 -7.496 263 HG2 GLU 63 HG2 GLU 30 -17.655 -10.790 -9.055 264 HG3 GLU 63 HG3 GLU 30 -18.272 -9.684 -7.835 265 H TYR 64 H TYR 31 -13.552 -11.569 -7.421 266 HA TYR 64 HA TYR 31 -11.567 -9.897 -6.288 267 HB2 TYR 64 HB2 TYR 31 -11.808 -12.127 -5.467 268 HB3 TYR 64 HB3 TYR 31 -11.659 -12.814 -7.074 269 HD1 TYR 64 HD2 TYR 31 -9.538 -13.010 -8.266 270 HD2 TYR 64 HD1 TYR 31 -9.765 -11.556 -4.202 271 HE1 TYR 64 HE2 TYR 31 -7.123 -13.343 -8.016 272 HE2 TYR 64 HE1 TYR 31 -7.346 -11.996 -3.921 273 HH TYR 64 HH TYR 31 -5.317 -13.293 -6.632 274 H ARG 65 H ARG 32 -11.520 -11.814 -9.336 275 HA ARG 65 HA ARG 32 -8.965 -10.941 -10.128 276 HB2 ARG 65 HB2 ARG 32 -9.968 -12.952 -10.938 277 HB3 ARG 65 HB3 ARG 32 -11.261 -12.059 -11.768 278 HG2 ARG 65 HG2 ARG 32 -9.758 -11.111 -13.368 279 HG3 ARG 65 HG3 ARG 32 -8.344 -11.477 -12.373 280 HD2 ARG 65 HD2 ARG 32 -8.900 -13.927 -12.654 281 HD3 ARG 65 HD3 ARG 32 -10.052 -13.459 -13.913 282 HE ARG 65 HE ARG 32 -7.101 -13.147 -13.832 283 HH11 ARG 65 HH12 ARG 32 -10.044 -12.935 -15.812 284 HH12 ARG 65 HH11 ARG 32 -9.206 -12.795 -17.316 285 HH21 ARG 65 HH21 ARG 32 -5.970 -12.987 -15.854 286 HH22 ARG 65 HH22 ARG 32 -6.841 -12.839 -17.336 287 H SER 66 H SER 33 -12.226 -9.517 -10.836 288 HA SER 66 HA SER 33 -11.285 -7.597 -12.655 289 HB2 SER 66 HB2 SER 33 -13.497 -7.265 -10.574 290 HB3 SER 66 HB3 SER 33 -13.263 -6.275 -12.023 291 HG SER 66 HG SER 33 -14.806 -7.891 -12.441 292 H LEU 67 H LEU 34 -11.098 -7.614 -9.037 293 HA LEU 67 HA LEU 34 -9.981 -4.917 -9.044 294 HB2 LEU 67 HB2 LEU 34 -11.294 -5.837 -7.136 295 HB3 LEU 67 HB3 LEU 34 -9.969 -6.954 -6.794 296 HG LEU 67 HG LEU 34 -8.452 -4.981 -6.471 297 HD11 LEU 67 HD11 LEU 34 -9.546 -3.235 -7.764 298 HD12 LEU 67 HD12 LEU 34 -11.003 -3.345 -6.754 299 HD13 LEU 67 HD13 LEU 34 -9.479 -2.739 -6.074 300 HD21 LEU 67 HD21 LEU 34 -10.918 -4.879 -4.687 301 HD22 LEU 67 HD22 LEU 34 -9.608 -6.064 -4.548 302 HD23 LEU 67 HD23 LEU 34 -9.276 -4.354 -4.265 303 H THR 68 H THR 35 -8.507 -8.248 -8.551 304 HA THR 68 HA THR 35 -5.892 -7.112 -8.045 305 HB THR 68 HB THR 35 -5.233 -9.580 -8.326 306 HG1 THR 68 HG1 THR 35 -7.200 -10.967 -8.300 307 HG21 THR 68 HG21 THR 35 -6.177 -10.284 -6.265 308 HG22 THR 68 HG22 THR 35 -5.850 -8.557 -6.153 309 HG23 THR 68 HG23 THR 35 -7.536 -9.142 -6.409 310 H GLY 69 H GLY 36 -7.476 -8.558 -10.906 311 HA2 GLY 69 HA2 GLY 36 -6.789 -8.640 -13.114 312 HA3 GLY 69 HA3 GLY 36 -5.234 -7.887 -12.685 313 H ASP 70 H ASP 37 -6.449 -10.604 -10.729 314 HA ASP 70 HA ASP 37 -4.611 -12.546 -11.999 315 HB2 ASP 70 HB2 ASP 37 -3.473 -11.177 -10.105 316 HB3 ASP 70 HB3 ASP 37 -4.573 -12.000 -8.996 317 H TRP 71 H TRP 38 -4.907 -14.706 -10.788 318 HA TRP 71 HA TRP 38 -7.765 -15.180 -10.062 319 HB2 TRP 71 HB2 TRP 38 -5.534 -17.106 -10.844 320 HB3 TRP 71 HB3 TRP 38 -7.157 -17.574 -10.375 321 HD1 TRP 71 HD1 TRP 38 -5.155 -16.838 -13.344 322 HE1 TRP 71 HE1 TRP 38 -6.592 -16.677 -15.453 323 HE3 TRP 71 HE3 TRP 38 -9.735 -16.351 -11.124 324 HZ2 TRP 71 HZ2 TRP 38 -9.410 -16.319 -16.096 325 HZ3 TRP 71 HZ3 TRP 38 -11.751 -15.966 -12.502 326 HH2 TRP 71 HH2 TRP 38 -11.621 -15.992 -14.977 327 H ILE 72 H ILE 39 -8.137 -16.320 -8.041 328 HA ILE 72 HA ILE 39 -6.442 -15.659 -5.912 329 HB ILE 72 HB ILE 39 -8.778 -17.500 -6.271 330 HG12 ILE 72 HG12 ILE 39 -8.131 -15.152 -4.417 331 HG13 ILE 72 HG13 ILE 39 -8.909 -15.021 -5.994 332 HG21 ILE 72 HG21 ILE 39 -7.159 -17.461 -3.687 333 HG22 ILE 72 HG22 ILE 39 -8.776 -18.163 -3.901 334 HG23 ILE 72 HG23 ILE 39 -7.433 -18.844 -4.778 335 HD11 ILE 72 HD11 ILE 39 -10.102 -16.419 -3.605 336 HD12 ILE 72 HD12 ILE 39 -10.525 -14.828 -4.266 337 HD13 ILE 72 HD13 ILE 39 -10.831 -16.282 -5.245 338 HA PRO 73 HA PRO 40 -3.461 -18.931 -6.399 339 HB2 PRO 73 HB2 PRO 40 -1.666 -18.258 -4.463 340 HB3 PRO 73 HB3 PRO 40 -1.956 -17.222 -5.882 341 HG2 PRO 73 HG2 PRO 40 -3.238 -17.003 -3.147 342 HG3 PRO 73 HG3 PRO 40 -2.374 -15.724 -4.063 343 HD2 PRO 73 HD2 PRO 40 -5.103 -16.032 -4.100 344 HD3 PRO 73 HD3 PRO 40 -4.193 -15.474 -5.538 345 H PHE 74 H PHE 41 -5.819 -20.068 -5.350 346 HA PHE 74 HA PHE 41 -5.643 -20.729 -2.541 347 HB2 PHE 74 HB2 PHE 41 -7.467 -22.230 -2.890 348 HB3 PHE 74 HB3 PHE 41 -7.807 -20.712 -3.657 349 HD1 PHE 74 HD2 PHE 41 -7.579 -20.575 -6.276 350 HD2 PHE 74 HD1 PHE 41 -7.522 -24.274 -4.058 351 HE1 PHE 74 HE2 PHE 41 -8.101 -21.823 -8.341 352 HE2 PHE 74 HE1 PHE 41 -8.110 -25.517 -6.131 353 HZ PHE 74 HZ PHE 41 -8.392 -24.285 -8.278 354 H LYS 75 H LYS 42 -5.183 -22.853 -5.397 355 HA LYS 75 HA LYS 42 -4.092 -25.022 -3.889 356 HB2 LYS 75 HB2 LYS 42 -5.257 -25.016 -6.148 357 HB3 LYS 75 HB3 LYS 42 -3.780 -24.365 -6.858 358 HG2 LYS 75 HG2 LYS 42 -2.553 -26.408 -6.113 359 HG3 LYS 75 HG3 LYS 42 -4.033 -27.015 -5.343 360 HD2 LYS 75 HD2 LYS 42 -5.174 -27.026 -7.549 361 HD3 LYS 75 HD3 LYS 42 -3.692 -26.471 -8.333 362 HE2 LYS 75 HE2 LYS 42 -3.985 -29.085 -6.760 363 HE3 LYS 75 HE3 LYS 42 -4.159 -28.943 -8.516 364 HZ1 LYS 75 HZ1 LYS 42 -1.849 -28.189 -8.637 365 HZ2 LYS 75 HZ2 LYS 42 -1.664 -28.377 -7.019 366 HZ3 LYS 75 HZ3 LYS 42 -1.955 -29.671 -7.969 367 H GLN 76 H GLN 43 -2.749 -22.178 -5.330 368 HA GLN 76 HA GLN 43 -0.001 -22.973 -5.453 369 HB2 GLN 76 HB2 GLN 43 -1.231 -20.182 -5.514 370 HB3 GLN 76 HB3 GLN 43 0.351 -20.658 -6.092 371 HG2 GLN 76 HG2 GLN 43 -0.745 -20.530 -8.082 372 HG3 GLN 76 HG3 GLN 43 -1.001 -22.229 -7.754 373 HE21 GLN 76 HE22 GLN 43 -2.623 -19.847 -9.248 374 HE22 GLN 76 HE21 GLN 43 -4.239 -20.064 -8.585 375 H LEU 77 H LEU 44 -1.999 -21.117 -3.091 376 HA LEU 77 HA LEU 44 0.129 -20.753 -1.126 377 HB2 LEU 77 HB2 LEU 44 -2.879 -20.507 -1.021 378 HB3 LEU 77 HB3 LEU 44 -1.826 -20.264 0.370 379 HG LEU 77 HG LEU 44 -1.605 -18.623 -2.175 380 HD11 LEU 77 HD11 LEU 44 -3.010 -17.873 0.436 381 HD12 LEU 77 HD12 LEU 44 -2.783 -16.824 -0.954 382 HD13 LEU 77 HD13 LEU 44 -3.824 -18.252 -1.110 383 HD21 LEU 77 HD21 LEU 44 -0.352 -17.040 -0.746 384 HD22 LEU 77 HD22 LEU 44 -0.463 -18.180 0.614 385 HD23 LEU 77 HD23 LEU 44 0.461 -18.601 -0.848 386 H GLY 78 H GLY 45 -2.322 -23.231 -1.886 387 HA2 GLY 78 HA2 GLY 45 -1.532 -25.508 -1.469 388 HA3 GLY 78 HA3 GLY 45 -1.049 -25.023 0.150 389 H TYR 79 H TYR 46 -4.048 -23.582 -0.807 390 HA TYR 79 HA TYR 46 -5.592 -25.310 1.012 391 HB2 TYR 79 HB2 TYR 46 -6.500 -23.009 -0.759 392 HB3 TYR 79 HB3 TYR 46 -7.389 -23.751 0.571 393 HD1 TYR 79 HD2 TYR 46 -6.444 -23.596 2.941 394 HD2 TYR 79 HD1 TYR 46 -4.970 -21.226 -0.342 395 HE1 TYR 79 HE2 TYR 46 -5.337 -22.102 4.537 396 HE2 TYR 79 HE1 TYR 46 -3.850 -19.710 1.246 397 HH TYR 79 HH TYR 46 -3.986 -20.187 4.824 398 HA PRO 80 HA PRO 47 -6.449 -27.808 -2.536 399 HB2 PRO 80 HB2 PRO 47 -8.721 -29.244 -1.809 400 HB3 PRO 80 HB3 PRO 47 -7.104 -29.528 -1.109 401 HG2 PRO 80 HG2 PRO 47 -9.329 -27.775 0.005 402 HG3 PRO 80 HG3 PRO 47 -8.406 -29.051 0.861 403 HD2 PRO 80 HD2 PRO 47 -7.648 -26.473 1.109 404 HD3 PRO 80 HD3 PRO 47 -6.410 -27.738 0.868 405 H THR 81 H THR 48 -9.105 -25.692 -1.408 406 HA THR 81 HA THR 48 -10.136 -25.498 -4.188 407 HB THR 81 HB THR 48 -12.423 -25.658 -3.048 408 HG1 THR 81 HG1 THR 48 -12.206 -26.810 -0.921 409 HG21 THR 81 HG21 THR 48 -11.381 -27.665 -4.203 410 HG22 THR 81 HG22 THR 48 -10.807 -28.198 -2.610 411 HG23 THR 81 HG23 THR 48 -12.543 -28.041 -2.922 412 H LEU 82 H LEU 49 -11.654 -23.627 -4.401 413 HA LEU 82 HA LEU 49 -10.658 -21.206 -3.197 414 HB2 LEU 82 HB2 LEU 49 -13.299 -21.866 -4.615 415 HB3 LEU 82 HB3 LEU 49 -12.974 -20.289 -3.951 416 HG LEU 82 HG LEU 49 -12.580 -20.182 -6.273 417 HD11 LEU 82 HD11 LEU 49 -10.987 -18.915 -4.866 418 HD12 LEU 82 HD12 LEU 49 -9.846 -20.290 -4.924 419 HD13 LEU 82 HD13 LEU 49 -10.252 -19.428 -6.399 420 HD21 LEU 82 HD21 LEU 49 -11.007 -21.541 -7.521 421 HD22 LEU 82 HD22 LEU 49 -10.547 -22.435 -6.068 422 HD23 LEU 82 HD23 LEU 49 -12.197 -22.587 -6.724 423 H GLU 83 H GLU 50 -13.402 -23.395 -2.359 424 HA GLU 83 HA GLU 50 -14.330 -21.711 -0.272 425 HB2 GLU 83 HB2 GLU 50 -15.587 -23.527 0.573 426 HB3 GLU 83 HB3 GLU 50 -15.648 -23.577 -1.181 427 HG2 GLU 83 HG2 GLU 50 -14.052 -25.444 -1.211 428 HG3 GLU 83 HG3 GLU 50 -13.878 -25.359 0.545 429 H ALA 84 H ALA 51 -11.823 -24.352 -0.159 430 HA ALA 84 HA ALA 51 -11.380 -24.149 2.633 431 HB1 ALA 84 HB1 ALA 51 -9.244 -25.261 2.167 432 HB2 ALA 84 HB2 ALA 51 -10.586 -26.020 1.295 433 HB3 ALA 84 HB3 ALA 51 -9.462 -24.959 0.422 434 H TYR 85 H TYR 52 -9.827 -22.367 -0.076 435 HA TYR 85 HA TYR 52 -8.041 -20.811 1.491 436 HB2 TYR 85 HB2 TYR 52 -7.822 -20.831 -0.871 437 HB3 TYR 85 HB3 TYR 52 -9.489 -20.369 -1.131 438 HD1 TYR 85 HD1 TYR 52 -6.277 -19.114 0.321 439 HD2 TYR 85 HD2 TYR 52 -10.103 -18.109 -1.414 440 HE1 TYR 85 HE1 TYR 52 -5.588 -16.758 0.272 441 HE2 TYR 85 HE2 TYR 52 -9.431 -15.723 -1.482 442 HH TYR 85 HH TYR 52 -6.269 -14.567 -0.194 443 H LEU 86 H LEU 53 -11.496 -20.133 0.557 444 HA LEU 86 HA LEU 53 -11.646 -17.700 2.039 445 HB2 LEU 86 HB2 LEU 53 -13.776 -19.656 1.094 446 HB3 LEU 86 HB3 LEU 53 -14.123 -18.080 1.797 447 HG LEU 86 HG LEU 53 -12.282 -18.247 -0.605 448 HD11 LEU 86 HD11 LEU 53 -14.305 -17.872 -2.044 449 HD12 LEU 86 HD12 LEU 53 -14.198 -19.489 -1.355 450 HD13 LEU 86 HD13 LEU 53 -15.307 -18.331 -0.626 451 HD21 LEU 86 HD21 LEU 53 -14.229 -16.115 0.384 452 HD22 LEU 86 HD22 LEU 53 -12.465 -16.103 0.635 453 HD23 LEU 86 HD23 LEU 53 -13.121 -15.990 -1.001 454 H ARG 87 H ARG 54 -12.351 -21.056 3.039 455 HA ARG 87 HA ARG 54 -13.360 -20.487 5.685 456 HB2 ARG 87 HB2 ARG 54 -11.690 -22.844 4.663 457 HB3 ARG 87 HB3 ARG 54 -12.040 -22.652 6.354 458 HG2 ARG 87 HG2 ARG 54 -13.558 -24.225 5.653 459 HG3 ARG 87 HG3 ARG 54 -14.501 -22.745 5.858 460 HD2 ARG 87 HD2 ARG 54 -14.636 -22.458 3.433 461 HD3 ARG 87 HD3 ARG 54 -13.334 -23.619 3.226 462 HE ARG 87 HE ARG 54 -14.797 -25.153 2.820 463 HH11 ARG 87 HH11 ARG 54 -16.261 -23.470 5.629 464 HH12 ARG 87 HH12 ARG 54 -17.692 -24.427 5.573 465 HH21 ARG 87 HH21 ARG 54 -16.717 -26.239 2.682 466 HH22 ARG 87 HH22 ARG 54 -17.913 -26.129 3.947 467 H SER 88 H SER 55 -10.054 -20.497 4.397 468 HA SER 88 HA SER 55 -8.805 -20.428 6.987 469 HB2 SER 88 HB2 SER 55 -7.650 -20.138 4.198 470 HB3 SER 88 HB3 SER 55 -6.743 -20.438 5.692 471 HG SER 88 HG SER 55 -8.617 -22.127 4.377 472 H VAL 89 H VAL 56 -10.484 -17.918 5.828 473 HA VAL 89 HA VAL 56 -8.578 -15.949 6.998 474 HB VAL 89 HB VAL 56 -8.381 -15.725 4.642 475 HG11 VAL 89 HG11 VAL 56 -11.387 -15.805 4.518 476 HG12 VAL 89 HG12 VAL 56 -10.431 -15.020 3.236 477 HG13 VAL 89 HG13 VAL 56 -10.181 -16.722 3.613 478 HG21 VAL 89 HG21 VAL 56 -10.138 -13.391 5.387 479 HG22 VAL 89 HG22 VAL 56 -8.466 -13.594 5.957 480 HG23 VAL 89 HG23 VAL 56 -8.813 -13.459 4.225 481 HA PRO 90 HA PRO 57 -13.053 -16.113 8.559 482 HB2 PRO 90 HB2 PRO 57 -12.865 -17.115 11.083 483 HB3 PRO 90 HB3 PRO 57 -12.873 -18.155 9.622 484 HG2 PRO 90 HG2 PRO 57 -10.473 -17.194 11.210 485 HG3 PRO 90 HG3 PRO 57 -10.852 -18.857 10.636 486 HD2 PRO 90 HD2 PRO 57 -9.181 -17.153 9.276 487 HD3 PRO 90 HD3 PRO 57 -10.220 -18.362 8.471 488 H ALA 91 H ALA 58 -10.121 -14.702 9.902 489 HA ALA 91 HA ALA 58 -11.511 -12.988 11.799 490 HB1 ALA 91 HB1 ALA 58 -9.274 -12.034 12.163 491 HB2 ALA 91 HB2 ALA 58 -9.195 -13.804 12.168 492 HB3 ALA 91 HB3 ALA 58 -8.646 -12.890 10.738 493 H VAL 92 H VAL 59 -11.155 -12.831 8.409 494 HA VAL 92 HA VAL 59 -11.647 -9.867 8.413 495 HB VAL 92 HB VAL 59 -9.868 -11.422 6.490 496 HG11 VAL 92 HG11 VAL 59 -10.280 -8.418 6.744 497 HG12 VAL 92 HG12 VAL 59 -9.176 -9.250 5.627 498 HG13 VAL 92 HG13 VAL 59 -10.920 -9.435 5.433 499 HG21 VAL 92 HG21 VAL 59 -8.688 -11.269 8.616 500 HG22 VAL 92 HG22 VAL 59 -7.984 -10.122 7.487 501 HG23 VAL 92 HG23 VAL 59 -9.088 -9.541 8.753 502 H VAL 93 H VAL 60 -12.477 -13.066 7.181 503 HA VAL 93 HA VAL 60 -14.519 -11.935 5.345 504 HB VAL 93 HB VAL 60 -12.337 -13.976 4.898 505 HG11 VAL 93 HG11 VAL 60 -13.157 -14.431 2.637 506 HG12 VAL 93 HG12 VAL 60 -14.246 -15.036 3.872 507 HG13 VAL 93 HG13 VAL 60 -14.652 -13.547 2.992 508 HG21 VAL 93 HG21 VAL 60 -11.898 -12.494 2.864 509 HG22 VAL 93 HG22 VAL 60 -13.000 -11.311 3.626 510 HG23 VAL 93 HG23 VAL 60 -11.513 -11.804 4.433 511 H ARG 94 H ARG 61 -16.126 -13.650 4.818 512 HA ARG 94 HA ARG 61 -16.657 -15.614 6.968 513 HB2 ARG 94 HB2 ARG 61 -17.620 -13.783 8.001 514 HB3 ARG 94 HB3 ARG 61 -18.091 -12.991 6.491 515 HG2 ARG 94 HG2 ARG 61 -19.996 -14.513 6.244 516 HG3 ARG 94 HG3 ARG 61 -19.462 -15.464 7.629 517 HD2 ARG 94 HD2 ARG 61 -21.327 -13.934 8.192 518 HD3 ARG 94 HD3 ARG 61 -19.865 -13.642 9.147 519 HE ARG 94 HE ARG 61 -20.093 -11.958 6.757 520 HH11 ARG 94 HH21 ARG 61 -21.371 -12.203 10.046 521 HH12 ARG 94 HH22 ARG 61 -21.352 -10.498 10.339 522 HH21 ARG 94 HH11 ARG 61 -19.759 -9.733 7.252 523 HH22 ARG 94 HH12 ARG 61 -20.550 -9.039 8.635 524 H ILE 95 H ILE 62 -18.370 -17.122 6.257 525 HA ILE 95 HA ILE 62 -19.169 -16.893 3.436 526 HB ILE 95 HB ILE 62 -18.425 -19.220 2.988 527 HG12 ILE 95 HG12 ILE 62 -16.852 -18.974 5.576 528 HG13 ILE 95 HG13 ILE 62 -18.190 -20.087 5.252 529 HG21 ILE 95 HG21 ILE 62 -16.000 -17.512 3.676 530 HG22 ILE 95 HG22 ILE 62 -16.197 -18.697 2.361 531 HG23 ILE 95 HG23 ILE 62 -17.065 -17.167 2.299 532 HD11 ILE 95 HD11 ILE 62 -16.127 -21.282 5.115 533 HD12 ILE 95 HD12 ILE 62 -16.804 -21.171 3.472 534 HD13 ILE 95 HD13 ILE 62 -15.430 -20.142 3.965 535 H GLU 96 H GLU 63 -20.972 -18.165 2.919 536 HA GLU 96 HA GLU 63 -22.260 -19.716 5.129 537 HB2 GLU 96 HB2 GLU 63 -23.562 -17.825 3.130 538 HB3 GLU 96 HB3 GLU 63 -24.446 -18.970 4.125 539 HG2 GLU 96 HG2 GLU 63 -22.743 -16.649 5.135 540 HG3 GLU 96 HG3 GLU 63 -24.496 -16.675 5.038 541 H ALA 97 H ALA 64 -21.624 -21.704 4.410 542 HA ALA 97 HA ALA 64 -21.935 -22.544 1.606 543 HB1 ALA 97 HB1 ALA 64 -20.157 -23.554 2.955 544 HB2 ALA 97 HB2 ALA 64 -21.358 -24.130 4.142 545 HB3 ALA 97 HB3 ALA 64 -21.361 -24.764 2.481 546 H SER 98 H SER 65 -23.907 -22.930 0.812 547 HA SER 98 HA SER 65 -26.277 -23.129 2.497 548 HB2 SER 98 HB2 SER 65 -26.334 -21.932 0.347 549 HB3 SER 98 HB3 SER 65 -25.825 -23.397 -0.515 550 HG SER 98 HG SER 65 -28.171 -22.936 -0.461 551 H ARG 99 H ARG 66 -27.573 -24.975 2.595 552 HA ARG 99 HA ARG 66 -26.309 -27.563 2.647 553 HB2 ARG 99 HB2 ARG 66 -28.621 -28.463 2.937 554 HB3 ARG 99 HB3 ARG 66 -28.079 -27.313 4.132 555 HG2 ARG 99 HG2 ARG 66 -30.421 -27.032 3.609 556 HG3 ARG 99 HG3 ARG 66 -29.518 -25.564 3.232 557 HD2 ARG 99 HD2 ARG 66 -29.724 -25.914 0.882 558 HD3 ARG 99 HD3 ARG 66 -30.244 -27.605 1.100 559 HE ARG 99 HE ARG 66 -32.120 -26.051 2.449 560 HH11 ARG 99 HH11 ARG 66 -30.985 -26.121 -0.936 561 HH12 ARG 99 HH12 ARG 66 -32.562 -25.865 -1.595 562 HH21 ARG 99 HH21 ARG 66 -34.189 -25.624 1.554 563 HH22 ARG 99 HH22 ARG 66 -34.393 -25.480 -0.156 564 H SER 100 H SER 67 -27.640 -25.753 -0.008 565 HA SER 100 HA SER 67 -28.127 -27.978 -1.750 566 HB2 SER 100 HB2 SER 67 -27.392 -25.109 -2.441 567 HB3 SER 100 HB3 SER 67 -28.240 -26.267 -3.469 568 HG SER 100 HG SER 67 -29.643 -24.753 -2.375 569 H GLY 101 H GLY 68 -25.155 -26.866 -0.443 570 HA2 GLY 101 HA2 GLY 68 -23.038 -27.601 -0.868 571 HA3 GLY 101 HA3 GLY 68 -23.595 -28.479 -2.311 572 H GLU 102 H GLU 69 -24.007 -25.012 -1.510 573 HA GLU 102 HA GLU 69 -22.003 -24.203 -3.523 574 HB2 GLU 102 HB2 GLU 69 -24.783 -22.996 -3.131 575 HB3 GLU 102 HB3 GLU 69 -23.473 -22.244 -4.051 576 HG2 GLU 102 HG2 GLU 69 -23.428 -24.174 -5.600 577 HG3 GLU 102 HG3 GLU 69 -24.775 -24.911 -4.730 578 H ILE 103 H ILE 70 -21.303 -21.862 -2.857 579 HA ILE 103 HA ILE 70 -21.811 -21.274 -0.050 580 HB ILE 103 HB ILE 70 -19.984 -22.604 0.348 581 HG12 ILE 103 HG12 ILE 70 -19.878 -20.236 1.310 582 HG13 ILE 103 HG13 ILE 70 -18.501 -21.302 1.469 583 HG21 ILE 103 HG21 ILE 70 -17.787 -22.560 -0.712 584 HG22 ILE 103 HG22 ILE 70 -19.077 -23.122 -1.778 585 HG23 ILE 103 HG23 ILE 70 -18.428 -21.468 -1.944 586 HD11 ILE 103 HD11 ILE 70 -17.197 -20.134 -0.127 587 HD12 ILE 103 HD12 ILE 70 -18.593 -19.283 -0.810 588 HD13 ILE 103 HD13 ILE 70 -18.017 -18.858 0.788 589 H VAL 104 H VAL 71 -21.827 -19.223 0.443 590 HA VAL 104 HA VAL 71 -21.342 -17.234 -1.715 591 HB VAL 104 HB VAL 71 -23.167 -16.919 0.697 592 HG11 VAL 104 HG11 VAL 71 -23.110 -15.571 -2.054 593 HG12 VAL 104 HG12 VAL 71 -24.245 -15.209 -0.737 594 HG13 VAL 104 HG13 VAL 71 -22.526 -14.865 -0.520 595 HG21 VAL 104 HG21 VAL 71 -23.978 -18.073 -2.006 596 HG22 VAL 104 HG22 VAL 71 -24.102 -18.870 -0.426 597 HG23 VAL 104 HG23 VAL 71 -25.109 -17.467 -0.771 598 H CYS 105 H CYS 72 -19.933 -15.553 -1.192 599 HA CYS 105 HA CYS 72 -18.465 -15.833 1.381 600 HB2 CYS 105 HB2 CYS 72 -17.532 -14.339 -1.090 601 HB3 CYS 105 HB3 CYS 72 -16.552 -15.052 0.212 602 HG CYS 105 HG CYS 72 -18.301 -16.456 -2.242 603 H TYR 106 H TYR 73 -17.951 -13.983 2.610 604 HA TYR 106 HA TYR 73 -19.222 -11.376 1.924 605 HB2 TYR 106 HB2 TYR 73 -19.587 -13.033 4.461 606 HB3 TYR 106 HB3 TYR 73 -20.080 -11.354 4.302 607 HD1 TYR 106 HD1 TYR 73 -21.767 -10.691 2.533 608 HD2 TYR 106 HD2 TYR 73 -21.045 -14.793 3.703 609 HE1 TYR 106 HE1 TYR 73 -24.037 -11.276 1.798 610 HE2 TYR 106 HE2 TYR 73 -23.272 -15.429 2.865 611 HH TYR 106 HH TYR 73 -25.335 -14.657 1.976 612 H ALA 107 H ALA 74 -18.485 -9.698 3.527 613 HA ALA 107 HA ALA 74 -15.632 -10.083 4.265 614 HB1 ALA 107 HB1 ALA 74 -17.425 -7.614 4.463 615 HB2 ALA 107 HB2 ALA 74 -15.657 -7.703 4.665 616 HB3 ALA 107 HB3 ALA 74 -16.373 -7.994 3.082 617 H VAL 108 H VAL 75 -14.997 -9.385 6.442 618 HA VAL 108 HA VAL 75 -17.176 -9.335 8.486 619 HB VAL 108 HB VAL 75 -15.310 -11.456 8.061 620 HG11 VAL 108 HG11 VAL 75 -14.957 -10.347 10.862 621 HG12 VAL 108 HG12 VAL 75 -14.343 -11.877 10.218 622 HG13 VAL 108 HG13 VAL 75 -13.714 -10.349 9.595 623 HG21 VAL 108 HG21 VAL 75 -17.709 -11.611 8.703 624 HG22 VAL 108 HG22 VAL 75 -16.665 -12.568 9.778 625 HG23 VAL 108 HG23 VAL 75 -17.307 -11.001 10.320 626 H ALA 109 H ALA 76 -13.939 -8.198 7.589 627 HA ALA 109 HA ALA 76 -13.272 -7.049 10.074 628 HB1 ALA 109 HB1 ALA 76 -11.749 -5.583 8.834 629 HB2 ALA 109 HB2 ALA 76 -11.623 -7.255 8.277 630 HB3 ALA 109 HB3 ALA 76 -12.509 -6.042 7.304 Start of MODEL 18 1 H1 GLY -2 H1 GLY -2 3.632 -4.102 -7.737 2 H2 GLY -2 H2 GLY -2 4.371 -3.017 -6.758 3 H3 GLY -2 H3 GLY -2 4.785 -4.603 -6.679 4 HA2 GLY -2 HA2 GLY -2 2.150 -3.494 -5.950 5 HA3 GLY -2 HA3 GLY -2 2.607 -5.202 -5.855 6 H HIS -1 H HIS -1 2.133 -2.554 -3.940 7 HA HIS -1 HA HIS -1 4.497 -2.613 -2.279 8 HB2 HIS -1 HB2 HIS -1 1.711 -1.519 -1.756 9 HB3 HIS -1 HB3 HIS -1 3.109 -1.258 -0.712 10 HD2 HIS -1 HD2 HIS -1 1.338 0.345 -3.541 11 HE1 HIS -1 HE1 HIS -1 5.267 1.986 -3.748 12 HE2 HIS -1 HE2 HIS -1 2.865 2.211 -4.579 13 H MET 34 H MET 1 1.377 -4.264 -2.150 14 HA MET 34 HA MET 1 1.723 -5.354 0.514 15 HB2 MET 34 HB2 MET 1 -0.068 -6.190 -1.799 16 HB3 MET 34 HB3 MET 1 -0.154 -6.836 -0.160 17 HG2 MET 34 HG2 MET 1 -1.716 -5.278 0.186 18 HG3 MET 34 HG3 MET 1 -0.372 -4.152 0.325 19 HE1 MET 34 HE1 MET 1 -3.787 -4.589 -1.078 20 HE2 MET 34 HE2 MET 1 -3.745 -4.128 -2.790 21 HE3 MET 34 HE3 MET 1 -3.101 -5.688 -2.287 22 H LEU 35 H LEU 2 2.220 -7.542 1.052 23 HA LEU 35 HA LEU 2 4.119 -8.986 -0.694 24 HB2 LEU 35 HB2 LEU 2 2.847 -9.793 1.967 25 HB3 LEU 35 HB3 LEU 2 4.178 -10.613 1.162 26 HG LEU 35 HG LEU 2 4.259 -7.810 2.363 27 HD11 LEU 35 HD11 LEU 2 4.229 -9.627 4.022 28 HD12 LEU 35 HD12 LEU 2 5.612 -10.401 3.215 29 HD13 LEU 35 HD13 LEU 2 5.797 -8.808 3.987 30 HD21 LEU 35 HD21 LEU 2 6.464 -9.365 0.951 31 HD22 LEU 35 HD22 LEU 2 5.744 -7.820 0.437 32 HD23 LEU 35 HD23 LEU 2 6.704 -7.884 1.907 33 H GLU 36 H GLU 3 3.543 -11.426 -1.206 34 HA GLU 36 HA GLU 3 1.311 -11.320 -2.859 35 HB2 GLU 36 HB2 GLU 3 3.173 -12.883 -3.201 36 HB3 GLU 36 HB3 GLU 3 2.657 -13.838 -1.803 37 HG2 GLU 36 HG2 GLU 3 0.560 -14.432 -2.917 38 HG3 GLU 36 HG3 GLU 3 0.934 -13.347 -4.261 39 H ALA 37 H ALA 4 1.430 -13.190 0.189 40 HA ALA 37 HA ALA 4 -1.310 -13.939 -0.077 41 HB1 ALA 37 HB1 ALA 4 0.252 -15.236 1.303 42 HB2 ALA 37 HB2 ALA 4 0.341 -13.885 2.479 43 HB3 ALA 37 HB3 ALA 4 -1.187 -14.762 2.216 44 H ASP 38 H ASP 5 0.242 -11.176 1.494 45 HA ASP 38 HA ASP 5 -2.062 -10.176 2.902 46 HB2 ASP 38 HB2 ASP 5 0.240 -9.513 3.462 47 HB3 ASP 38 HB3 ASP 5 0.447 -8.791 1.865 48 H LEU 39 H LEU 6 -0.701 -9.550 -0.345 49 HA LEU 39 HA LEU 6 -2.403 -7.486 -1.202 50 HB2 LEU 39 HB2 LEU 6 -0.320 -8.263 -2.362 51 HB3 LEU 39 HB3 LEU 6 -1.101 -9.735 -2.843 52 HG LEU 39 HG LEU 6 -2.357 -7.115 -3.659 53 HD11 LEU 39 HD11 LEU 6 0.021 -8.401 -5.055 54 HD12 LEU 39 HD12 LEU 6 -0.943 -7.041 -5.674 55 HD13 LEU 39 HD13 LEU 6 0.022 -6.839 -4.205 56 HD21 LEU 39 HD21 LEU 6 -3.581 -9.161 -4.287 57 HD22 LEU 39 HD22 LEU 6 -2.936 -8.380 -5.717 58 HD23 LEU 39 HD23 LEU 6 -2.127 -9.819 -5.059 59 H VAL 40 H VAL 7 -2.614 -11.025 -1.826 60 HA VAL 40 HA VAL 7 -5.079 -10.696 -3.172 61 HB VAL 40 HB VAL 7 -5.203 -13.096 -3.260 62 HG11 VAL 40 HG11 VAL 7 -2.282 -12.281 -3.534 63 HG12 VAL 40 HG12 VAL 7 -3.152 -13.533 -4.422 64 HG13 VAL 40 HG13 VAL 7 -3.547 -11.836 -4.674 65 HG21 VAL 40 HG21 VAL 7 -3.587 -14.575 -2.141 66 HG22 VAL 40 HG22 VAL 7 -2.909 -13.185 -1.273 67 HG23 VAL 40 HG23 VAL 7 -4.561 -13.720 -0.944 68 H SER 41 H SER 8 -4.409 -11.449 0.265 69 HA SER 41 HA SER 8 -7.132 -11.897 0.983 70 HB2 SER 41 HB2 SER 8 -4.846 -10.885 2.720 71 HB3 SER 41 HB3 SER 8 -6.379 -11.590 3.288 72 HG SER 41 HG SER 8 -4.194 -12.811 1.992 73 H LYS 42 H LYS 9 -5.207 -8.777 1.094 74 HA LYS 42 HA LYS 9 -7.455 -7.288 2.206 75 HB2 LYS 42 HB2 LYS 9 -4.859 -6.511 0.815 76 HB3 LYS 42 HB3 LYS 9 -6.101 -5.308 1.201 77 HG2 LYS 42 HG2 LYS 9 -6.064 -5.926 3.579 78 HG3 LYS 42 HG3 LYS 9 -4.829 -7.169 3.248 79 HD2 LYS 42 HD2 LYS 9 -3.205 -5.505 2.609 80 HD3 LYS 42 HD3 LYS 9 -4.423 -4.221 2.603 81 HE2 LYS 42 HE2 LYS 9 -2.980 -4.069 4.574 82 HE3 LYS 42 HE3 LYS 9 -4.663 -4.328 5.026 83 HZ1 LYS 42 HZ1 LYS 9 -2.652 -6.520 4.905 84 HZ2 LYS 42 HZ2 LYS 9 -3.009 -5.686 6.276 85 HZ3 LYS 42 HZ3 LYS 9 -4.159 -6.598 5.558 86 H MET 43 H MET 10 -6.339 -7.950 -1.157 87 HA MET 43 HA MET 10 -8.247 -6.202 -2.401 88 HB2 MET 43 HB2 MET 10 -6.862 -8.722 -3.406 89 HB3 MET 43 HB3 MET 10 -7.784 -7.612 -4.417 90 HG2 MET 43 HG2 MET 10 -5.445 -6.589 -2.771 91 HG3 MET 43 HG3 MET 10 -5.188 -7.440 -4.279 92 HE1 MET 43 HE1 MET 10 -4.383 -4.232 -5.928 93 HE2 MET 43 HE2 MET 10 -3.715 -5.305 -4.677 94 HE3 MET 43 HE3 MET 10 -4.401 -5.995 -6.162 95 H LEU 44 H LEU 11 -8.323 -9.755 -1.778 96 HA LEU 44 HA LEU 11 -10.906 -10.435 -2.577 97 HB2 LEU 44 HB2 LEU 11 -9.273 -12.075 -1.736 98 HB3 LEU 44 HB3 LEU 11 -9.156 -11.240 -0.201 99 HG LEU 44 HG LEU 11 -11.570 -11.869 0.247 100 HD11 LEU 44 HD11 LEU 11 -12.412 -13.804 -0.994 101 HD12 LEU 44 HD12 LEU 11 -12.147 -12.446 -2.115 102 HD13 LEU 44 HD13 LEU 11 -10.976 -13.787 -2.040 103 HD21 LEU 44 HD21 LEU 11 -9.739 -12.955 1.395 104 HD22 LEU 44 HD22 LEU 11 -10.949 -14.172 0.932 105 HD23 LEU 44 HD23 LEU 11 -9.445 -14.002 0.005 106 H ARG 45 H ARG 12 -9.902 -9.337 0.662 107 HA ARG 45 HA ARG 12 -12.420 -9.007 1.847 108 HB2 ARG 45 HB2 ARG 12 -10.508 -9.037 3.149 109 HB3 ARG 45 HB3 ARG 12 -9.661 -7.832 2.209 110 HG2 ARG 45 HG2 ARG 12 -12.133 -6.973 3.683 111 HG3 ARG 45 HG3 ARG 12 -10.636 -7.273 4.557 112 HD2 ARG 45 HD2 ARG 12 -9.529 -5.683 2.749 113 HD3 ARG 45 HD3 ARG 12 -11.206 -5.100 2.558 114 HE ARG 45 HE ARG 12 -10.401 -5.427 5.307 115 HH11 ARG 45 HH11 ARG 12 -9.937 -3.042 2.689 116 HH12 ARG 45 HH12 ARG 12 -9.874 -1.708 3.788 117 HH21 ARG 45 HH21 ARG 12 -10.437 -3.786 6.648 118 HH22 ARG 45 HH22 ARG 12 -10.095 -2.134 6.167 119 H ALA 46 H ALA 13 -10.575 -6.565 -0.110 120 HA ALA 46 HA ALA 13 -12.488 -4.567 0.444 121 HB1 ALA 46 HB1 ALA 13 -10.595 -4.816 -1.956 122 HB2 ALA 46 HB2 ALA 13 -11.406 -3.327 -1.435 123 HB3 ALA 46 HB3 ALA 13 -10.191 -4.089 -0.382 124 H VAL 47 H VAL 14 -12.294 -6.899 -2.294 125 HA VAL 47 HA VAL 14 -14.544 -5.849 -3.722 126 HB VAL 47 HB VAL 14 -13.439 -8.693 -3.545 127 HG11 VAL 47 HG11 VAL 14 -14.626 -9.158 -5.616 128 HG12 VAL 47 HG12 VAL 14 -15.778 -8.734 -4.356 129 HG13 VAL 47 HG13 VAL 14 -15.368 -7.534 -5.596 130 HG21 VAL 47 HG21 VAL 14 -12.498 -8.079 -5.811 131 HG22 VAL 47 HG22 VAL 14 -13.044 -6.420 -5.548 132 HG23 VAL 47 HG23 VAL 14 -11.816 -7.141 -4.490 133 H LEU 48 H LEU 15 -14.255 -8.262 -1.084 134 HA LEU 48 HA LEU 15 -17.022 -8.918 -0.987 135 HB2 LEU 48 HB2 LEU 15 -14.830 -8.980 1.144 136 HB3 LEU 48 HB3 LEU 15 -16.408 -9.689 1.363 137 HG LEU 48 HG LEU 15 -14.683 -10.523 -0.998 138 HD11 LEU 48 HD11 LEU 15 -13.925 -12.399 0.462 139 HD12 LEU 48 HD12 LEU 15 -13.359 -10.812 1.025 140 HD13 LEU 48 HD13 LEU 15 -14.713 -11.604 1.843 141 HD21 LEU 48 HD21 LEU 15 -16.835 -11.937 0.610 142 HD22 LEU 48 HD22 LEU 15 -17.118 -11.165 -0.956 143 HD23 LEU 48 HD23 LEU 15 -16.023 -12.562 -0.824 144 H GLN 49 H GLN 16 -15.183 -6.278 0.650 145 HA GLN 49 HA GLN 16 -17.382 -5.494 2.323 146 HB2 GLN 49 HB2 GLN 16 -14.869 -4.044 1.386 147 HB3 GLN 49 HB3 GLN 16 -16.071 -3.271 2.415 148 HG2 GLN 49 HG2 GLN 16 -14.566 -5.809 3.167 149 HG3 GLN 49 HG3 GLN 16 -14.114 -4.184 3.652 150 HE21 GLN 49 HE22 GLN 16 -14.354 -5.656 5.780 151 HE22 GLN 49 HE21 GLN 16 -15.892 -5.430 6.602 152 H SER 50 H SER 17 -16.335 -4.422 -0.985 153 HA SER 50 HA SER 17 -18.398 -2.466 -1.291 154 HB2 SER 50 HB2 SER 17 -17.012 -4.210 -3.376 155 HB3 SER 50 HB3 SER 17 -17.942 -2.734 -3.698 156 HG SER 50 HG SER 17 -15.695 -2.274 -3.577 157 H HIS 51 H HIS 18 -18.326 -5.995 -1.821 158 HA HIS 51 HA HIS 18 -21.014 -5.952 -3.010 159 HB2 HIS 51 HB2 HIS 18 -18.882 -8.097 -2.835 160 HB3 HIS 51 HB3 HIS 18 -20.458 -8.282 -3.609 161 HD2 HIS 51 HD2 HIS 18 -18.773 -8.826 -5.761 162 HE1 HIS 51 HE1 HIS 18 -18.160 -4.756 -6.786 163 HE2 HIS 51 HE2 HIS 18 -17.990 -7.138 -7.631 164 H LYS 52 H LYS 19 -21.718 -5.279 -0.673 165 HA LYS 52 HA LYS 19 -21.693 -7.080 1.484 166 HB2 LYS 52 HB2 LYS 19 -23.766 -4.970 0.708 167 HB3 LYS 52 HB3 LYS 19 -23.769 -5.812 2.253 168 HG2 LYS 52 HG2 LYS 19 -21.515 -4.026 1.241 169 HG3 LYS 52 HG3 LYS 19 -22.766 -3.592 2.404 170 HD2 LYS 52 HD2 LYS 19 -21.918 -5.567 3.850 171 HD3 LYS 52 HD3 LYS 19 -20.517 -5.622 2.760 172 HE2 LYS 52 HE2 LYS 19 -20.079 -3.183 3.207 173 HE3 LYS 52 HE3 LYS 19 -21.485 -3.139 4.278 174 HZ1 LYS 52 HZ1 LYS 19 -19.574 -3.350 5.615 175 HZ2 LYS 52 HZ2 LYS 19 -20.309 -4.801 5.698 176 HZ3 LYS 52 HZ3 LYS 19 -18.948 -4.594 4.777 177 H ASN 53 H ASN 20 -23.776 -7.226 -1.350 178 HA ASN 53 HA ASN 20 -25.756 -8.988 -0.243 179 HB2 ASN 53 HB2 ASN 20 -26.003 -7.685 -2.373 180 HB3 ASN 53 HB3 ASN 20 -24.764 -8.706 -3.126 181 HD21 ASN 53 HD22 ASN 20 -27.976 -8.977 -1.408 182 HD22 ASN 53 HD21 ASN 20 -28.517 -10.336 -2.357 183 H GLY 54 H GLY 21 -22.418 -9.561 -0.839 184 HA2 GLY 54 HA2 GLY 21 -21.217 -11.445 -0.486 185 HA3 GLY 54 HA3 GLY 21 -22.673 -12.449 -0.446 186 H ILE 55 H ILE 22 -20.499 -13.303 -1.834 187 HA ILE 55 HA ILE 22 -21.447 -13.316 -4.646 188 HB ILE 55 HB ILE 22 -18.858 -13.239 -5.204 189 HG12 ILE 55 HG12 ILE 22 -18.904 -11.550 -2.647 190 HG13 ILE 55 HG13 ILE 22 -17.927 -12.969 -2.973 191 HG21 ILE 55 HG21 ILE 22 -19.054 -11.061 -5.956 192 HG22 ILE 55 HG22 ILE 22 -20.724 -11.630 -5.934 193 HG23 ILE 55 HG23 ILE 22 -20.164 -10.576 -4.627 194 HD11 ILE 55 HD11 ILE 22 -16.826 -11.545 -4.854 195 HD12 ILE 55 HD12 ILE 22 -17.720 -10.171 -4.181 196 HD13 ILE 55 HD13 ILE 22 -16.526 -11.002 -3.199 197 H VAL 56 H VAL 23 -21.682 -15.292 -5.294 198 HA VAL 56 HA VAL 23 -21.064 -17.568 -3.707 199 HB VAL 56 HB VAL 23 -21.665 -18.814 -5.789 200 HG11 VAL 56 HG11 VAL 23 -23.594 -16.608 -4.962 201 HG12 VAL 56 HG12 VAL 23 -24.020 -18.086 -5.847 202 HG13 VAL 56 HG13 VAL 23 -23.387 -18.201 -4.198 203 HG21 VAL 56 HG21 VAL 23 -22.543 -17.658 -7.749 204 HG22 VAL 56 HG22 VAL 23 -22.123 -16.077 -7.075 205 HG23 VAL 56 HG23 VAL 23 -20.850 -17.231 -7.519 206 H LEU 57 H LEU 24 -19.347 -19.154 -3.910 207 HA LEU 57 HA LEU 24 -16.913 -18.137 -4.210 208 HB2 LEU 57 HB2 LEU 24 -15.833 -20.148 -4.083 209 HB3 LEU 57 HB3 LEU 24 -17.262 -20.219 -3.112 210 HG LEU 57 HG LEU 24 -16.959 -21.470 -5.895 211 HD11 LEU 57 HD11 LEU 24 -16.745 -23.624 -4.737 212 HD12 LEU 57 HD12 LEU 24 -15.451 -22.521 -4.273 213 HD13 LEU 57 HD13 LEU 24 -16.805 -22.801 -3.162 214 HD21 LEU 57 HD21 LEU 24 -18.959 -22.777 -5.418 215 HD22 LEU 57 HD22 LEU 24 -19.105 -22.073 -3.803 216 HD23 LEU 57 HD23 LEU 24 -19.390 -21.079 -5.221 217 HA PRO 58 HA PRO 25 -15.939 -19.014 -8.743 218 HB2 PRO 58 HB2 PRO 25 -17.888 -19.019 -10.662 219 HB3 PRO 58 HB3 PRO 25 -17.322 -20.495 -9.828 220 HG2 PRO 58 HG2 PRO 25 -19.772 -18.834 -9.190 221 HG3 PRO 58 HG3 PRO 25 -19.645 -20.605 -9.363 222 HD2 PRO 58 HD2 PRO 25 -19.580 -19.429 -6.921 223 HD3 PRO 58 HD3 PRO 25 -18.559 -20.843 -7.314 224 H ARG 59 H ARG 26 -18.863 -17.039 -8.099 225 HA ARG 59 HA ARG 26 -18.111 -14.776 -9.736 226 HB2 ARG 59 HB2 ARG 26 -20.429 -15.332 -8.920 227 HB3 ARG 59 HB3 ARG 26 -19.923 -14.893 -7.274 228 HG2 ARG 59 HG2 ARG 26 -19.472 -12.586 -8.041 229 HG3 ARG 59 HG3 ARG 26 -19.893 -13.060 -9.699 230 HD2 ARG 59 HD2 ARG 26 -22.202 -13.548 -8.971 231 HD3 ARG 59 HD3 ARG 26 -21.787 -13.065 -7.307 232 HE ARG 59 HE ARG 26 -21.075 -10.961 -9.078 233 HH11 ARG 59 HH11 ARG 26 -24.060 -12.522 -7.906 234 HH12 ARG 59 HH12 ARG 26 -25.003 -11.081 -7.988 235 HH21 ARG 59 HH21 ARG 26 -22.353 -9.055 -9.225 236 HH22 ARG 59 HH22 ARG 26 -24.019 -9.082 -8.784 237 H LEU 60 H LEU 27 -17.391 -15.839 -6.416 238 HA LEU 60 HA LEU 27 -16.174 -13.492 -5.484 239 HB2 LEU 60 HB2 LEU 27 -16.702 -15.458 -4.068 240 HB3 LEU 60 HB3 LEU 27 -15.460 -16.423 -4.837 241 HG LEU 60 HG LEU 27 -14.919 -15.540 -2.587 242 HD11 LEU 60 HD11 LEU 27 -13.230 -16.408 -4.228 243 HD12 LEU 60 HD12 LEU 27 -12.882 -14.712 -4.667 244 HD13 LEU 60 HD13 LEU 27 -12.617 -15.284 -3.020 245 HD21 LEU 60 HD21 LEU 27 -14.338 -12.887 -3.965 246 HD22 LEU 60 HD22 LEU 27 -15.795 -13.228 -3.000 247 HD23 LEU 60 HD23 LEU 27 -14.227 -13.294 -2.237 248 H GLN 61 H GLN 28 -14.653 -16.311 -7.244 249 HA GLN 61 HA GLN 28 -12.105 -15.064 -7.567 250 HB2 GLN 61 HB2 GLN 28 -13.556 -17.222 -9.133 251 HB3 GLN 61 HB3 GLN 28 -12.049 -16.534 -9.725 252 HG2 GLN 61 HG2 GLN 28 -10.959 -17.131 -7.536 253 HG3 GLN 61 HG3 GLN 28 -12.424 -18.021 -7.112 254 HE21 GLN 61 HE22 GLN 28 -9.319 -18.321 -8.733 255 HE22 GLN 61 HE21 GLN 28 -9.689 -19.758 -9.619 256 H GLY 62 H GLY 29 -15.048 -14.921 -9.665 257 HA2 GLY 62 HA2 GLY 29 -13.943 -13.518 -11.807 258 HA3 GLY 62 HA3 GLY 29 -15.633 -13.396 -11.281 259 H GLU 63 H GLU 30 -15.677 -12.059 -8.979 260 HA GLU 63 HA GLU 30 -15.087 -9.372 -9.823 261 HB2 GLU 63 HB2 GLU 30 -16.056 -10.512 -7.162 262 HB3 GLU 63 HB3 GLU 30 -15.997 -8.789 -7.560 263 HG2 GLU 63 HG2 GLU 30 -17.643 -10.870 -9.068 264 HG3 GLU 63 HG3 GLU 30 -18.259 -9.753 -7.865 265 H TYR 64 H TYR 31 -13.522 -11.599 -7.501 266 HA TYR 64 HA TYR 31 -11.546 -9.886 -6.419 267 HB2 TYR 64 HB2 TYR 31 -11.795 -12.112 -5.585 268 HB3 TYR 64 HB3 TYR 31 -11.582 -12.819 -7.176 269 HD1 TYR 64 HD2 TYR 31 -9.386 -12.950 -8.294 270 HD2 TYR 64 HD1 TYR 31 -9.824 -11.529 -4.240 271 HE1 TYR 64 HE2 TYR 31 -6.977 -13.279 -7.903 272 HE2 TYR 64 HE1 TYR 31 -7.411 -11.906 -3.849 273 HH TYR 64 HH TYR 31 -5.224 -13.086 -6.480 274 H ARG 65 H ARG 32 -11.487 -11.842 -9.456 275 HA ARG 65 HA ARG 32 -8.921 -10.897 -10.205 276 HB2 ARG 65 HB2 ARG 32 -9.972 -13.028 -10.869 277 HB3 ARG 65 HB3 ARG 32 -11.078 -12.173 -11.940 278 HG2 ARG 65 HG2 ARG 32 -8.168 -11.584 -12.393 279 HG3 ARG 65 HG3 ARG 32 -8.609 -13.257 -12.596 280 HD2 ARG 65 HD2 ARG 32 -8.816 -12.429 -14.735 281 HD3 ARG 65 HD3 ARG 32 -10.505 -12.408 -14.163 282 HE ARG 65 HE ARG 32 -9.276 -9.977 -13.515 283 HH11 ARG 65 HH11 ARG 32 -10.475 -11.667 -16.407 284 HH12 ARG 65 HH12 ARG 32 -10.731 -10.226 -17.323 285 HH21 ARG 65 HH21 ARG 32 -9.553 -8.044 -14.764 286 HH22 ARG 65 HH22 ARG 32 -10.225 -8.114 -16.352 287 H SER 66 H SER 33 -12.192 -9.555 -10.868 288 HA SER 66 HA SER 33 -11.340 -7.653 -12.797 289 HB2 SER 66 HB2 SER 33 -13.458 -7.283 -10.637 290 HB3 SER 66 HB3 SER 33 -13.278 -6.347 -12.128 291 HG SER 66 HG SER 33 -14.846 -7.954 -12.456 292 H LEU 67 H LEU 34 -11.146 -7.607 -9.171 293 HA LEU 67 HA LEU 34 -10.019 -4.915 -9.220 294 HB2 LEU 67 HB2 LEU 34 -11.312 -5.715 -7.293 295 HB3 LEU 67 HB3 LEU 34 -10.106 -6.975 -6.986 296 HG LEU 67 HG LEU 34 -8.383 -5.239 -6.547 297 HD11 LEU 67 HD11 LEU 34 -9.168 -3.361 -7.911 298 HD12 LEU 67 HD12 LEU 34 -10.658 -3.239 -6.943 299 HD13 LEU 67 HD13 LEU 34 -9.073 -2.862 -6.226 300 HD21 LEU 67 HD21 LEU 34 -10.930 -4.822 -4.919 301 HD22 LEU 67 HD22 LEU 34 -9.739 -6.128 -4.693 302 HD23 LEU 67 HD23 LEU 34 -9.268 -4.454 -4.401 303 H THR 68 H THR 35 -8.553 -8.207 -8.563 304 HA THR 68 HA THR 35 -5.962 -7.052 -8.044 305 HB THR 68 HB THR 35 -5.317 -9.522 -8.064 306 HG1 THR 68 HG1 THR 35 -7.227 -10.931 -8.178 307 HG21 THR 68 HG21 THR 35 -7.816 -8.993 -6.404 308 HG22 THR 68 HG22 THR 35 -6.395 -9.985 -6.001 309 HG23 THR 68 HG23 THR 35 -6.234 -8.234 -6.074 310 H GLY 69 H GLY 36 -7.510 -8.536 -10.904 311 HA2 GLY 69 HA2 GLY 36 -6.744 -8.734 -13.085 312 HA3 GLY 69 HA3 GLY 36 -5.218 -7.944 -12.641 313 H ASP 70 H ASP 37 -6.404 -10.640 -10.616 314 HA ASP 70 HA ASP 37 -4.667 -12.610 -11.955 315 HB2 ASP 70 HB2 ASP 37 -3.390 -11.348 -10.055 316 HB3 ASP 70 HB3 ASP 37 -4.514 -12.129 -8.931 317 H TRP 71 H TRP 38 -5.098 -14.820 -10.907 318 HA TRP 71 HA TRP 38 -7.920 -15.040 -9.983 319 HB2 TRP 71 HB2 TRP 38 -6.035 -17.195 -11.026 320 HB3 TRP 71 HB3 TRP 38 -7.713 -17.423 -10.553 321 HD1 TRP 71 HD1 TRP 38 -5.647 -16.775 -13.494 322 HE1 TRP 71 HE1 TRP 38 -7.014 -16.051 -15.529 323 HE3 TRP 71 HE3 TRP 38 -10.080 -15.769 -11.144 324 HZ2 TRP 71 HZ2 TRP 38 -9.670 -14.981 -16.044 325 HZ3 TRP 71 HZ3 TRP 38 -11.978 -14.808 -12.428 326 HH2 TRP 71 HH2 TRP 38 -11.831 -14.536 -14.890 327 H ILE 72 H ILE 39 -8.269 -16.205 -8.001 328 HA ILE 72 HA ILE 39 -6.501 -15.635 -5.974 329 HB ILE 72 HB ILE 39 -8.882 -17.420 -6.225 330 HG12 ILE 72 HG12 ILE 39 -8.111 -15.145 -4.332 331 HG13 ILE 72 HG13 ILE 39 -8.889 -14.931 -5.909 332 HG21 ILE 72 HG21 ILE 39 -7.185 -17.472 -3.694 333 HG22 ILE 72 HG22 ILE 39 -8.830 -18.118 -3.858 334 HG23 ILE 72 HG23 ILE 39 -7.538 -18.836 -4.781 335 HD11 ILE 72 HD11 ILE 39 -10.112 -16.344 -3.531 336 HD12 ILE 72 HD12 ILE 39 -10.516 -14.750 -4.200 337 HD13 ILE 72 HD13 ILE 39 -10.837 -16.211 -5.162 338 HA PRO 73 HA PRO 40 -3.483 -18.889 -6.387 339 HB2 PRO 73 HB2 PRO 40 -1.738 -18.214 -4.414 340 HB3 PRO 73 HB3 PRO 40 -2.017 -17.158 -5.813 341 HG2 PRO 73 HG2 PRO 40 -3.382 -17.012 -3.113 342 HG3 PRO 73 HG3 PRO 40 -2.496 -15.710 -3.972 343 HD2 PRO 73 HD2 PRO 40 -5.212 -16.012 -4.102 344 HD3 PRO 73 HD3 PRO 40 -4.263 -15.456 -5.523 345 H PHE 74 H PHE 41 -5.895 -20.033 -5.346 346 HA PHE 74 HA PHE 41 -5.712 -20.732 -2.540 347 HB2 PHE 74 HB2 PHE 41 -7.535 -22.222 -2.885 348 HB3 PHE 74 HB3 PHE 41 -7.877 -20.704 -3.648 349 HD1 PHE 74 HD2 PHE 41 -7.605 -20.576 -6.282 350 HD2 PHE 74 HD1 PHE 41 -7.639 -24.258 -4.039 351 HE1 PHE 74 HE2 PHE 41 -8.117 -21.826 -8.348 352 HE2 PHE 74 HE1 PHE 41 -8.243 -25.503 -6.114 353 HZ PHE 74 HZ PHE 41 -8.451 -24.290 -8.271 354 H LYS 75 H LYS 42 -5.237 -22.839 -5.411 355 HA LYS 75 HA LYS 42 -4.147 -24.949 -3.787 356 HB2 LYS 75 HB2 LYS 42 -5.464 -25.016 -6.004 357 HB3 LYS 75 HB3 LYS 42 -3.982 -24.543 -6.806 358 HG2 LYS 75 HG2 LYS 42 -4.325 -26.926 -7.003 359 HG3 LYS 75 HG3 LYS 42 -2.899 -26.658 -5.994 360 HD2 LYS 75 HD2 LYS 42 -4.251 -27.104 -3.955 361 HD3 LYS 75 HD3 LYS 42 -5.702 -27.306 -4.945 362 HE2 LYS 75 HE2 LYS 42 -3.173 -29.028 -5.137 363 HE3 LYS 75 HE3 LYS 42 -4.575 -29.440 -4.155 364 HZ1 LYS 75 HZ1 LYS 42 -4.590 -29.183 -7.118 365 HZ2 LYS 75 HZ2 LYS 42 -4.659 -30.569 -6.264 366 HZ3 LYS 75 HZ3 LYS 42 -5.910 -29.527 -6.195 367 H GLN 76 H GLN 43 -2.865 -22.185 -5.359 368 HA GLN 76 HA GLN 43 -0.120 -22.976 -5.585 369 HB2 GLN 76 HB2 GLN 43 -1.366 -20.191 -5.561 370 HB3 GLN 76 HB3 GLN 43 0.209 -20.647 -6.177 371 HG2 GLN 76 HG2 GLN 43 -0.925 -20.489 -8.140 372 HG3 GLN 76 HG3 GLN 43 -1.157 -22.202 -7.840 373 HE21 GLN 76 HE22 GLN 43 -2.837 -19.858 -9.301 374 HE22 GLN 76 HE21 GLN 43 -4.440 -20.091 -8.621 375 H LEU 77 H LEU 44 -2.060 -21.135 -3.154 376 HA LEU 77 HA LEU 44 0.104 -20.826 -1.227 377 HB2 LEU 77 HB2 LEU 44 -2.899 -20.570 -1.037 378 HB3 LEU 77 HB3 LEU 44 -1.816 -20.348 0.337 379 HG LEU 77 HG LEU 44 -1.612 -18.679 -2.198 380 HD11 LEU 77 HD11 LEU 44 -3.013 -17.948 0.422 381 HD12 LEU 77 HD12 LEU 44 -2.792 -16.892 -0.970 382 HD13 LEU 77 HD13 LEU 44 -3.832 -18.319 -1.122 383 HD21 LEU 77 HD21 LEU 44 0.444 -18.679 -0.867 384 HD22 LEU 77 HD22 LEU 44 -0.361 -17.112 -0.773 385 HD23 LEU 77 HD23 LEU 44 -0.473 -18.251 0.590 386 H GLY 78 H GLY 45 -2.378 -23.262 -1.970 387 HA2 GLY 78 HA2 GLY 45 -1.588 -25.559 -1.637 388 HA3 GLY 78 HA3 GLY 45 -1.065 -25.115 -0.019 389 H TYR 79 H TYR 46 -4.080 -23.637 -0.853 390 HA TYR 79 HA TYR 46 -5.575 -25.391 0.963 391 HB2 TYR 79 HB2 TYR 46 -6.528 -23.067 -0.758 392 HB3 TYR 79 HB3 TYR 46 -7.394 -23.829 0.574 393 HD1 TYR 79 HD2 TYR 46 -6.423 -23.685 2.933 394 HD2 TYR 79 HD1 TYR 46 -4.972 -21.326 -0.364 395 HE1 TYR 79 HE2 TYR 46 -5.275 -22.217 4.517 396 HE2 TYR 79 HE1 TYR 46 -3.827 -19.812 1.218 397 HH TYR 79 HH TYR 46 -3.878 -20.343 4.790 398 HA PRO 80 HA PRO 47 -6.466 -27.845 -2.542 399 HB2 PRO 80 HB2 PRO 47 -8.738 -29.305 -1.824 400 HB3 PRO 80 HB3 PRO 47 -7.107 -29.583 -1.142 401 HG2 PRO 80 HG2 PRO 47 -9.341 -27.865 0.012 402 HG3 PRO 80 HG3 PRO 47 -8.391 -29.140 0.844 403 HD2 PRO 80 HD2 PRO 47 -7.658 -26.551 1.106 404 HD3 PRO 80 HD3 PRO 47 -6.407 -27.794 0.836 405 H THR 81 H THR 48 -9.149 -25.769 -1.417 406 HA THR 81 HA THR 48 -10.138 -25.535 -4.207 407 HB THR 81 HB THR 48 -12.447 -25.769 -3.100 408 HG1 THR 81 HG1 THR 48 -12.232 -26.997 -1.018 409 HG21 THR 81 HG21 THR 48 -10.786 -28.292 -2.740 410 HG22 THR 81 HG22 THR 48 -12.507 -28.155 -3.134 411 HG23 THR 81 HG23 THR 48 -11.291 -27.689 -4.334 412 H LEU 82 H LEU 49 -11.715 -23.695 -4.380 413 HA LEU 82 HA LEU 49 -10.714 -21.284 -3.162 414 HB2 LEU 82 HB2 LEU 49 -13.336 -21.934 -4.614 415 HB3 LEU 82 HB3 LEU 49 -13.008 -20.354 -3.948 416 HG LEU 82 HG LEU 49 -12.583 -20.280 -6.278 417 HD11 LEU 82 HD11 LEU 49 -10.260 -19.468 -6.337 418 HD12 LEU 82 HD12 LEU 49 -11.067 -18.947 -4.838 419 HD13 LEU 82 HD13 LEU 49 -9.899 -20.293 -4.839 420 HD21 LEU 82 HD21 LEU 49 -10.508 -22.483 -5.987 421 HD22 LEU 82 HD22 LEU 49 -12.133 -22.687 -6.689 422 HD23 LEU 82 HD23 LEU 49 -10.949 -21.629 -7.462 423 H GLU 83 H GLU 50 -13.449 -23.481 -2.325 424 HA GLU 83 HA GLU 50 -14.378 -21.795 -0.227 425 HB2 GLU 83 HB2 GLU 50 -15.624 -23.602 0.608 426 HB3 GLU 83 HB3 GLU 50 -15.677 -23.705 -1.143 427 HG2 GLU 83 HG2 GLU 50 -14.011 -25.538 -1.091 428 HG3 GLU 83 HG3 GLU 50 -13.927 -25.418 0.671 429 H ALA 84 H ALA 51 -11.852 -24.440 -0.170 430 HA ALA 84 HA ALA 51 -11.405 -24.241 2.619 431 HB1 ALA 84 HB1 ALA 51 -9.304 -25.407 2.160 432 HB2 ALA 84 HB2 ALA 51 -10.647 -26.117 1.245 433 HB3 ALA 84 HB3 ALA 51 -9.479 -25.059 0.420 434 H TYR 85 H TYR 52 -9.823 -22.481 -0.087 435 HA TYR 85 HA TYR 52 -8.036 -20.918 1.464 436 HB2 TYR 85 HB2 TYR 52 -7.847 -20.912 -0.894 437 HB3 TYR 85 HB3 TYR 52 -9.526 -20.440 -1.133 438 HD1 TYR 85 HD1 TYR 52 -6.278 -19.220 0.289 439 HD2 TYR 85 HD2 TYR 52 -10.122 -18.165 -1.364 440 HE1 TYR 85 HE1 TYR 52 -5.581 -16.866 0.281 441 HE2 TYR 85 HE2 TYR 52 -9.442 -15.784 -1.390 442 HH TYR 85 HH TYR 52 -6.247 -14.672 -0.127 443 H LEU 86 H LEU 53 -11.493 -20.208 0.544 444 HA LEU 86 HA LEU 53 -11.631 -17.802 2.042 445 HB2 LEU 86 HB2 LEU 53 -13.772 -19.750 1.125 446 HB3 LEU 86 HB3 LEU 53 -14.116 -18.177 1.835 447 HG LEU 86 HG LEU 53 -12.329 -18.338 -0.600 448 HD11 LEU 86 HD11 LEU 53 -14.388 -17.941 -1.975 449 HD12 LEU 86 HD12 LEU 53 -14.289 -19.560 -1.280 450 HD13 LEU 86 HD13 LEU 53 -15.356 -18.372 -0.528 451 HD21 LEU 86 HD21 LEU 53 -14.225 -16.205 0.485 452 HD22 LEU 86 HD22 LEU 53 -12.449 -16.199 0.645 453 HD23 LEU 86 HD23 LEU 53 -13.188 -16.065 -0.956 454 H ARG 87 H ARG 54 -12.338 -21.163 3.064 455 HA ARG 87 HA ARG 54 -13.308 -20.579 5.721 456 HB2 ARG 87 HB2 ARG 54 -11.690 -22.957 4.665 457 HB3 ARG 87 HB3 ARG 54 -12.021 -22.769 6.360 458 HG2 ARG 87 HG2 ARG 54 -13.574 -24.302 5.677 459 HG3 ARG 87 HG3 ARG 54 -14.484 -22.807 5.895 460 HD2 ARG 87 HD2 ARG 54 -14.659 -22.517 3.465 461 HD3 ARG 87 HD3 ARG 54 -13.359 -23.681 3.241 462 HE ARG 87 HE ARG 54 -14.817 -25.212 2.850 463 HH11 ARG 87 HH21 ARG 54 -16.279 -23.489 5.634 464 HH12 ARG 87 HH22 ARG 54 -17.714 -24.442 5.602 465 HH21 ARG 87 HH11 ARG 54 -16.745 -26.298 2.720 466 HH22 ARG 87 HH12 ARG 54 -17.937 -26.161 3.983 467 H SER 88 H SER 55 -10.035 -20.617 4.374 468 HA SER 88 HA SER 55 -8.745 -20.548 6.960 469 HB2 SER 88 HB2 SER 55 -7.619 -20.338 4.151 470 HB3 SER 88 HB3 SER 55 -6.712 -20.637 5.645 471 HG SER 88 HG SER 55 -8.625 -22.293 4.364 472 H VAL 89 H VAL 56 -10.378 -18.025 5.722 473 HA VAL 89 HA VAL 56 -8.420 -16.078 6.834 474 HB VAL 89 HB VAL 56 -8.276 -15.919 4.478 475 HG11 VAL 89 HG11 VAL 56 -11.283 -15.895 4.428 476 HG12 VAL 89 HG12 VAL 56 -10.342 -15.165 3.107 477 HG13 VAL 89 HG13 VAL 56 -10.126 -16.868 3.514 478 HG21 VAL 89 HG21 VAL 56 -9.945 -13.514 5.201 479 HG22 VAL 89 HG22 VAL 56 -8.280 -13.770 5.783 480 HG23 VAL 89 HG23 VAL 56 -8.613 -13.650 4.046 481 HA PRO 90 HA PRO 57 -12.867 -16.133 8.483 482 HB2 PRO 90 HB2 PRO 57 -12.659 -17.110 11.017 483 HB3 PRO 90 HB3 PRO 57 -12.710 -18.168 9.574 484 HG2 PRO 90 HG2 PRO 57 -10.265 -17.224 11.097 485 HG3 PRO 90 HG3 PRO 57 -10.680 -18.890 10.576 486 HD2 PRO 90 HD2 PRO 57 -9.005 -17.273 9.126 487 HD3 PRO 90 HD3 PRO 57 -10.108 -18.461 8.378 488 H ALA 91 H ALA 58 -9.872 -14.781 9.738 489 HA ALA 91 HA ALA 58 -11.177 -13.020 11.671 490 HB1 ALA 91 HB1 ALA 58 -8.327 -13.017 10.546 491 HB2 ALA 91 HB2 ALA 58 -8.899 -12.131 11.975 492 HB3 ALA 91 HB3 ALA 58 -8.870 -13.901 11.995 493 H VAL 92 H VAL 59 -10.933 -12.937 8.270 494 HA VAL 92 HA VAL 59 -11.293 -9.970 8.249 495 HB VAL 92 HB VAL 59 -9.648 -11.532 6.237 496 HG11 VAL 92 HG11 VAL 59 -9.821 -8.539 6.790 497 HG12 VAL 92 HG12 VAL 59 -8.792 -9.322 5.567 498 HG13 VAL 92 HG13 VAL 59 -10.551 -9.397 5.419 499 HG21 VAL 92 HG21 VAL 59 -7.621 -10.498 7.253 500 HG22 VAL 92 HG22 VAL 59 -8.613 -9.921 8.611 501 HG23 VAL 92 HG23 VAL 59 -8.382 -11.666 8.321 502 H VAL 93 H VAL 60 -12.280 -13.119 7.079 503 HA VAL 93 HA VAL 60 -14.316 -11.940 5.274 504 HB VAL 93 HB VAL 60 -12.167 -14.010 4.769 505 HG11 VAL 93 HG11 VAL 60 -14.556 -13.646 2.939 506 HG12 VAL 93 HG12 VAL 60 -13.085 -14.563 2.587 507 HG13 VAL 93 HG13 VAL 60 -14.146 -15.106 3.877 508 HG21 VAL 93 HG21 VAL 60 -11.430 -11.809 4.219 509 HG22 VAL 93 HG22 VAL 60 -11.818 -12.596 2.693 510 HG23 VAL 93 HG23 VAL 60 -12.951 -11.419 3.400 511 H ARG 94 H ARG 61 -15.976 -13.621 4.799 512 HA ARG 94 HA ARG 61 -16.526 -15.522 7.002 513 HB2 ARG 94 HB2 ARG 61 -17.379 -13.509 7.925 514 HB3 ARG 94 HB3 ARG 61 -18.017 -12.948 6.386 515 HG2 ARG 94 HG2 ARG 61 -19.847 -14.550 6.478 516 HG3 ARG 94 HG3 ARG 61 -19.127 -15.369 7.870 517 HD2 ARG 94 HD2 ARG 61 -21.031 -13.950 8.501 518 HD3 ARG 94 HD3 ARG 61 -19.516 -13.473 9.297 519 HE ARG 94 HE ARG 61 -19.994 -11.974 6.854 520 HH11 ARG 94 HH11 ARG 61 -21.211 -12.192 10.179 521 HH12 ARG 94 HH12 ARG 61 -21.471 -10.497 10.355 522 HH21 ARG 94 HH21 ARG 61 -20.162 -9.690 7.143 523 HH22 ARG 94 HH22 ARG 61 -20.939 -9.045 8.543 524 H ILE 95 H ILE 62 -18.292 -17.011 6.319 525 HA ILE 95 HA ILE 62 -19.095 -16.813 3.495 526 HB ILE 95 HB ILE 62 -18.401 -19.143 3.071 527 HG12 ILE 95 HG12 ILE 62 -16.801 -18.942 5.644 528 HG13 ILE 95 HG13 ILE 62 -18.171 -20.018 5.320 529 HG21 ILE 95 HG21 ILE 62 -16.992 -17.117 2.368 530 HG22 ILE 95 HG22 ILE 62 -15.932 -17.491 3.737 531 HG23 ILE 95 HG23 ILE 62 -16.173 -18.669 2.421 532 HD11 ILE 95 HD11 ILE 62 -15.420 -20.134 4.017 533 HD12 ILE 95 HD12 ILE 62 -16.147 -21.270 5.159 534 HD13 ILE 95 HD13 ILE 62 -16.820 -21.130 3.524 535 H GLU 96 H GLU 63 -20.923 -18.057 2.995 536 HA GLU 96 HA GLU 63 -22.229 -19.566 5.214 537 HB2 GLU 96 HB2 GLU 63 -23.497 -17.650 3.205 538 HB3 GLU 96 HB3 GLU 63 -24.406 -18.766 4.211 539 HG2 GLU 96 HG2 GLU 63 -22.651 -16.482 5.200 540 HG3 GLU 96 HG3 GLU 63 -24.407 -16.465 5.109 541 H ALA 97 H ALA 64 -21.675 -21.582 4.503 542 HA ALA 97 HA ALA 64 -21.952 -22.392 1.685 543 HB1 ALA 97 HB1 ALA 64 -21.486 -24.000 4.233 544 HB2 ALA 97 HB2 ALA 64 -21.465 -24.639 2.572 545 HB3 ALA 97 HB3 ALA 64 -20.233 -23.468 3.082 546 H SER 98 H SER 65 -23.863 -22.899 0.804 547 HA SER 98 HA SER 65 -26.309 -22.987 2.406 548 HB2 SER 98 HB2 SER 65 -26.271 -21.880 0.195 549 HB3 SER 98 HB3 SER 65 -25.772 -23.403 -0.572 550 HG SER 98 HG SER 65 -28.035 -22.994 -0.725 551 H ARG 99 H ARG 66 -27.582 -24.825 2.577 552 HA ARG 99 HA ARG 66 -26.416 -27.404 2.771 553 HB2 ARG 99 HB2 ARG 66 -28.547 -28.274 3.184 554 HB3 ARG 99 HB3 ARG 66 -28.534 -26.678 3.899 555 HG2 ARG 99 HG2 ARG 66 -29.919 -27.504 1.296 556 HG3 ARG 99 HG3 ARG 66 -30.679 -27.205 2.858 557 HD2 ARG 99 HD2 ARG 66 -29.943 -24.812 2.748 558 HD3 ARG 99 HD3 ARG 66 -29.293 -25.138 1.116 559 HE ARG 99 HE ARG 66 -32.069 -25.892 1.395 560 HH11 ARG 99 HH11 ARG 66 -29.886 -23.155 0.680 561 HH12 ARG 99 HH12 ARG 66 -31.105 -22.225 -0.123 562 HH21 ARG 99 HH21 ARG 66 -33.663 -24.665 0.279 563 HH22 ARG 99 HH22 ARG 66 -33.285 -23.116 -0.383 564 H SER 100 H SER 67 -27.649 -25.714 -0.070 565 HA SER 100 HA SER 67 -27.950 -28.037 -1.721 566 HB2 SER 100 HB2 SER 67 -27.415 -25.168 -2.580 567 HB3 SER 100 HB3 SER 67 -28.236 -26.443 -3.502 568 HG SER 100 HG SER 67 -29.758 -25.043 -2.539 569 H GLY 101 H GLY 68 -25.096 -26.530 -0.495 570 HA2 GLY 101 HA2 GLY 68 -22.998 -27.481 -0.772 571 HA3 GLY 101 HA3 GLY 68 -23.417 -28.072 -2.382 572 H GLU 102 H GLU 69 -24.510 -24.895 -2.346 573 HA GLU 102 HA GLU 69 -22.098 -23.840 -3.672 574 HB2 GLU 102 HB2 GLU 69 -24.803 -22.600 -2.970 575 HB3 GLU 102 HB3 GLU 69 -23.515 -21.751 -3.814 576 HG2 GLU 102 HG2 GLU 69 -25.037 -24.200 -4.808 577 HG3 GLU 102 HG3 GLU 69 -25.199 -22.546 -5.387 578 H ILE 103 H ILE 70 -21.254 -21.695 -2.790 579 HA ILE 103 HA ILE 70 -21.793 -21.197 0.016 580 HB ILE 103 HB ILE 70 -20.004 -22.553 0.471 581 HG12 ILE 103 HG12 ILE 70 -19.857 -20.174 1.408 582 HG13 ILE 103 HG13 ILE 70 -18.493 -21.254 1.601 583 HG21 ILE 103 HG21 ILE 70 -19.044 -23.107 -1.635 584 HG22 ILE 103 HG22 ILE 70 -18.349 -21.475 -1.786 585 HG23 ILE 103 HG23 ILE 70 -17.774 -22.575 -0.532 586 HD11 ILE 103 HD11 ILE 70 -18.050 -18.785 0.869 587 HD12 ILE 103 HD12 ILE 70 -17.138 -20.096 0.090 588 HD13 ILE 103 HD13 ILE 70 -18.497 -19.320 -0.736 589 H VAL 104 H VAL 71 -21.801 -19.140 0.515 590 HA VAL 104 HA VAL 71 -21.286 -17.190 -1.670 591 HB VAL 104 HB VAL 71 -23.181 -16.890 0.701 592 HG11 VAL 104 HG11 VAL 71 -22.534 -14.825 -0.502 593 HG12 VAL 104 HG12 VAL 71 -23.075 -15.540 -2.044 594 HG13 VAL 104 HG13 VAL 71 -24.245 -15.192 -0.750 595 HG21 VAL 104 HG21 VAL 71 -23.877 -18.071 -2.031 596 HG22 VAL 104 HG22 VAL 71 -24.046 -18.861 -0.454 597 HG23 VAL 104 HG23 VAL 71 -25.066 -17.481 -0.855 598 H CYS 105 H CYS 72 -19.875 -15.541 -1.176 599 HA CYS 105 HA CYS 72 -18.390 -15.815 1.381 600 HB2 CYS 105 HB2 CYS 72 -17.491 -14.372 -1.130 601 HB3 CYS 105 HB3 CYS 72 -16.490 -15.094 0.153 602 HG CYS 105 HG CYS 72 -18.329 -16.483 -2.246 603 H TYR 106 H TYR 73 -17.828 -13.972 2.597 604 HA TYR 106 HA TYR 73 -19.038 -11.345 1.920 605 HB2 TYR 106 HB2 TYR 73 -19.439 -12.985 4.465 606 HB3 TYR 106 HB3 TYR 73 -19.871 -11.286 4.316 607 HD1 TYR 106 HD1 TYR 73 -21.562 -10.571 2.541 608 HD2 TYR 106 HD2 TYR 73 -20.930 -14.687 3.735 609 HE1 TYR 106 HE1 TYR 73 -23.848 -11.098 1.847 610 HE2 TYR 106 HE2 TYR 73 -23.168 -15.282 2.871 611 HH TYR 106 HH TYR 73 -25.206 -14.465 1.993 612 H ALA 107 H ALA 74 -18.253 -9.673 3.561 613 HA ALA 107 HA ALA 74 -15.382 -10.166 4.182 614 HB1 ALA 107 HB1 ALA 74 -15.261 -7.764 4.526 615 HB2 ALA 107 HB2 ALA 74 -16.013 -8.073 2.965 616 HB3 ALA 107 HB3 ALA 74 -17.031 -7.603 4.342 617 H VAL 108 H VAL 75 -14.623 -9.331 6.262 618 HA VAL 108 HA VAL 75 -16.625 -8.995 8.406 619 HB VAL 108 HB VAL 75 -15.047 -11.391 8.059 620 HG11 VAL 108 HG11 VAL 75 -14.139 -11.765 10.249 621 HG12 VAL 108 HG12 VAL 75 -13.330 -10.380 9.530 622 HG13 VAL 108 HG13 VAL 75 -14.566 -10.130 10.778 623 HG21 VAL 108 HG21 VAL 75 -17.443 -11.256 8.677 624 HG22 VAL 108 HG22 VAL 75 -16.520 -12.233 9.824 625 HG23 VAL 108 HG23 VAL 75 -16.992 -10.577 10.253 626 H ALA 109 H ALA 76 -13.372 -8.295 7.151 627 HA ALA 109 HA ALA 76 -13.293 -5.953 8.890 628 HB1 ALA 109 HB1 ALA 76 -11.062 -6.347 9.745 629 HB2 ALA 109 HB2 ALA 76 -12.075 -7.712 10.232 630 HB3 ALA 109 HB3 ALA 76 -10.927 -7.879 8.874 Start of MODEL 19 1 H1 GLY -2 H1 GLY -2 7.073 1.184 -2.299 2 H2 GLY -2 H2 GLY -2 6.154 1.630 -1.026 3 H3 GLY -2 H3 GLY -2 7.766 1.402 -0.831 4 HA2 GLY -2 HA2 GLY -2 7.563 -0.948 -1.290 5 HA3 GLY -2 HA3 GLY -2 6.565 -0.464 0.091 6 H HIS -1 H HIS -1 5.844 -2.766 -0.963 7 HA HIS -1 HA HIS -1 3.251 -2.255 -2.290 8 HB2 HIS -1 HB2 HIS -1 5.371 -4.215 -3.279 9 HB3 HIS -1 HB3 HIS -1 3.669 -4.332 -3.703 10 HD2 HIS -1 HD2 HIS -1 6.831 -2.636 -4.807 11 HE1 HIS -1 HE1 HIS -1 3.720 -0.645 -6.930 12 HE2 HIS -1 HE2 HIS -1 6.238 -0.972 -6.747 13 H MET 34 H MET 1 1.810 -4.163 -1.975 14 HA MET 34 HA MET 1 2.035 -5.333 0.660 15 HB2 MET 34 HB2 MET 1 0.218 -5.970 -1.710 16 HB3 MET 34 HB3 MET 1 0.069 -6.702 -0.107 17 HG2 MET 34 HG2 MET 1 -0.170 -4.400 0.845 18 HG3 MET 34 HG3 MET 1 -0.292 -3.761 -0.797 19 HE1 MET 34 HE1 MET 1 -3.056 -3.919 -2.150 20 HE2 MET 34 HE2 MET 1 -1.994 -5.300 -2.495 21 HE3 MET 34 HE3 MET 1 -3.666 -5.586 -1.991 22 H LEU 35 H LEU 2 2.363 -7.545 1.190 23 HA LEU 35 HA LEU 2 4.218 -9.075 -0.535 24 HB2 LEU 35 HB2 LEU 2 2.875 -9.596 2.166 25 HB3 LEU 35 HB3 LEU 2 3.732 -10.852 1.307 26 HG LEU 35 HG LEU 2 5.119 -9.946 3.038 27 HD11 LEU 35 HD11 LEU 2 6.260 -9.061 0.356 28 HD12 LEU 35 HD12 LEU 2 7.154 -9.524 1.814 29 HD13 LEU 35 HD13 LEU 2 6.203 -10.741 0.949 30 HD21 LEU 35 HD21 LEU 2 5.969 -7.693 3.121 31 HD22 LEU 35 HD22 LEU 2 5.091 -7.238 1.647 32 HD23 LEU 35 HD23 LEU 2 4.200 -7.635 3.134 33 H GLU 36 H GLU 3 3.512 -11.310 -1.347 34 HA GLU 36 HA GLU 3 1.225 -10.959 -2.898 35 HB2 GLU 36 HB2 GLU 3 3.044 -12.520 -3.473 36 HB3 GLU 36 HB3 GLU 3 2.527 -13.609 -2.181 37 HG2 GLU 36 HG2 GLU 3 0.384 -14.010 -3.282 38 HG3 GLU 36 HG3 GLU 3 0.749 -12.795 -4.506 39 H ALA 37 H ALA 4 1.464 -12.819 0.127 40 HA ALA 37 HA ALA 4 -1.234 -13.792 -0.144 41 HB1 ALA 37 HB1 ALA 4 -1.027 -14.626 2.136 42 HB2 ALA 37 HB2 ALA 4 0.426 -15.014 1.197 43 HB3 ALA 37 HB3 ALA 4 0.466 -13.679 2.381 44 H ASP 38 H ASP 5 0.229 -10.983 1.498 45 HA ASP 38 HA ASP 5 -2.177 -10.169 2.850 46 HB2 ASP 38 HB2 ASP 5 0.166 -9.468 3.462 47 HB3 ASP 38 HB3 ASP 5 0.168 -8.423 2.041 48 H LEU 39 H LEU 6 -0.719 -9.437 -0.330 49 HA LEU 39 HA LEU 6 -2.462 -7.401 -1.174 50 HB2 LEU 39 HB2 LEU 6 -0.372 -8.024 -2.340 51 HB3 LEU 39 HB3 LEU 6 -1.037 -9.557 -2.810 52 HG LEU 39 HG LEU 6 -2.499 -7.059 -3.680 53 HD11 LEU 39 HD11 LEU 6 -1.076 -6.884 -5.665 54 HD12 LEU 39 HD12 LEU 6 -0.117 -6.629 -4.205 55 HD13 LEU 39 HD13 LEU 6 -0.024 -8.183 -5.059 56 HD21 LEU 39 HD21 LEU 6 -2.896 -8.415 -5.749 57 HD22 LEU 39 HD22 LEU 6 -2.087 -9.789 -4.970 58 HD23 LEU 39 HD23 LEU 6 -3.601 -9.125 -4.309 59 H VAL 40 H VAL 7 -2.648 -10.945 -1.785 60 HA VAL 40 HA VAL 7 -5.103 -10.631 -3.155 61 HB VAL 40 HB VAL 7 -5.244 -13.093 -3.119 62 HG11 VAL 40 HG11 VAL 7 -3.233 -13.510 -4.374 63 HG12 VAL 40 HG12 VAL 7 -3.745 -11.857 -4.702 64 HG13 VAL 40 HG13 VAL 7 -2.387 -12.159 -3.617 65 HG21 VAL 40 HG21 VAL 7 -3.586 -14.485 -2.001 66 HG22 VAL 40 HG22 VAL 7 -2.840 -13.054 -1.294 67 HG23 VAL 40 HG23 VAL 7 -4.464 -13.545 -0.805 68 H SER 41 H SER 8 -4.468 -11.488 0.320 69 HA SER 41 HA SER 8 -7.192 -11.831 0.940 70 HB2 SER 41 HB2 SER 8 -4.846 -11.003 2.679 71 HB3 SER 41 HB3 SER 8 -6.449 -11.480 3.289 72 HG SER 41 HG SER 8 -4.867 -13.246 3.136 73 H LYS 42 H LYS 9 -5.227 -8.730 1.070 74 HA LYS 42 HA LYS 9 -7.455 -7.221 2.180 75 HB2 LYS 42 HB2 LYS 9 -4.898 -6.453 0.722 76 HB3 LYS 42 HB3 LYS 9 -6.156 -5.267 1.075 77 HG2 LYS 42 HG2 LYS 9 -6.062 -5.806 3.489 78 HG3 LYS 42 HG3 LYS 9 -4.741 -6.971 3.168 79 HD2 LYS 42 HD2 LYS 9 -3.291 -5.220 2.350 80 HD3 LYS 42 HD3 LYS 9 -4.600 -4.039 2.351 81 HE2 LYS 42 HE2 LYS 9 -3.181 -3.538 4.167 82 HE3 LYS 42 HE3 LYS 9 -4.684 -4.182 4.846 83 HZ1 LYS 42 HZ1 LYS 9 -2.201 -5.777 4.453 84 HZ2 LYS 42 HZ2 LYS 9 -2.626 -5.079 5.885 85 HZ3 LYS 42 HZ3 LYS 9 -3.537 -6.280 5.242 86 H MET 43 H MET 10 -6.369 -7.836 -1.253 87 HA MET 43 HA MET 10 -8.437 -6.092 -2.275 88 HB2 MET 43 HB2 MET 10 -6.760 -8.261 -3.582 89 HB3 MET 43 HB3 MET 10 -7.948 -7.275 -4.455 90 HG2 MET 43 HG2 MET 10 -6.769 -5.205 -3.583 91 HG3 MET 43 HG3 MET 10 -5.491 -6.268 -2.979 92 HE1 MET 43 HE1 MET 10 -3.846 -4.421 -6.066 93 HE2 MET 43 HE2 MET 10 -4.886 -3.812 -4.758 94 HE3 MET 43 HE3 MET 10 -3.562 -4.943 -4.394 95 H LEU 44 H LEU 11 -8.326 -9.660 -1.783 96 HA LEU 44 HA LEU 11 -10.905 -10.404 -2.601 97 HB2 LEU 44 HB2 LEU 11 -9.237 -12.016 -1.762 98 HB3 LEU 44 HB3 LEU 11 -9.148 -11.180 -0.224 99 HG LEU 44 HG LEU 11 -11.542 -11.856 0.226 100 HD11 LEU 44 HD11 LEU 11 -12.353 -13.805 -1.038 101 HD12 LEU 44 HD12 LEU 11 -12.153 -12.412 -2.126 102 HD13 LEU 44 HD13 LEU 11 -10.942 -13.712 -2.123 103 HD21 LEU 44 HD21 LEU 11 -9.366 -13.929 -0.038 104 HD22 LEU 44 HD22 LEU 11 -9.717 -12.920 1.363 105 HD23 LEU 44 HD23 LEU 11 -10.877 -14.167 0.870 106 H ARG 45 H ARG 12 -9.897 -9.285 0.647 107 HA ARG 45 HA ARG 12 -12.428 -8.996 1.813 108 HB2 ARG 45 HB2 ARG 12 -10.534 -9.006 3.143 109 HB3 ARG 45 HB3 ARG 12 -9.682 -7.802 2.207 110 HG2 ARG 45 HG2 ARG 12 -12.166 -6.939 3.638 111 HG3 ARG 45 HG3 ARG 12 -10.679 -7.246 4.534 112 HD2 ARG 45 HD2 ARG 12 -9.535 -5.670 2.758 113 HD3 ARG 45 HD3 ARG 12 -11.201 -5.083 2.511 114 HE ARG 45 HE ARG 12 -10.393 -5.402 5.283 115 HH11 ARG 45 HH21 ARG 12 -10.079 -3.000 2.673 116 HH12 ARG 45 HH22 ARG 12 -10.120 -1.652 3.761 117 HH21 ARG 45 HH11 ARG 12 -10.637 -3.764 6.611 118 HH22 ARG 45 HH12 ARG 12 -10.363 -2.093 6.147 119 H ALA 46 H ALA 13 -10.604 -6.549 -0.149 120 HA ALA 46 HA ALA 13 -12.512 -4.549 0.421 121 HB1 ALA 46 HB1 ALA 13 -10.204 -4.086 -0.423 122 HB2 ALA 46 HB2 ALA 13 -10.650 -4.771 -2.001 123 HB3 ALA 46 HB3 ALA 13 -11.434 -3.291 -1.426 124 H VAL 47 H VAL 14 -12.325 -6.875 -2.330 125 HA VAL 47 HA VAL 14 -14.582 -5.825 -3.752 126 HB VAL 47 HB VAL 14 -13.450 -8.657 -3.562 127 HG11 VAL 47 HG11 VAL 14 -15.386 -7.534 -5.620 128 HG12 VAL 47 HG12 VAL 14 -14.616 -9.144 -5.639 129 HG13 VAL 47 HG13 VAL 14 -15.787 -8.731 -4.380 130 HG21 VAL 47 HG21 VAL 14 -12.504 -8.058 -5.828 131 HG22 VAL 47 HG22 VAL 14 -13.076 -6.401 -5.594 132 HG23 VAL 47 HG23 VAL 14 -11.835 -7.087 -4.526 133 H LEU 48 H LEU 15 -14.288 -8.267 -1.126 134 HA LEU 48 HA LEU 15 -17.068 -8.887 -0.998 135 HB2 LEU 48 HB2 LEU 15 -14.877 -8.984 1.130 136 HB3 LEU 48 HB3 LEU 15 -16.461 -9.699 1.322 137 HG LEU 48 HG LEU 15 -14.698 -10.513 -1.030 138 HD11 LEU 48 HD11 LEU 15 -13.913 -12.375 0.415 139 HD12 LEU 48 HD12 LEU 15 -13.370 -10.790 0.997 140 HD13 LEU 48 HD13 LEU 15 -14.709 -11.605 1.810 141 HD21 LEU 48 HD21 LEU 15 -16.822 -11.998 0.562 142 HD22 LEU 48 HD22 LEU 15 -17.138 -11.166 -0.967 143 HD23 LEU 48 HD23 LEU 15 -16.010 -12.539 -0.915 144 H GLN 49 H GLN 16 -15.165 -6.308 0.630 145 HA GLN 49 HA GLN 16 -17.289 -5.451 2.345 146 HB2 GLN 49 HB2 GLN 16 -14.749 -4.122 1.317 147 HB3 GLN 49 HB3 GLN 16 -15.906 -3.234 2.296 148 HG2 GLN 49 HG2 GLN 16 -14.571 -5.823 3.187 149 HG3 GLN 49 HG3 GLN 16 -14.006 -4.214 3.604 150 HE21 GLN 49 HE22 GLN 16 -14.434 -5.747 5.739 151 HE22 GLN 49 HE21 GLN 16 -15.945 -5.328 6.542 152 H SER 50 H SER 17 -16.380 -4.472 -1.029 153 HA SER 50 HA SER 17 -18.451 -2.504 -1.246 154 HB2 SER 50 HB2 SER 17 -17.149 -4.246 -3.385 155 HB3 SER 50 HB3 SER 17 -18.052 -2.754 -3.667 156 HG SER 50 HG SER 17 -16.441 -1.584 -2.629 157 H HIS 51 H HIS 18 -18.347 -6.021 -1.842 158 HA HIS 51 HA HIS 18 -21.070 -6.003 -2.923 159 HB2 HIS 51 HB2 HIS 18 -18.928 -8.140 -2.797 160 HB3 HIS 51 HB3 HIS 18 -20.510 -8.327 -3.549 161 HD2 HIS 51 HD2 HIS 18 -18.894 -8.870 -5.734 162 HE1 HIS 51 HE1 HIS 18 -18.233 -4.803 -6.746 163 HE2 HIS 51 HE2 HIS 18 -18.113 -7.184 -7.609 164 H LYS 52 H LYS 19 -21.733 -5.363 -0.534 165 HA LYS 52 HA LYS 19 -21.635 -7.304 1.531 166 HB2 LYS 52 HB2 LYS 19 -23.667 -5.075 1.024 167 HB3 LYS 52 HB3 LYS 19 -23.621 -6.041 2.491 168 HG2 LYS 52 HG2 LYS 19 -21.471 -4.132 1.532 169 HG3 LYS 52 HG3 LYS 19 -22.559 -3.957 2.921 170 HD2 LYS 52 HD2 LYS 19 -21.469 -6.189 3.760 171 HD3 LYS 52 HD3 LYS 19 -20.200 -5.841 2.586 172 HE2 LYS 52 HE2 LYS 19 -21.031 -4.192 5.014 173 HE3 LYS 52 HE3 LYS 19 -19.489 -5.016 4.735 174 HZ1 LYS 52 HZ1 LYS 19 -19.211 -3.393 2.803 175 HZ2 LYS 52 HZ2 LYS 19 -20.463 -2.537 3.434 176 HZ3 LYS 52 HZ3 LYS 19 -19.097 -2.758 4.314 177 H ASN 53 H ASN 20 -23.789 -7.246 -1.243 178 HA ASN 53 HA ASN 20 -25.769 -9.037 -0.219 179 HB2 ASN 53 HB2 ASN 20 -25.980 -7.728 -2.341 180 HB3 ASN 53 HB3 ASN 20 -24.709 -8.725 -3.066 181 HD21 ASN 53 HD22 ASN 20 -27.979 -9.006 -1.481 182 HD22 ASN 53 HD21 ASN 20 -28.477 -10.375 -2.444 183 H GLY 54 H GLY 21 -22.411 -9.598 -0.861 184 HA2 GLY 54 HA2 GLY 21 -21.203 -11.465 -0.498 185 HA3 GLY 54 HA3 GLY 21 -22.652 -12.480 -0.458 186 H ILE 55 H ILE 22 -20.472 -13.328 -1.845 187 HA ILE 55 HA ILE 22 -21.421 -13.357 -4.653 188 HB ILE 55 HB ILE 22 -18.839 -13.277 -5.225 189 HG12 ILE 55 HG12 ILE 22 -18.866 -11.570 -2.682 190 HG13 ILE 55 HG13 ILE 22 -17.903 -13.009 -2.997 191 HG21 ILE 55 HG21 ILE 22 -19.052 -11.094 -5.990 192 HG22 ILE 55 HG22 ILE 22 -20.717 -11.681 -5.944 193 HG23 ILE 55 HG23 ILE 22 -20.155 -10.614 -4.650 194 HD11 ILE 55 HD11 ILE 22 -17.660 -10.224 -4.206 195 HD12 ILE 55 HD12 ILE 22 -16.463 -11.092 -3.251 196 HD13 ILE 55 HD13 ILE 22 -16.817 -11.607 -4.914 197 H VAL 56 H VAL 23 -21.688 -15.352 -5.241 198 HA VAL 56 HA VAL 23 -20.985 -17.592 -3.671 199 HB VAL 56 HB VAL 23 -21.627 -18.863 -5.749 200 HG11 VAL 56 HG11 VAL 23 -23.286 -18.307 -4.080 201 HG12 VAL 56 HG12 VAL 23 -23.564 -16.708 -4.822 202 HG13 VAL 56 HG13 VAL 23 -23.993 -18.189 -5.695 203 HG21 VAL 56 HG21 VAL 23 -22.567 -17.699 -7.672 204 HG22 VAL 56 HG22 VAL 23 -22.178 -16.115 -6.983 205 HG23 VAL 56 HG23 VAL 23 -20.877 -17.224 -7.457 206 H LEU 57 H LEU 24 -19.264 -19.265 -4.000 207 HA LEU 57 HA LEU 24 -16.861 -18.119 -4.357 208 HB2 LEU 57 HB2 LEU 24 -15.690 -19.992 -4.071 209 HB3 LEU 57 HB3 LEU 24 -17.190 -20.282 -3.285 210 HG LEU 57 HG LEU 24 -17.857 -21.732 -5.327 211 HD11 LEU 57 HD11 LEU 24 -16.377 -21.237 -7.133 212 HD12 LEU 57 HD12 LEU 24 -14.968 -21.136 -6.064 213 HD13 LEU 57 HD13 LEU 24 -15.692 -22.700 -6.485 214 HD21 LEU 57 HD21 LEU 24 -17.118 -22.743 -3.240 215 HD22 LEU 57 HD22 LEU 24 -16.402 -23.630 -4.559 216 HD23 LEU 57 HD23 LEU 24 -15.418 -22.470 -3.639 217 HA PRO 58 HA PRO 25 -16.141 -18.991 -8.954 218 HB2 PRO 58 HB2 PRO 25 -18.244 -19.028 -10.731 219 HB3 PRO 58 HB3 PRO 25 -17.570 -20.485 -9.946 220 HG2 PRO 58 HG2 PRO 25 -20.019 -18.906 -9.125 221 HG3 PRO 58 HG3 PRO 25 -19.835 -20.676 -9.288 222 HD2 PRO 58 HD2 PRO 25 -19.645 -19.464 -6.880 223 HD3 PRO 58 HD3 PRO 25 -18.619 -20.849 -7.289 224 H ARG 59 H ARG 26 -18.960 -17.010 -8.034 225 HA ARG 59 HA ARG 26 -18.300 -14.747 -9.752 226 HB2 ARG 59 HB2 ARG 26 -20.575 -15.331 -8.831 227 HB3 ARG 59 HB3 ARG 26 -20.012 -14.809 -7.229 228 HG2 ARG 59 HG2 ARG 26 -19.623 -12.546 -8.116 229 HG3 ARG 59 HG3 ARG 26 -20.043 -13.106 -9.749 230 HD2 ARG 59 HD2 ARG 26 -22.358 -13.619 -8.942 231 HD3 ARG 59 HD3 ARG 26 -21.930 -13.000 -7.356 232 HE ARG 59 HE ARG 26 -21.868 -10.819 -8.139 233 HH11 ARG 59 HH11 ARG 26 -22.556 -12.995 -10.875 234 HH12 ARG 59 HH12 ARG 26 -23.086 -11.728 -11.918 235 HH21 ARG 59 HH21 ARG 26 -22.619 -9.147 -9.522 236 HH22 ARG 59 HH22 ARG 26 -23.137 -9.504 -11.130 237 H LEU 60 H LEU 27 -17.459 -15.820 -6.477 238 HA LEU 60 HA LEU 27 -16.176 -13.521 -5.546 239 HB2 LEU 60 HB2 LEU 27 -16.593 -15.557 -4.154 240 HB3 LEU 60 HB3 LEU 27 -15.383 -16.450 -5.033 241 HG LEU 60 HG LEU 27 -14.653 -15.725 -2.855 242 HD11 LEU 60 HD11 LEU 27 -12.841 -14.467 -4.926 243 HD12 LEU 60 HD12 LEU 27 -12.441 -15.200 -3.377 244 HD13 LEU 60 HD13 LEU 27 -13.023 -16.232 -4.688 245 HD21 LEU 60 HD21 LEU 27 -15.800 -13.488 -2.964 246 HD22 LEU 60 HD22 LEU 27 -14.178 -13.464 -2.307 247 HD23 LEU 60 HD23 LEU 27 -14.449 -12.899 -3.969 248 H GLN 61 H GLN 28 -14.767 -16.355 -7.292 249 HA GLN 61 HA GLN 28 -12.202 -15.340 -7.772 250 HB2 GLN 61 HB2 GLN 28 -14.007 -17.334 -9.110 251 HB3 GLN 61 HB3 GLN 28 -12.634 -16.784 -10.050 252 HG2 GLN 61 HG2 GLN 28 -12.149 -17.716 -7.213 253 HG3 GLN 61 HG3 GLN 28 -12.479 -18.902 -8.469 254 HE21 GLN 61 HE22 GLN 28 -10.541 -19.751 -9.360 255 HE22 GLN 61 HE21 GLN 28 -9.106 -18.791 -9.627 256 H GLY 62 H GLY 29 -15.114 -14.886 -9.870 257 HA2 GLY 62 HA2 GLY 29 -13.836 -13.450 -11.898 258 HA3 GLY 62 HA3 GLY 29 -15.549 -13.291 -11.465 259 H GLU 63 H GLU 30 -15.654 -12.051 -9.065 260 HA GLU 63 HA GLU 30 -15.015 -9.355 -9.847 261 HB2 GLU 63 HB2 GLU 30 -16.065 -10.520 -7.227 262 HB3 GLU 63 HB3 GLU 30 -15.993 -8.792 -7.600 263 HG2 GLU 63 HG2 GLU 30 -17.613 -10.839 -9.174 264 HG3 GLU 63 HG3 GLU 30 -18.244 -9.763 -7.944 265 H TYR 64 H TYR 31 -13.596 -11.606 -7.476 266 HA TYR 64 HA TYR 31 -11.639 -9.973 -6.245 267 HB2 TYR 64 HB2 TYR 31 -11.964 -12.201 -5.458 268 HB3 TYR 64 HB3 TYR 31 -11.740 -12.888 -7.066 269 HD1 TYR 64 HD2 TYR 31 -9.600 -13.237 -8.110 270 HD2 TYR 64 HD1 TYR 31 -9.952 -11.585 -4.131 271 HE1 TYR 64 HE2 TYR 31 -7.206 -13.580 -7.744 272 HE2 TYR 64 HE1 TYR 31 -7.558 -12.041 -3.729 273 HH TYR 64 HH TYR 31 -5.445 -13.475 -6.313 274 H ARG 65 H ARG 32 -11.487 -11.897 -9.296 275 HA ARG 65 HA ARG 32 -8.869 -11.058 -9.938 276 HB2 ARG 65 HB2 ARG 32 -9.847 -13.074 -10.803 277 HB3 ARG 65 HB3 ARG 32 -11.080 -12.173 -11.709 278 HG2 ARG 65 HG2 ARG 32 -9.480 -11.244 -13.229 279 HG3 ARG 65 HG3 ARG 32 -8.129 -11.581 -12.136 280 HD2 ARG 65 HD2 ARG 32 -8.619 -14.034 -12.436 281 HD3 ARG 65 HD3 ARG 32 -9.699 -13.588 -13.771 282 HE ARG 65 HE ARG 32 -6.763 -13.224 -13.513 283 HH11 ARG 65 HH11 ARG 32 -9.582 -13.163 -15.676 284 HH12 ARG 65 HH12 ARG 32 -8.657 -13.022 -17.125 285 HH21 ARG 65 HH21 ARG 32 -5.511 -13.058 -15.455 286 HH22 ARG 65 HH22 ARG 32 -6.286 -12.998 -16.994 287 H SER 66 H SER 33 -12.069 -9.607 -10.821 288 HA SER 66 HA SER 33 -11.047 -7.712 -12.619 289 HB2 SER 66 HB2 SER 33 -13.307 -7.294 -10.609 290 HB3 SER 66 HB3 SER 33 -13.010 -6.349 -12.069 291 HG SER 66 HG SER 33 -14.570 -7.917 -12.514 292 H LEU 67 H LEU 34 -10.989 -7.678 -8.996 293 HA LEU 67 HA LEU 34 -9.746 -5.024 -9.045 294 HB2 LEU 67 HB2 LEU 34 -11.149 -5.708 -7.165 295 HB3 LEU 67 HB3 LEU 34 -9.989 -6.970 -6.733 296 HG LEU 67 HG LEU 34 -8.267 -5.286 -6.244 297 HD11 LEU 67 HD11 LEU 34 -8.778 -3.480 -7.824 298 HD12 LEU 67 HD12 LEU 34 -10.352 -3.200 -7.047 299 HD13 LEU 67 HD13 LEU 34 -8.836 -2.846 -6.188 300 HD21 LEU 67 HD21 LEU 34 -9.299 -4.253 -4.277 301 HD22 LEU 67 HD22 LEU 34 -10.926 -4.550 -4.941 302 HD23 LEU 67 HD23 LEU 34 -9.884 -5.913 -4.482 303 H THR 68 H THR 35 -8.424 -8.388 -8.364 304 HA THR 68 HA THR 35 -5.807 -7.311 -7.757 305 HB THR 68 HB THR 35 -5.193 -9.793 -7.889 306 HG1 THR 68 HG1 THR 35 -7.131 -11.158 -7.978 307 HG21 THR 68 HG21 THR 35 -6.349 -10.409 -5.872 308 HG22 THR 68 HG22 THR 35 -5.885 -8.725 -5.761 309 HG23 THR 68 HG23 THR 35 -7.587 -9.156 -6.121 310 H GLY 69 H GLY 36 -7.315 -8.662 -10.680 311 HA2 GLY 69 HA2 GLY 36 -6.524 -8.789 -12.851 312 HA3 GLY 69 HA3 GLY 36 -4.969 -8.089 -12.356 313 H ASP 70 H ASP 37 -6.299 -10.797 -10.448 314 HA ASP 70 HA ASP 37 -4.537 -12.768 -11.777 315 HB2 ASP 70 HB2 ASP 37 -3.286 -11.539 -9.889 316 HB3 ASP 70 HB3 ASP 37 -4.442 -12.267 -8.770 317 H TRP 71 H TRP 38 -4.987 -14.981 -10.774 318 HA TRP 71 HA TRP 38 -7.860 -15.317 -10.108 319 HB2 TRP 71 HB2 TRP 38 -5.652 -17.325 -10.696 320 HB3 TRP 71 HB3 TRP 38 -7.307 -17.737 -10.292 321 HD1 TRP 71 HD1 TRP 38 -5.190 -17.316 -13.192 322 HE1 TRP 71 HE1 TRP 38 -6.519 -17.091 -15.368 323 HE3 TRP 71 HE3 TRP 38 -9.777 -16.318 -11.194 324 HZ2 TRP 71 HZ2 TRP 38 -9.265 -16.466 -16.137 325 HZ3 TRP 71 HZ3 TRP 38 -11.692 -15.788 -12.645 326 HH2 TRP 71 HH2 TRP 38 -11.476 -15.896 -15.124 327 H ILE 72 H ILE 39 -8.377 -16.526 -8.148 328 HA ILE 72 HA ILE 39 -7.017 -15.834 -5.798 329 HB ILE 72 HB ILE 39 -8.909 -18.081 -6.511 330 HG12 ILE 72 HG12 ILE 39 -9.687 -15.624 -6.468 331 HG13 ILE 72 HG13 ILE 39 -10.645 -16.831 -5.633 332 HG21 ILE 72 HG21 ILE 39 -9.255 -18.448 -4.040 333 HG22 ILE 72 HG22 ILE 39 -7.714 -18.998 -4.700 334 HG23 ILE 72 HG23 ILE 39 -7.777 -17.501 -3.756 335 HD11 ILE 72 HD11 ILE 39 -8.649 -15.095 -4.158 336 HD12 ILE 72 HD12 ILE 39 -10.335 -14.631 -4.449 337 HD13 ILE 72 HD13 ILE 39 -9.994 -16.084 -3.501 338 HA PRO 73 HA PRO 40 -3.656 -18.764 -6.350 339 HB2 PRO 73 HB2 PRO 40 -1.955 -18.014 -4.401 340 HB3 PRO 73 HB3 PRO 40 -2.398 -16.895 -5.697 341 HG2 PRO 73 HG2 PRO 40 -3.710 -17.107 -2.968 342 HG3 PRO 73 HG3 PRO 40 -2.972 -15.662 -3.740 343 HD2 PRO 73 HD2 PRO 40 -5.658 -16.225 -3.885 344 HD3 PRO 73 HD3 PRO 40 -4.777 -15.466 -5.248 345 H PHE 74 H PHE 41 -5.990 -20.044 -5.301 346 HA PHE 74 HA PHE 41 -5.769 -20.842 -2.546 347 HB2 PHE 74 HB2 PHE 41 -7.533 -22.366 -2.940 348 HB3 PHE 74 HB3 PHE 41 -7.945 -20.873 -3.728 349 HD1 PHE 74 HD1 PHE 41 -7.645 -20.741 -6.339 350 HD2 PHE 74 HD2 PHE 41 -7.511 -24.410 -4.080 351 HE1 PHE 74 HE1 PHE 41 -8.141 -22.029 -8.397 352 HE2 PHE 74 HE2 PHE 41 -8.092 -25.690 -6.135 353 HZ PHE 74 HZ PHE 41 -8.384 -24.498 -8.295 354 H LYS 75 H LYS 42 -5.207 -22.833 -5.484 355 HA LYS 75 HA LYS 42 -4.031 -24.930 -3.906 356 HB2 LYS 75 HB2 LYS 42 -5.354 -24.924 -6.179 357 HB3 LYS 75 HB3 LYS 42 -3.821 -24.538 -6.920 358 HG2 LYS 75 HG2 LYS 42 -4.326 -26.907 -7.074 359 HG3 LYS 75 HG3 LYS 42 -2.875 -26.686 -6.079 360 HD2 LYS 75 HD2 LYS 42 -4.154 -27.086 -4.037 361 HD3 LYS 75 HD3 LYS 42 -5.682 -27.096 -4.928 362 HE2 LYS 75 HE2 LYS 42 -3.399 -29.090 -5.363 363 HE3 LYS 75 HE3 LYS 42 -4.728 -29.362 -4.239 364 HZ1 LYS 75 HZ1 LYS 42 -6.280 -29.249 -6.116 365 HZ2 LYS 75 HZ2 LYS 42 -5.039 -29.045 -7.176 366 HZ3 LYS 75 HZ3 LYS 42 -5.177 -30.431 -6.340 367 H GLN 76 H GLN 43 -2.844 -22.111 -5.455 368 HA GLN 76 HA GLN 43 -0.087 -22.820 -5.773 369 HB2 GLN 76 HB2 GLN 43 -1.401 -20.067 -5.594 370 HB3 GLN 76 HB3 GLN 43 0.182 -20.456 -6.254 371 HG2 GLN 76 HG2 GLN 43 -0.980 -20.266 -8.199 372 HG3 GLN 76 HG3 GLN 43 -1.178 -21.986 -7.945 373 HE21 GLN 76 HE22 GLN 43 -2.905 -19.571 -9.257 374 HE22 GLN 76 HE21 GLN 43 -4.493 -19.866 -8.565 375 H LEU 77 H LEU 44 -1.969 -21.055 -3.236 376 HA LEU 77 HA LEU 44 0.306 -20.859 -1.398 377 HB2 LEU 77 HB2 LEU 44 -2.654 -20.388 -1.066 378 HB3 LEU 77 HB3 LEU 44 -1.473 -20.197 0.236 379 HG LEU 77 HG LEU 44 -1.479 -18.611 -2.355 380 HD11 LEU 77 HD11 LEU 44 -2.260 -16.714 -1.035 381 HD12 LEU 77 HD12 LEU 44 -3.388 -18.065 -0.872 382 HD13 LEU 77 HD13 LEU 44 -2.254 -17.690 0.448 383 HD21 LEU 77 HD21 LEU 44 0.233 -18.267 0.138 384 HD22 LEU 77 HD22 LEU 44 0.800 -18.732 -1.486 385 HD23 LEU 77 HD23 LEU 44 0.145 -17.120 -1.214 386 H GLY 78 H GLY 45 -2.255 -23.213 -2.078 387 HA2 GLY 78 HA2 GLY 45 -1.479 -25.506 -1.729 388 HA3 GLY 78 HA3 GLY 45 -0.914 -25.049 -0.125 389 H TYR 79 H TYR 46 -3.947 -23.613 -0.978 390 HA TYR 79 HA TYR 46 -5.428 -25.283 0.931 391 HB2 TYR 79 HB2 TYR 46 -6.356 -23.014 -0.881 392 HB3 TYR 79 HB3 TYR 46 -7.250 -23.735 0.454 393 HD1 TYR 79 HD2 TYR 46 -6.325 -23.520 2.827 394 HD2 TYR 79 HD1 TYR 46 -4.760 -21.262 -0.500 395 HE1 TYR 79 HE2 TYR 46 -5.208 -21.995 4.388 396 HE2 TYR 79 HE1 TYR 46 -3.649 -19.717 1.047 397 HH TYR 79 HH TYR 46 -3.226 -19.173 3.320 398 HA PRO 80 HA PRO 47 -6.321 -27.930 -2.456 399 HB2 PRO 80 HB2 PRO 47 -8.582 -29.343 -1.645 400 HB3 PRO 80 HB3 PRO 47 -6.956 -29.594 -0.955 401 HG2 PRO 80 HG2 PRO 47 -9.174 -27.790 0.105 402 HG3 PRO 80 HG3 PRO 47 -8.235 -29.040 1.003 403 HD2 PRO 80 HD2 PRO 47 -7.462 -26.457 1.140 404 HD3 PRO 80 HD3 PRO 47 -6.230 -27.729 0.903 405 H THR 81 H THR 48 -8.991 -25.802 -1.420 406 HA THR 81 HA THR 48 -10.024 -25.704 -4.206 407 HB THR 81 HB THR 48 -12.324 -25.903 -3.093 408 HG1 THR 81 HG1 THR 48 -12.111 -27.002 -0.944 409 HG21 THR 81 HG21 THR 48 -11.154 -27.885 -4.203 410 HG22 THR 81 HG22 THR 48 -10.646 -28.387 -2.577 411 HG23 THR 81 HG23 THR 48 -12.369 -28.282 -2.963 412 H LEU 82 H LEU 49 -11.601 -23.896 -4.447 413 HA LEU 82 HA LEU 49 -10.657 -21.397 -3.411 414 HB2 LEU 82 HB2 LEU 49 -13.345 -22.228 -4.637 415 HB3 LEU 82 HB3 LEU 49 -13.011 -20.588 -4.141 416 HG LEU 82 HG LEU 49 -12.744 -20.704 -6.493 417 HD11 LEU 82 HD11 LEU 49 -11.185 -19.245 -5.296 418 HD12 LEU 82 HD12 LEU 49 -9.979 -20.557 -5.247 419 HD13 LEU 82 HD13 LEU 49 -10.476 -19.881 -6.796 420 HD21 LEU 82 HD21 LEU 49 -12.258 -23.137 -6.740 421 HD22 LEU 82 HD22 LEU 49 -11.188 -22.102 -7.689 422 HD23 LEU 82 HD23 LEU 49 -10.588 -22.822 -6.195 423 H GLU 83 H GLU 50 -13.342 -23.570 -2.388 424 HA GLU 83 HA GLU 50 -14.228 -21.802 -0.342 425 HB2 GLU 83 HB2 GLU 50 -15.446 -23.603 0.596 426 HB3 GLU 83 HB3 GLU 50 -15.577 -23.691 -1.157 427 HG2 GLU 83 HG2 GLU 50 -13.944 -25.538 -1.200 428 HG3 GLU 83 HG3 GLU 50 -13.741 -25.424 0.550 429 H ALA 84 H ALA 51 -11.707 -24.432 -0.216 430 HA ALA 84 HA ALA 51 -11.257 -24.162 2.565 431 HB1 ALA 84 HB1 ALA 51 -10.486 -26.069 1.256 432 HB2 ALA 84 HB2 ALA 51 -9.334 -25.027 0.382 433 HB3 ALA 84 HB3 ALA 51 -9.148 -25.311 2.135 434 H TYR 85 H TYR 52 -9.704 -22.432 -0.181 435 HA TYR 85 HA TYR 52 -7.920 -20.836 1.349 436 HB2 TYR 85 HB2 TYR 52 -7.712 -20.851 -1.010 437 HB3 TYR 85 HB3 TYR 52 -9.394 -20.375 -1.260 438 HD1 TYR 85 HD1 TYR 52 -6.116 -19.174 0.078 439 HD2 TYR 85 HD2 TYR 52 -10.016 -18.089 -1.404 440 HE1 TYR 85 HE1 TYR 52 -5.431 -16.813 0.133 441 HE2 TYR 85 HE2 TYR 52 -9.352 -15.702 -1.369 442 HH TYR 85 HH TYR 52 -6.144 -14.593 -0.157 443 H LEU 86 H LEU 53 -11.375 -20.183 0.428 444 HA LEU 86 HA LEU 53 -11.533 -17.746 1.889 445 HB2 LEU 86 HB2 LEU 53 -13.668 -19.702 0.961 446 HB3 LEU 86 HB3 LEU 53 -14.008 -18.094 1.595 447 HG LEU 86 HG LEU 53 -12.186 -18.415 -0.800 448 HD11 LEU 86 HD11 LEU 53 -15.211 -18.418 -0.749 449 HD12 LEU 86 HD12 LEU 53 -14.244 -18.010 -2.198 450 HD13 LEU 86 HD13 LEU 53 -14.130 -19.612 -1.479 451 HD21 LEU 86 HD21 LEU 53 -12.295 -16.216 0.383 452 HD22 LEU 86 HD22 LEU 53 -12.897 -16.148 -1.273 453 HD23 LEU 86 HD23 LEU 53 -14.051 -16.171 0.081 454 H ARG 87 H ARG 54 -12.225 -21.102 2.959 455 HA ARG 87 HA ARG 54 -13.235 -20.480 5.589 456 HB2 ARG 87 HB2 ARG 54 -11.560 -22.839 4.577 457 HB3 ARG 87 HB3 ARG 54 -11.888 -22.624 6.268 458 HG2 ARG 87 HG2 ARG 54 -13.398 -24.214 5.618 459 HG3 ARG 87 HG3 ARG 54 -14.362 -22.743 5.809 460 HD2 ARG 87 HD2 ARG 54 -14.530 -22.513 3.369 461 HD3 ARG 87 HD3 ARG 54 -13.217 -23.658 3.170 462 HE ARG 87 HE ARG 54 -14.674 -25.208 2.808 463 HH11 ARG 87 HH11 ARG 54 -16.091 -23.506 5.628 464 HH12 ARG 87 HH12 ARG 54 -17.497 -24.505 5.646 465 HH21 ARG 87 HH21 ARG 54 -16.571 -26.341 2.743 466 HH22 ARG 87 HH22 ARG 54 -17.742 -26.221 4.035 467 H SER 88 H SER 55 -9.927 -20.559 4.294 468 HA SER 88 HA SER 55 -8.690 -20.443 6.881 469 HB2 SER 88 HB2 SER 55 -7.515 -20.202 4.098 470 HB3 SER 88 HB3 SER 55 -6.627 -20.499 5.605 471 HG SER 88 HG SER 55 -8.483 -22.181 4.267 472 H VAL 89 H VAL 56 -10.333 -17.927 5.698 473 HA VAL 89 HA VAL 56 -8.404 -15.966 6.830 474 HB VAL 89 HB VAL 56 -8.215 -15.781 4.482 475 HG11 VAL 89 HG11 VAL 56 -10.258 -15.098 3.057 476 HG12 VAL 89 HG12 VAL 56 -10.050 -16.794 3.498 477 HG13 VAL 89 HG13 VAL 56 -11.225 -15.814 4.364 478 HG21 VAL 89 HG21 VAL 56 -8.286 -13.637 5.774 479 HG22 VAL 89 HG22 VAL 56 -8.615 -13.519 4.036 480 HG23 VAL 89 HG23 VAL 56 -9.957 -13.420 5.182 481 HA PRO 90 HA PRO 57 -12.854 -16.090 8.415 482 HB2 PRO 90 HB2 PRO 57 -12.679 -17.098 10.930 483 HB3 PRO 90 HB3 PRO 57 -12.684 -18.138 9.471 484 HG2 PRO 90 HG2 PRO 57 -10.291 -17.179 11.076 485 HG3 PRO 90 HG3 PRO 57 -10.658 -18.843 10.502 486 HD2 PRO 90 HD2 PRO 57 -8.987 -17.130 9.149 487 HD3 PRO 90 HD3 PRO 57 -10.001 -18.361 8.351 488 H ALA 91 H ALA 58 -9.904 -14.722 9.714 489 HA ALA 91 HA ALA 58 -11.223 -12.991 11.653 490 HB1 ALA 91 HB1 ALA 58 -8.973 -12.061 11.956 491 HB2 ALA 91 HB2 ALA 58 -8.913 -13.832 11.973 492 HB3 ALA 91 HB3 ALA 58 -8.388 -12.938 10.526 493 H VAL 92 H VAL 59 -10.981 -12.876 8.250 494 HA VAL 92 HA VAL 59 -11.395 -9.918 8.234 495 HB VAL 92 HB VAL 59 -9.684 -11.439 6.244 496 HG11 VAL 92 HG11 VAL 59 -9.948 -8.456 6.793 497 HG12 VAL 92 HG12 VAL 59 -8.894 -9.210 5.573 498 HG13 VAL 92 HG13 VAL 59 -10.651 -9.336 5.416 499 HG21 VAL 92 HG21 VAL 59 -8.725 -9.800 8.628 500 HG22 VAL 92 HG22 VAL 59 -8.434 -11.529 8.348 501 HG23 VAL 92 HG23 VAL 59 -7.703 -10.335 7.286 502 H VAL 93 H VAL 60 -12.271 -13.083 7.014 503 HA VAL 93 HA VAL 60 -14.339 -11.938 5.218 504 HB VAL 93 HB VAL 60 -12.149 -13.953 4.700 505 HG11 VAL 93 HG11 VAL 60 -14.564 -13.629 2.894 506 HG12 VAL 93 HG12 VAL 60 -13.063 -14.479 2.493 507 HG13 VAL 93 HG13 VAL 60 -14.081 -15.093 3.784 508 HG21 VAL 93 HG21 VAL 60 -12.972 -11.362 3.360 509 HG22 VAL 93 HG22 VAL 60 -11.451 -11.733 4.181 510 HG23 VAL 93 HG23 VAL 60 -11.812 -12.504 2.641 511 H ARG 94 H ARG 61 -15.956 -13.643 4.721 512 HA ARG 94 HA ARG 61 -16.483 -15.564 6.917 513 HB2 ARG 94 HB2 ARG 61 -17.389 -13.608 7.850 514 HB3 ARG 94 HB3 ARG 61 -17.991 -13.006 6.310 515 HG2 ARG 94 HG2 ARG 61 -19.828 -14.610 6.330 516 HG3 ARG 94 HG3 ARG 61 -19.149 -15.433 7.748 517 HD2 ARG 94 HD2 ARG 61 -21.074 -13.940 8.281 518 HD3 ARG 94 HD3 ARG 61 -19.592 -13.563 9.166 519 HE ARG 94 HE ARG 61 -19.896 -12.001 6.710 520 HH11 ARG 94 HH11 ARG 61 -21.254 -12.144 9.968 521 HH12 ARG 94 HH12 ARG 61 -21.248 -10.433 10.213 522 HH21 ARG 94 HH21 ARG 61 -19.558 -9.741 7.154 523 HH22 ARG 94 HH22 ARG 61 -20.421 -9.022 8.478 524 H ILE 95 H ILE 62 -18.181 -17.093 6.217 525 HA ILE 95 HA ILE 62 -19.057 -16.877 3.423 526 HB ILE 95 HB ILE 62 -18.338 -19.197 2.927 527 HG12 ILE 95 HG12 ILE 62 -16.702 -19.019 5.484 528 HG13 ILE 95 HG13 ILE 62 -18.082 -20.089 5.193 529 HG21 ILE 95 HG21 ILE 62 -16.941 -17.158 2.256 530 HG22 ILE 95 HG22 ILE 62 -15.866 -17.550 3.617 531 HG23 ILE 95 HG23 ILE 62 -16.106 -18.699 2.277 532 HD11 ILE 95 HD11 ILE 62 -16.073 -21.345 4.982 533 HD12 ILE 95 HD12 ILE 62 -16.771 -21.185 3.354 534 HD13 ILE 95 HD13 ILE 62 -15.363 -20.205 3.839 535 H GLU 96 H GLU 63 -20.893 -18.155 2.976 536 HA GLU 96 HA GLU 63 -22.056 -19.742 5.224 537 HB2 GLU 96 HB2 GLU 63 -23.488 -17.745 3.418 538 HB3 GLU 96 HB3 GLU 63 -24.300 -19.004 4.354 539 HG2 GLU 96 HG2 GLU 63 -23.244 -18.069 6.443 540 HG3 GLU 96 HG3 GLU 63 -22.619 -16.729 5.478 541 H ALA 97 H ALA 64 -21.496 -21.711 4.422 542 HA ALA 97 HA ALA 64 -21.955 -22.483 1.617 543 HB1 ALA 97 HB1 ALA 64 -21.222 -24.109 4.083 544 HB2 ALA 97 HB2 ALA 64 -21.330 -24.720 2.413 545 HB3 ALA 97 HB3 ALA 64 -20.101 -23.507 2.830 546 H SER 98 H SER 65 -23.969 -22.800 0.938 547 HA SER 98 HA SER 65 -26.242 -22.911 2.757 548 HB2 SER 98 HB2 SER 65 -26.314 -21.661 0.625 549 HB3 SER 98 HB3 SER 65 -25.993 -23.150 -0.282 550 HG SER 98 HG SER 65 -28.233 -22.653 -0.217 551 H ARG 99 H ARG 66 -27.642 -24.672 2.885 552 HA ARG 99 HA ARG 66 -26.670 -27.330 2.849 553 HB2 ARG 99 HB2 ARG 66 -28.860 -28.063 3.294 554 HB3 ARG 99 HB3 ARG 66 -28.672 -26.542 4.133 555 HG2 ARG 99 HG2 ARG 66 -30.184 -26.972 1.503 556 HG3 ARG 99 HG3 ARG 66 -30.912 -26.871 3.089 557 HD2 ARG 99 HD2 ARG 66 -29.467 -24.602 1.682 558 HD3 ARG 99 HD3 ARG 66 -31.203 -24.801 1.839 559 HE ARG 99 HE ARG 66 -30.576 -24.858 4.421 560 HH11 ARG 99 HH11 ARG 66 -29.207 -22.608 1.990 561 HH12 ARG 99 HH12 ARG 66 -29.152 -21.277 3.094 562 HH21 ARG 99 HH21 ARG 66 -30.446 -23.090 5.863 563 HH22 ARG 99 HH22 ARG 66 -29.804 -21.577 5.346 564 H SER 100 H SER 67 -27.906 -25.388 0.188 565 HA SER 100 HA SER 67 -28.469 -27.494 -1.628 566 HB2 SER 100 HB2 SER 67 -27.520 -24.671 -2.260 567 HB3 SER 100 HB3 SER 67 -28.506 -25.743 -3.277 568 HG SER 100 HG SER 67 -29.833 -24.231 -2.209 569 H GLY 101 H GLY 68 -25.400 -26.633 -0.319 570 HA2 GLY 101 HA2 GLY 68 -23.345 -27.500 -0.806 571 HA3 GLY 101 HA3 GLY 68 -23.995 -28.323 -2.239 572 H GLU 102 H GLU 69 -24.239 -24.840 -1.459 573 HA GLU 102 HA GLU 69 -22.191 -24.124 -3.456 574 HB2 GLU 102 HB2 GLU 69 -24.943 -22.821 -3.128 575 HB3 GLU 102 HB3 GLU 69 -23.598 -22.137 -4.047 576 HG2 GLU 102 HG2 GLU 69 -23.605 -24.141 -5.537 577 HG3 GLU 102 HG3 GLU 69 -25.002 -24.772 -4.658 578 H ILE 103 H ILE 70 -21.432 -21.794 -2.808 579 HA ILE 103 HA ILE 70 -21.877 -21.212 0.033 580 HB ILE 103 HB ILE 70 -20.001 -22.578 0.261 581 HG12 ILE 103 HG12 ILE 70 -19.864 -20.226 1.305 582 HG13 ILE 103 HG13 ILE 70 -18.474 -21.291 1.343 583 HG21 ILE 103 HG21 ILE 70 -17.862 -22.334 -0.984 584 HG22 ILE 103 HG22 ILE 70 -19.219 -23.014 -1.895 585 HG23 ILE 103 HG23 ILE 70 -18.745 -21.322 -2.150 586 HD11 ILE 103 HD11 ILE 70 -18.704 -19.192 -0.842 587 HD12 ILE 103 HD12 ILE 70 -18.045 -18.822 0.742 588 HD13 ILE 103 HD13 ILE 70 -17.272 -20.050 -0.266 589 H VAL 104 H VAL 71 -21.889 -19.141 0.505 590 HA VAL 104 HA VAL 71 -21.370 -17.182 -1.678 591 HB VAL 104 HB VAL 71 -23.185 -16.839 0.749 592 HG11 VAL 104 HG11 VAL 71 -22.450 -14.775 -0.391 593 HG12 VAL 104 HG12 VAL 71 -23.034 -15.411 -1.955 594 HG13 VAL 104 HG13 VAL 71 -24.176 -15.040 -0.644 595 HG21 VAL 104 HG21 VAL 71 -24.166 -18.721 -0.476 596 HG22 VAL 104 HG22 VAL 71 -25.130 -17.260 -0.740 597 HG23 VAL 104 HG23 VAL 71 -24.030 -17.836 -2.006 598 H CYS 105 H CYS 72 -19.795 -15.677 -1.238 599 HA CYS 105 HA CYS 72 -18.365 -15.897 1.347 600 HB2 CYS 105 HB2 CYS 72 -17.489 -14.348 -1.121 601 HB3 CYS 105 HB3 CYS 72 -16.476 -15.029 0.160 602 HG CYS 105 HG CYS 72 -18.172 -16.462 -2.297 603 H TYR 106 H TYR 73 -17.825 -14.000 2.558 604 HA TYR 106 HA TYR 73 -19.117 -11.410 1.873 605 HB2 TYR 106 HB2 TYR 73 -19.472 -13.046 4.417 606 HB3 TYR 106 HB3 TYR 73 -19.940 -11.356 4.271 607 HD1 TYR 106 HD1 TYR 73 -21.670 -10.681 2.510 608 HD2 TYR 106 HD2 TYR 73 -20.920 -14.789 3.684 609 HE1 TYR 106 HE1 TYR 73 -23.945 -11.287 1.810 610 HE2 TYR 106 HE2 TYR 73 -23.158 -15.428 2.867 611 HH TYR 106 HH TYR 73 -25.492 -13.047 1.483 612 H ALA 107 H ALA 74 -18.363 -9.713 3.517 613 HA ALA 107 HA ALA 74 -15.477 -10.142 4.133 614 HB1 ALA 107 HB1 ALA 74 -17.181 -7.608 4.310 615 HB2 ALA 107 HB2 ALA 74 -15.413 -7.742 4.482 616 HB3 ALA 107 HB3 ALA 74 -16.154 -8.061 2.930 617 H VAL 108 H VAL 75 -14.725 -9.353 6.232 618 HA VAL 108 HA VAL 75 -16.745 -9.045 8.376 619 HB VAL 108 HB VAL 75 -15.076 -11.394 8.017 620 HG11 VAL 108 HG11 VAL 75 -13.439 -10.352 9.544 621 HG12 VAL 108 HG12 VAL 75 -14.717 -10.125 10.755 622 HG13 VAL 108 HG13 VAL 75 -14.231 -11.756 10.252 623 HG21 VAL 108 HG21 VAL 75 -17.494 -11.354 8.574 624 HG22 VAL 108 HG22 VAL 75 -16.552 -12.316 9.726 625 HG23 VAL 108 HG23 VAL 75 -17.106 -10.685 10.170 626 H ALA 109 H ALA 76 -13.479 -8.323 7.157 627 HA ALA 109 HA ALA 76 -13.458 -5.931 8.837 628 HB1 ALA 109 HB1 ALA 76 -11.230 -6.294 9.725 629 HB2 ALA 109 HB2 ALA 76 -12.246 -7.654 10.237 630 HB3 ALA 109 HB3 ALA 76 -11.086 -7.842 8.895 Start of MODEL 20 1 H1 GLY -2 H1 GLY -2 6.601 0.816 -0.974 2 H2 GLY -2 H2 GLY -2 6.292 0.505 0.604 3 H3 GLY -2 H3 GLY -2 7.842 0.566 0.066 4 HA2 GLY -2 HA2 GLY -2 7.514 -1.376 -1.306 5 HA3 GLY -2 HA3 GLY -2 7.214 -1.710 0.408 6 H HIS -1 H HIS -1 6.107 -2.766 -2.336 7 HA HIS -1 HA HIS -1 3.241 -2.274 -2.245 8 HB2 HIS -1 HB2 HIS -1 4.685 -3.033 -4.220 9 HB3 HIS -1 HB3 HIS -1 4.581 -4.651 -3.529 10 HD2 HIS -1 HD2 HIS -1 3.375 -4.834 -6.098 11 HE1 HIS -1 HE1 HIS -1 -0.463 -3.608 -4.719 12 HE2 HIS -1 HE2 HIS -1 0.794 -4.745 -6.621 13 H MET 34 H MET 1 1.731 -4.185 -1.927 14 HA MET 34 HA MET 1 1.937 -5.359 0.695 15 HB2 MET 34 HB2 MET 1 0.157 -5.999 -1.701 16 HB3 MET 34 HB3 MET 1 -0.024 -6.717 -0.093 17 HG2 MET 34 HG2 MET 1 -0.251 -4.390 0.816 18 HG3 MET 34 HG3 MET 1 -0.350 -3.787 -0.837 19 HE1 MET 34 HE1 MET 1 -3.093 -3.900 -2.188 20 HE2 MET 34 HE2 MET 1 -2.075 -5.315 -2.524 21 HE3 MET 34 HE3 MET 1 -3.763 -5.540 -2.012 22 H LEU 35 H LEU 2 2.306 -7.540 1.253 23 HA LEU 35 HA LEU 2 4.148 -9.108 -0.430 24 HB2 LEU 35 HB2 LEU 2 2.782 -9.534 2.267 25 HB3 LEU 35 HB3 LEU 2 3.508 -10.873 1.403 26 HG LEU 35 HG LEU 2 5.701 -9.765 1.383 27 HD11 LEU 35 HD11 LEU 2 5.123 -7.392 1.519 28 HD12 LEU 35 HD12 LEU 2 4.375 -7.635 3.120 29 HD13 LEU 35 HD13 LEU 2 6.129 -7.826 2.901 30 HD21 LEU 35 HD21 LEU 2 4.453 -10.038 4.155 31 HD22 LEU 35 HD22 LEU 2 5.117 -11.355 3.163 32 HD23 LEU 35 HD23 LEU 2 6.186 -10.101 3.778 33 H GLU 36 H GLU 3 3.455 -11.313 -1.287 34 HA GLU 36 HA GLU 3 1.208 -10.935 -2.883 35 HB2 GLU 36 HB2 GLU 3 3.042 -12.493 -3.425 36 HB3 GLU 36 HB3 GLU 3 2.506 -13.596 -2.146 37 HG2 GLU 36 HG2 GLU 3 0.394 -14.001 -3.299 38 HG3 GLU 36 HG3 GLU 3 0.793 -12.787 -4.519 39 H ALA 37 H ALA 4 1.381 -12.836 0.115 40 HA ALA 37 HA ALA 4 -1.315 -13.787 -0.213 41 HB1 ALA 37 HB1 ALA 4 0.325 -15.056 1.105 42 HB2 ALA 37 HB2 ALA 4 0.310 -13.782 2.354 43 HB3 ALA 37 HB3 ALA 4 -1.165 -14.722 2.003 44 H ASP 38 H ASP 5 0.133 -10.979 1.427 45 HA ASP 38 HA ASP 5 -2.292 -10.201 2.802 46 HB2 ASP 38 HB2 ASP 5 0.013 -9.511 3.489 47 HB3 ASP 38 HB3 ASP 5 0.091 -8.483 2.045 48 H LEU 39 H LEU 6 -0.804 -9.452 -0.354 49 HA LEU 39 HA LEU 6 -2.516 -7.393 -1.206 50 HB2 LEU 39 HB2 LEU 6 -0.440 -8.042 -2.361 51 HB3 LEU 39 HB3 LEU 6 -1.136 -9.571 -2.842 52 HG LEU 39 HG LEU 6 -2.549 -7.046 -3.687 53 HD11 LEU 39 HD11 LEU 6 -0.103 -8.205 -5.080 54 HD12 LEU 39 HD12 LEU 6 -1.132 -6.889 -5.685 55 HD13 LEU 39 HD13 LEU 6 -0.170 -6.654 -4.219 56 HD21 LEU 39 HD21 LEU 6 -2.994 -8.377 -5.758 57 HD22 LEU 39 HD22 LEU 6 -2.185 -9.765 -5.011 58 HD23 LEU 39 HD23 LEU 6 -3.684 -9.099 -4.325 59 H VAL 40 H VAL 7 -2.721 -10.923 -1.833 60 HA VAL 40 HA VAL 7 -5.212 -10.622 -3.140 61 HB VAL 40 HB VAL 7 -5.302 -13.087 -3.100 62 HG11 VAL 40 HG11 VAL 7 -2.467 -12.111 -3.645 63 HG12 VAL 40 HG12 VAL 7 -3.311 -13.480 -4.388 64 HG13 VAL 40 HG13 VAL 7 -3.847 -11.835 -4.709 65 HG21 VAL 40 HG21 VAL 7 -3.573 -14.433 -2.011 66 HG22 VAL 40 HG22 VAL 7 -2.906 -12.975 -1.276 67 HG23 VAL 40 HG23 VAL 7 -4.510 -13.551 -0.814 68 H SER 41 H SER 8 -4.443 -11.303 0.302 69 HA SER 41 HA SER 8 -7.115 -11.772 1.110 70 HB2 SER 41 HB2 SER 8 -4.812 -10.592 2.718 71 HB3 SER 41 HB3 SER 8 -6.322 -11.241 3.377 72 HG SER 41 HG SER 8 -4.202 -12.602 2.077 73 H LYS 42 H LYS 9 -5.273 -8.594 1.071 74 HA LYS 42 HA LYS 9 -7.527 -7.111 2.134 75 HB2 LYS 42 HB2 LYS 9 -4.978 -6.337 0.669 76 HB3 LYS 42 HB3 LYS 9 -6.242 -5.152 1.019 77 HG2 LYS 42 HG2 LYS 9 -6.135 -5.710 3.437 78 HG3 LYS 42 HG3 LYS 9 -4.810 -6.857 3.103 79 HD2 LYS 42 HD2 LYS 9 -3.392 -5.085 2.286 80 HD3 LYS 42 HD3 LYS 9 -4.706 -3.904 2.341 81 HE2 LYS 42 HE2 LYS 9 -3.260 -3.458 4.141 82 HE3 LYS 42 HE3 LYS 9 -4.752 -4.122 4.822 83 HZ1 LYS 42 HZ1 LYS 9 -2.666 -5.033 5.797 84 HZ2 LYS 42 HZ2 LYS 9 -3.596 -6.223 5.154 85 HZ3 LYS 42 HZ3 LYS 9 -2.274 -5.712 4.348 86 H MET 43 H MET 10 -6.452 -7.800 -1.277 87 HA MET 43 HA MET 10 -8.539 -6.101 -2.339 88 HB2 MET 43 HB2 MET 10 -6.848 -8.272 -3.624 89 HB3 MET 43 HB3 MET 10 -8.032 -7.286 -4.502 90 HG2 MET 43 HG2 MET 10 -6.851 -5.214 -3.598 91 HG3 MET 43 HG3 MET 10 -5.573 -6.291 -3.013 92 HE1 MET 43 HE1 MET 10 -3.658 -4.909 -4.423 93 HE2 MET 43 HE2 MET 10 -3.959 -4.373 -6.083 94 HE3 MET 43 HE3 MET 10 -4.997 -3.781 -4.765 95 H LEU 44 H LEU 11 -8.393 -9.654 -1.764 96 HA LEU 44 HA LEU 11 -10.986 -10.415 -2.558 97 HB2 LEU 44 HB2 LEU 11 -9.343 -12.029 -1.747 98 HB3 LEU 44 HB3 LEU 11 -9.176 -11.179 -0.227 99 HG LEU 44 HG LEU 11 -11.554 -11.832 0.339 100 HD11 LEU 44 HD11 LEU 11 -12.384 -13.835 -0.859 101 HD12 LEU 44 HD12 LEU 11 -12.349 -12.398 -1.907 102 HD13 LEU 44 HD13 LEU 11 -11.084 -13.655 -2.058 103 HD21 LEU 44 HD21 LEU 11 -10.881 -14.126 0.973 104 HD22 LEU 44 HD22 LEU 11 -9.417 -13.949 -0.007 105 HD23 LEU 44 HD23 LEU 11 -9.669 -12.900 1.394 106 H ARG 45 H ARG 12 -9.941 -9.240 0.643 107 HA ARG 45 HA ARG 12 -12.444 -8.941 1.854 108 HB2 ARG 45 HB2 ARG 12 -10.522 -8.913 3.129 109 HB3 ARG 45 HB3 ARG 12 -9.711 -7.700 2.172 110 HG2 ARG 45 HG2 ARG 12 -12.189 -6.889 3.665 111 HG3 ARG 45 HG3 ARG 12 -10.676 -7.168 4.530 112 HD2 ARG 45 HD2 ARG 12 -9.587 -5.556 2.779 113 HD3 ARG 45 HD3 ARG 12 -11.264 -5.015 2.514 114 HE ARG 45 HE ARG 12 -10.437 -5.320 5.293 115 HH11 ARG 45 HH21 ARG 12 -10.243 -2.896 2.692 116 HH12 ARG 45 HH22 ARG 12 -10.388 -1.560 3.777 117 HH21 ARG 45 HH11 ARG 12 -10.799 -3.697 6.633 118 HH22 ARG 45 HH12 ARG 12 -10.624 -2.010 6.164 119 H ALA 46 H ALA 13 -10.691 -6.486 -0.168 120 HA ALA 46 HA ALA 13 -12.666 -4.541 0.375 121 HB1 ALA 46 HB1 ALA 13 -11.600 -3.267 -1.483 122 HB2 ALA 46 HB2 ALA 13 -10.363 -4.007 -0.441 123 HB3 ALA 46 HB3 ALA 13 -10.757 -4.734 -2.017 124 H VAL 47 H VAL 14 -12.414 -6.900 -2.338 125 HA VAL 47 HA VAL 14 -14.723 -5.938 -3.742 126 HB VAL 47 HB VAL 14 -13.531 -8.744 -3.526 127 HG11 VAL 47 HG11 VAL 14 -15.576 -7.705 -5.536 128 HG12 VAL 47 HG12 VAL 14 -14.779 -9.296 -5.565 129 HG13 VAL 47 HG13 VAL 14 -15.897 -8.894 -4.259 130 HG21 VAL 47 HG21 VAL 14 -11.999 -7.156 -4.567 131 HG22 VAL 47 HG22 VAL 14 -12.686 -8.156 -5.846 132 HG23 VAL 47 HG23 VAL 14 -13.288 -6.510 -5.602 133 H LEU 48 H LEU 15 -14.365 -8.277 -1.025 134 HA LEU 48 HA LEU 15 -17.148 -8.896 -0.905 135 HB2 LEU 48 HB2 LEU 15 -14.997 -9.023 1.264 136 HB3 LEU 48 HB3 LEU 15 -16.581 -9.768 1.374 137 HG LEU 48 HG LEU 15 -14.755 -10.497 -0.943 138 HD11 LEU 48 HD11 LEU 15 -14.806 -11.660 1.872 139 HD12 LEU 48 HD12 LEU 15 -13.982 -12.391 0.472 140 HD13 LEU 48 HD13 LEU 15 -13.460 -10.805 1.085 141 HD21 LEU 48 HD21 LEU 15 -16.058 -12.529 -0.928 142 HD22 LEU 48 HD22 LEU 15 -16.926 -12.020 0.530 143 HD23 LEU 48 HD23 LEU 15 -17.171 -11.150 -0.992 144 H GLN 49 H GLN 16 -15.258 -6.325 0.761 145 HA GLN 49 HA GLN 16 -17.433 -5.403 2.399 146 HB2 GLN 49 HB2 GLN 16 -14.890 -4.083 1.359 147 HB3 GLN 49 HB3 GLN 16 -16.024 -3.236 2.392 148 HG2 GLN 49 HG2 GLN 16 -14.628 -5.828 3.188 149 HG3 GLN 49 HG3 GLN 16 -14.070 -4.218 3.602 150 HE21 GLN 49 HE22 GLN 16 -14.389 -5.753 5.754 151 HE22 GLN 49 HE21 GLN 16 -15.876 -5.368 6.605 152 H SER 50 H SER 17 -16.428 -4.674 -0.964 153 HA SER 50 HA SER 17 -18.363 -2.564 -1.373 154 HB2 SER 50 HB2 SER 17 -16.999 -4.405 -3.386 155 HB3 SER 50 HB3 SER 17 -17.837 -2.886 -3.743 156 HG SER 50 HG SER 17 -15.418 -3.256 -2.251 157 H HIS 51 H HIS 18 -18.409 -6.104 -1.695 158 HA HIS 51 HA HIS 18 -21.101 -6.065 -2.921 159 HB2 HIS 51 HB2 HIS 18 -18.964 -8.211 -2.736 160 HB3 HIS 51 HB3 HIS 18 -20.532 -8.392 -3.512 161 HD2 HIS 51 HD2 HIS 18 -18.925 -9.017 -5.652 162 HE1 HIS 51 HE1 HIS 18 -18.114 -4.996 -6.736 163 HE2 HIS 51 HE2 HIS 18 -18.080 -7.390 -7.559 164 H LYS 52 H LYS 19 -21.776 -5.411 -0.531 165 HA LYS 52 HA LYS 19 -21.642 -7.345 1.541 166 HB2 LYS 52 HB2 LYS 19 -23.624 -5.083 1.018 167 HB3 LYS 52 HB3 LYS 19 -23.642 -6.037 2.492 168 HG2 LYS 52 HG2 LYS 19 -21.290 -4.345 1.546 169 HG3 LYS 52 HG3 LYS 19 -22.484 -3.888 2.762 170 HD2 LYS 52 HD2 LYS 19 -21.774 -5.923 4.127 171 HD3 LYS 52 HD3 LYS 19 -20.502 -6.202 2.947 172 HE2 LYS 52 HE2 LYS 19 -19.472 -5.056 4.757 173 HE3 LYS 52 HE3 LYS 19 -19.553 -3.928 3.405 174 HZ1 LYS 52 HZ1 LYS 19 -21.450 -2.851 4.495 175 HZ2 LYS 52 HZ2 LYS 19 -21.438 -3.951 5.711 176 HZ3 LYS 52 HZ3 LYS 19 -20.190 -2.921 5.532 177 H ASN 53 H ASN 20 -23.801 -7.349 -1.214 178 HA ASN 53 HA ASN 20 -25.740 -9.168 -0.158 179 HB2 ASN 53 HB2 ASN 20 -25.996 -7.920 -2.297 180 HB3 ASN 53 HB3 ASN 20 -24.694 -8.887 -3.008 181 HD21 ASN 53 HD22 ASN 20 -27.926 -9.275 -1.376 182 HD22 ASN 53 HD21 ASN 20 -28.393 -10.671 -2.319 183 H GLY 54 H GLY 21 -22.374 -9.643 -0.773 184 HA2 GLY 54 HA2 GLY 21 -21.051 -11.412 -0.477 185 HA3 GLY 54 HA3 GLY 21 -22.442 -12.485 -0.232 186 H ILE 55 H ILE 22 -20.339 -13.382 -1.733 187 HA ILE 55 HA ILE 22 -21.470 -13.576 -4.473 188 HB ILE 55 HB ILE 22 -19.004 -13.487 -5.260 189 HG12 ILE 55 HG12 ILE 22 -18.639 -12.035 -2.591 190 HG13 ILE 55 HG13 ILE 22 -17.739 -13.399 -3.241 191 HG21 ILE 55 HG21 ILE 22 -20.895 -11.807 -5.653 192 HG22 ILE 55 HG22 ILE 22 -20.166 -10.845 -4.362 193 HG23 ILE 55 HG23 ILE 22 -19.226 -11.244 -5.845 194 HD11 ILE 55 HD11 ILE 22 -16.949 -11.729 -5.087 195 HD12 ILE 55 HD12 ILE 22 -17.674 -10.467 -4.075 196 HD13 ILE 55 HD13 ILE 22 -16.347 -11.454 -3.441 197 H VAL 56 H VAL 23 -21.705 -15.564 -5.067 198 HA VAL 56 HA VAL 23 -20.959 -17.814 -3.516 199 HB VAL 56 HB VAL 23 -21.580 -19.069 -5.596 200 HG11 VAL 56 HG11 VAL 23 -23.967 -18.454 -5.522 201 HG12 VAL 56 HG12 VAL 23 -23.244 -18.584 -3.915 202 HG13 VAL 56 HG13 VAL 23 -23.557 -16.980 -4.624 203 HG21 VAL 56 HG21 VAL 23 -22.585 -17.900 -7.495 204 HG22 VAL 56 HG22 VAL 23 -22.209 -16.318 -6.794 205 HG23 VAL 56 HG23 VAL 23 -20.906 -17.400 -7.310 206 H LEU 57 H LEU 24 -19.122 -19.277 -3.736 207 HA LEU 57 HA LEU 24 -16.795 -18.155 -4.265 208 HB2 LEU 57 HB2 LEU 24 -15.594 -19.997 -3.970 209 HB3 LEU 57 HB3 LEU 24 -17.084 -20.315 -3.154 210 HG LEU 57 HG LEU 24 -17.732 -21.820 -5.149 211 HD11 LEU 57 HD11 LEU 24 -16.348 -21.362 -7.014 212 HD12 LEU 57 HD12 LEU 24 -14.926 -21.060 -6.006 213 HD13 LEU 57 HD13 LEU 24 -15.505 -22.711 -6.313 214 HD21 LEU 57 HD21 LEU 24 -15.257 -22.439 -3.490 215 HD22 LEU 57 HD22 LEU 24 -16.937 -22.788 -3.091 216 HD23 LEU 57 HD23 LEU 24 -16.183 -23.656 -4.406 217 HA PRO 58 HA PRO 25 -16.167 -19.186 -8.847 218 HB2 PRO 58 HB2 PRO 25 -18.298 -19.345 -10.581 219 HB3 PRO 58 HB3 PRO 25 -17.575 -20.755 -9.746 220 HG2 PRO 58 HG2 PRO 25 -20.041 -19.180 -8.959 221 HG3 PRO 58 HG3 PRO 25 -19.829 -20.955 -9.034 222 HD2 PRO 58 HD2 PRO 25 -19.628 -19.596 -6.700 223 HD3 PRO 58 HD3 PRO 25 -18.591 -20.998 -7.041 224 H ARG 59 H ARG 26 -19.073 -17.253 -8.058 225 HA ARG 59 HA ARG 26 -18.464 -15.023 -9.822 226 HB2 ARG 59 HB2 ARG 26 -20.723 -15.525 -8.846 227 HB3 ARG 59 HB3 ARG 26 -20.097 -15.095 -7.236 228 HG2 ARG 59 HG2 ARG 26 -19.680 -12.801 -7.991 229 HG3 ARG 59 HG3 ARG 26 -20.196 -13.238 -9.637 230 HD2 ARG 59 HD2 ARG 26 -22.467 -13.715 -8.799 231 HD3 ARG 59 HD3 ARG 26 -21.963 -13.288 -7.149 232 HE ARG 59 HE ARG 26 -21.314 -11.111 -8.828 233 HH11 ARG 59 HH11 ARG 26 -24.280 -12.722 -7.700 234 HH12 ARG 59 HH12 ARG 26 -25.237 -11.291 -7.744 235 HH21 ARG 59 HH21 ARG 26 -22.603 -9.201 -8.896 236 HH22 ARG 59 HH22 ARG 26 -24.267 -9.257 -8.440 237 H LEU 60 H LEU 27 -17.521 -15.987 -6.510 238 HA LEU 60 HA LEU 27 -16.275 -13.609 -5.739 239 HB2 LEU 60 HB2 LEU 27 -16.581 -15.528 -4.190 240 HB3 LEU 60 HB3 LEU 27 -15.327 -16.442 -4.996 241 HG LEU 60 HG LEU 27 -14.416 -13.707 -4.311 242 HD11 LEU 60 HD11 LEU 27 -14.987 -15.677 -2.083 243 HD12 LEU 60 HD12 LEU 27 -14.248 -14.063 -1.945 244 HD13 LEU 60 HD13 LEU 27 -15.924 -14.199 -2.427 245 HD21 LEU 60 HD21 LEU 27 -12.461 -14.949 -3.478 246 HD22 LEU 60 HD22 LEU 27 -13.278 -16.485 -3.823 247 HD23 LEU 60 HD23 LEU 27 -12.838 -15.381 -5.142 248 H GLN 61 H GLN 28 -14.792 -16.492 -7.396 249 HA GLN 61 HA GLN 28 -12.261 -15.401 -7.893 250 HB2 GLN 61 HB2 GLN 28 -13.968 -17.496 -9.192 251 HB3 GLN 61 HB3 GLN 28 -12.627 -16.896 -10.143 252 HG2 GLN 61 HG2 GLN 28 -12.057 -17.718 -7.287 253 HG3 GLN 61 HG3 GLN 28 -12.369 -18.972 -8.483 254 HE21 GLN 61 HE22 GLN 28 -10.418 -19.773 -9.407 255 HE22 GLN 61 HE21 GLN 28 -9.018 -18.784 -9.717 256 H GLY 62 H GLY 29 -15.201 -15.032 -9.981 257 HA2 GLY 62 HA2 GLY 29 -13.990 -13.549 -12.028 258 HA3 GLY 62 HA3 GLY 29 -15.681 -13.399 -11.533 259 H GLU 63 H GLU 30 -15.777 -12.181 -9.185 260 HA GLU 63 HA GLU 30 -15.168 -9.480 -9.899 261 HB2 GLU 63 HB2 GLU 30 -16.094 -10.717 -7.265 262 HB3 GLU 63 HB3 GLU 30 -16.049 -8.983 -7.601 263 HG2 GLU 63 HG2 GLU 30 -17.732 -11.023 -9.117 264 HG3 GLU 63 HG3 GLU 30 -18.311 -9.938 -7.869 265 H TYR 64 H TYR 31 -13.671 -11.716 -7.552 266 HA TYR 64 HA TYR 31 -11.731 -10.028 -6.360 267 HB2 TYR 64 HB2 TYR 31 -12.084 -12.231 -5.484 268 HB3 TYR 64 HB3 TYR 31 -11.830 -12.969 -7.066 269 HD1 TYR 64 HD1 TYR 31 -10.048 -11.501 -4.167 270 HD2 TYR 64 HD2 TYR 31 -9.722 -13.408 -8.025 271 HE1 TYR 64 HE1 TYR 31 -7.643 -11.967 -3.741 272 HE2 TYR 64 HE2 TYR 31 -7.343 -13.780 -7.634 273 HH TYR 64 HH TYR 31 -5.552 -13.516 -6.261 274 H ARG 65 H ARG 32 -11.529 -12.052 -9.364 275 HA ARG 65 HA ARG 32 -8.876 -11.229 -9.862 276 HB2 ARG 65 HB2 ARG 32 -9.982 -13.320 -10.693 277 HB3 ARG 65 HB3 ARG 32 -10.840 -12.357 -11.904 278 HG2 ARG 65 HG2 ARG 32 -7.924 -11.800 -11.840 279 HG3 ARG 65 HG3 ARG 32 -8.261 -13.508 -12.065 280 HD2 ARG 65 HD2 ARG 32 -9.657 -12.970 -14.034 281 HD3 ARG 65 HD3 ARG 32 -9.298 -11.240 -13.800 282 HE ARG 65 HE ARG 32 -6.874 -12.670 -13.792 283 HH11 ARG 65 HH21 ARG 32 -9.429 -11.864 -16.129 284 HH12 ARG 65 HH22 ARG 32 -8.392 -11.899 -17.510 285 HH21 ARG 65 HH11 ARG 32 -5.461 -12.681 -15.635 286 HH22 ARG 65 HH12 ARG 32 -6.082 -12.379 -17.214 287 H SER 66 H SER 33 -12.011 -9.825 -10.950 288 HA SER 66 HA SER 33 -10.916 -7.973 -12.777 289 HB2 SER 66 HB2 SER 33 -13.273 -7.598 -10.883 290 HB3 SER 66 HB3 SER 33 -12.900 -6.603 -12.296 291 HG SER 66 HG SER 33 -14.434 -8.211 -12.848 292 H LEU 67 H LEU 34 -11.081 -7.821 -9.142 293 HA LEU 67 HA LEU 34 -9.921 -5.157 -9.191 294 HB2 LEU 67 HB2 LEU 34 -11.337 -5.888 -7.332 295 HB3 LEU 67 HB3 LEU 34 -10.139 -7.104 -6.872 296 HG LEU 67 HG LEU 34 -8.483 -5.339 -6.399 297 HD11 LEU 67 HD11 LEU 34 -9.103 -3.547 -7.946 298 HD12 LEU 67 HD12 LEU 34 -10.693 -3.378 -7.161 299 HD13 LEU 67 HD13 LEU 34 -9.206 -2.927 -6.303 300 HD21 LEU 67 HD21 LEU 34 -10.019 -6.064 -4.616 301 HD22 LEU 67 HD22 LEU 34 -9.514 -4.382 -4.406 302 HD23 LEU 67 HD23 LEU 34 -11.142 -4.762 -5.037 303 H THR 68 H THR 35 -8.490 -8.452 -8.415 304 HA THR 68 HA THR 35 -5.924 -7.286 -7.757 305 HB THR 68 HB THR 35 -5.244 -9.771 -7.900 306 HG1 THR 68 HG1 THR 35 -7.013 -11.213 -8.157 307 HG21 THR 68 HG21 THR 35 -5.955 -8.732 -5.764 308 HG22 THR 68 HG22 THR 35 -7.652 -9.170 -6.146 309 HG23 THR 68 HG23 THR 35 -6.407 -10.420 -5.898 310 H GLY 69 H GLY 36 -7.294 -8.767 -10.714 311 HA2 GLY 69 HA2 GLY 36 -6.428 -8.878 -12.846 312 HA3 GLY 69 HA3 GLY 36 -4.949 -8.049 -12.328 313 H ASP 70 H ASP 37 -6.100 -10.772 -10.377 314 HA ASP 70 HA ASP 37 -4.315 -12.734 -11.666 315 HB2 ASP 70 HB2 ASP 37 -3.022 -11.492 -9.837 316 HB3 ASP 70 HB3 ASP 37 -4.201 -12.116 -8.671 317 H TRP 71 H TRP 38 -4.941 -14.951 -10.917 318 HA TRP 71 HA TRP 38 -7.781 -15.085 -10.060 319 HB2 TRP 71 HB2 TRP 38 -5.830 -17.258 -10.933 320 HB3 TRP 71 HB3 TRP 38 -7.548 -17.466 -10.596 321 HD1 TRP 71 HD1 TRP 38 -5.208 -16.719 -13.366 322 HE1 TRP 71 HE1 TRP 38 -6.453 -16.194 -15.523 323 HE3 TRP 71 HE3 TRP 38 -9.879 -15.955 -11.408 324 HZ2 TRP 71 HZ2 TRP 38 -9.161 -15.505 -16.319 325 HZ3 TRP 71 HZ3 TRP 38 -11.742 -15.261 -12.881 326 HH2 TRP 71 HH2 TRP 38 -11.416 -15.092 -15.341 327 H ILE 72 H ILE 39 -8.331 -16.550 -8.258 328 HA ILE 72 HA ILE 39 -7.006 -15.917 -5.901 329 HB ILE 72 HB ILE 39 -8.893 -18.164 -6.616 330 HG12 ILE 72 HG12 ILE 39 -9.663 -15.699 -6.536 331 HG13 ILE 72 HG13 ILE 39 -10.614 -16.916 -5.705 332 HG21 ILE 72 HG21 ILE 39 -7.692 -19.112 -4.825 333 HG22 ILE 72 HG22 ILE 39 -7.742 -17.626 -3.861 334 HG23 ILE 72 HG23 ILE 39 -9.221 -18.561 -4.148 335 HD11 ILE 72 HD11 ILE 39 -10.288 -14.745 -4.466 336 HD12 ILE 72 HD12 ILE 39 -9.929 -16.223 -3.568 337 HD13 ILE 72 HD13 ILE 39 -8.591 -15.219 -4.218 338 HA PRO 73 HA PRO 40 -3.584 -18.781 -6.363 339 HB2 PRO 73 HB2 PRO 40 -1.954 -17.998 -4.375 340 HB3 PRO 73 HB3 PRO 40 -2.367 -16.886 -5.691 341 HG2 PRO 73 HG2 PRO 40 -3.735 -17.087 -2.991 342 HG3 PRO 73 HG3 PRO 40 -3.026 -15.636 -3.778 343 HD2 PRO 73 HD2 PRO 40 -5.695 -16.280 -3.952 344 HD3 PRO 73 HD3 PRO 40 -4.817 -15.493 -5.294 345 H PHE 74 H PHE 41 -5.903 -20.110 -5.378 346 HA PHE 74 HA PHE 41 -5.713 -20.871 -2.607 347 HB2 PHE 74 HB2 PHE 41 -7.462 -22.416 -2.986 348 HB3 PHE 74 HB3 PHE 41 -7.878 -20.945 -3.790 349 HD1 PHE 74 HD2 PHE 41 -7.602 -20.837 -6.400 350 HD2 PHE 74 HD1 PHE 41 -7.374 -24.485 -4.111 351 HE1 PHE 74 HE2 PHE 41 -8.078 -22.145 -8.441 352 HE2 PHE 74 HE1 PHE 41 -7.905 -25.794 -6.165 353 HZ PHE 74 HZ PHE 41 -8.251 -24.625 -8.328 354 H LYS 75 H LYS 42 -5.106 -22.881 -5.526 355 HA LYS 75 HA LYS 42 -3.891 -24.990 -4.002 356 HB2 LYS 75 HB2 LYS 42 -5.131 -25.048 -6.239 357 HB3 LYS 75 HB3 LYS 42 -3.667 -24.408 -6.985 358 HG2 LYS 75 HG2 LYS 42 -2.405 -26.419 -6.189 359 HG3 LYS 75 HG3 LYS 42 -3.868 -27.017 -5.381 360 HD2 LYS 75 HD2 LYS 42 -5.023 -27.175 -7.552 361 HD3 LYS 75 HD3 LYS 42 -3.576 -26.545 -8.383 362 HE2 LYS 75 HE2 LYS 42 -2.262 -28.489 -7.533 363 HE3 LYS 75 HE3 LYS 42 -3.710 -29.117 -6.730 364 HZ1 LYS 75 HZ1 LYS 42 -3.359 -30.200 -8.857 365 HZ2 LYS 75 HZ2 LYS 42 -4.742 -29.340 -8.933 366 HZ3 LYS 75 HZ3 LYS 42 -3.387 -28.782 -9.666 367 H GLN 76 H GLN 43 -2.746 -22.076 -5.478 368 HA GLN 76 HA GLN 43 0.022 -22.723 -5.767 369 HB2 GLN 76 HB2 GLN 43 -1.351 -19.999 -5.609 370 HB3 GLN 76 HB3 GLN 43 0.247 -20.338 -6.235 371 HG2 GLN 76 HG2 GLN 43 -0.889 -20.183 -8.204 372 HG3 GLN 76 HG3 GLN 43 -1.040 -21.913 -7.957 373 HE21 GLN 76 HE22 GLN 43 -2.816 -19.587 -9.320 374 HE22 GLN 76 HE21 GLN 43 -4.407 -19.917 -8.648 375 H LEU 77 H LEU 44 -1.922 -21.054 -3.212 376 HA LEU 77 HA LEU 44 0.357 -20.794 -1.385 377 HB2 LEU 77 HB2 LEU 44 -2.609 -20.369 -1.062 378 HB3 LEU 77 HB3 LEU 44 -1.446 -20.168 0.248 379 HG LEU 77 HG LEU 44 -1.396 -18.593 -2.347 380 HD11 LEU 77 HD11 LEU 44 -2.292 -17.662 0.416 381 HD12 LEU 77 HD12 LEU 44 -2.268 -16.692 -1.071 382 HD13 LEU 77 HD13 LEU 44 -3.377 -18.063 -0.939 383 HD21 LEU 77 HD21 LEU 44 0.849 -18.674 -1.371 384 HD22 LEU 77 HD22 LEU 44 0.157 -17.069 -1.137 385 HD23 LEU 77 HD23 LEU 44 0.199 -18.208 0.218 386 H GLY 78 H GLY 45 -2.159 -23.195 -2.079 387 HA2 GLY 78 HA2 GLY 45 -1.352 -25.479 -1.718 388 HA3 GLY 78 HA3 GLY 45 -0.795 -25.013 -0.113 389 H TYR 79 H TYR 46 -3.841 -23.613 -0.972 390 HA TYR 79 HA TYR 46 -5.314 -25.294 0.928 391 HB2 TYR 79 HB2 TYR 46 -6.274 -23.053 -0.898 392 HB3 TYR 79 HB3 TYR 46 -7.138 -23.754 0.465 393 HD1 TYR 79 HD2 TYR 46 -6.127 -23.532 2.819 394 HD2 TYR 79 HD1 TYR 46 -4.758 -21.236 -0.566 395 HE1 TYR 79 HE2 TYR 46 -5.015 -21.969 4.336 396 HE2 TYR 79 HE1 TYR 46 -3.652 -19.637 0.952 397 HH TYR 79 HH TYR 46 -3.678 -20.023 4.536 398 HA PRO 80 HA PRO 47 -6.232 -27.944 -2.495 399 HB2 PRO 80 HB2 PRO 47 -8.483 -29.358 -1.655 400 HB3 PRO 80 HB3 PRO 47 -6.845 -29.600 -0.982 401 HG2 PRO 80 HG2 PRO 47 -9.056 -27.816 0.107 402 HG3 PRO 80 HG3 PRO 47 -8.107 -29.052 0.991 403 HD2 PRO 80 HD2 PRO 47 -7.366 -26.461 1.119 404 HD3 PRO 80 HD3 PRO 47 -6.120 -27.719 0.899 405 H THR 81 H THR 48 -8.883 -25.806 -1.396 406 HA THR 81 HA THR 48 -9.969 -25.727 -4.167 407 HB THR 81 HB THR 48 -12.240 -25.876 -2.994 408 HG1 THR 81 HG1 THR 48 -11.980 -26.948 -0.833 409 HG21 THR 81 HG21 THR 48 -10.581 -28.368 -2.449 410 HG22 THR 81 HG22 THR 48 -12.318 -28.254 -2.797 411 HG23 THR 81 HG23 THR 48 -11.135 -27.905 -4.071 412 H LEU 82 H LEU 49 -11.556 -23.927 -4.415 413 HA LEU 82 HA LEU 49 -10.601 -21.399 -3.433 414 HB2 LEU 82 HB2 LEU 49 -13.301 -22.263 -4.611 415 HB3 LEU 82 HB3 LEU 49 -12.966 -20.611 -4.163 416 HG LEU 82 HG LEU 49 -12.723 -20.802 -6.521 417 HD11 LEU 82 HD11 LEU 49 -10.455 -19.994 -6.885 418 HD12 LEU 82 HD12 LEU 49 -11.136 -19.319 -5.392 419 HD13 LEU 82 HD13 LEU 49 -9.935 -20.633 -5.331 420 HD21 LEU 82 HD21 LEU 49 -11.217 -22.242 -7.700 421 HD22 LEU 82 HD22 LEU 49 -10.566 -22.925 -6.207 422 HD23 LEU 82 HD23 LEU 49 -12.259 -23.249 -6.686 423 H GLU 83 H GLU 50 -13.240 -23.590 -2.326 424 HA GLU 83 HA GLU 50 -14.117 -21.806 -0.295 425 HB2 GLU 83 HB2 GLU 50 -15.289 -23.616 0.702 426 HB3 GLU 83 HB3 GLU 50 -15.481 -23.698 -1.042 427 HG2 GLU 83 HG2 GLU 50 -13.860 -25.549 -1.147 428 HG3 GLU 83 HG3 GLU 50 -13.583 -25.430 0.598 429 H ALA 84 H ALA 51 -11.562 -24.416 -0.187 430 HA ALA 84 HA ALA 51 -11.067 -24.121 2.581 431 HB1 ALA 84 HB1 ALA 51 -10.289 -26.020 1.286 432 HB2 ALA 84 HB2 ALA 51 -9.174 -24.979 0.370 433 HB3 ALA 84 HB3 ALA 51 -8.943 -25.234 2.124 434 H TYR 85 H TYR 52 -9.585 -22.374 -0.210 435 HA TYR 85 HA TYR 52 -7.789 -20.767 1.292 436 HB2 TYR 85 HB2 TYR 52 -7.618 -20.816 -1.073 437 HB3 TYR 85 HB3 TYR 52 -9.293 -20.341 -1.304 438 HD1 TYR 85 HD1 TYR 52 -5.956 -19.098 -0.146 439 HD2 TYR 85 HD2 TYR 52 -9.955 -18.059 -1.386 440 HE1 TYR 85 HE1 TYR 52 -5.277 -16.726 -0.259 441 HE2 TYR 85 HE2 TYR 52 -9.308 -15.685 -1.475 442 HH TYR 85 HH TYR 52 -7.553 -14.128 -1.318 443 H LEU 86 H LEU 53 -11.270 -20.151 0.419 444 HA LEU 86 HA LEU 53 -11.434 -17.719 1.881 445 HB2 LEU 86 HB2 LEU 53 -13.571 -19.691 0.994 446 HB3 LEU 86 HB3 LEU 53 -13.892 -18.061 1.590 447 HG LEU 86 HG LEU 53 -12.091 -18.493 -0.811 448 HD11 LEU 86 HD11 LEU 53 -15.099 -18.348 -0.749 449 HD12 LEU 86 HD12 LEU 53 -14.117 -18.040 -2.215 450 HD13 LEU 86 HD13 LEU 53 -14.092 -19.622 -1.434 451 HD21 LEU 86 HD21 LEU 53 -12.040 -16.276 0.286 452 HD22 LEU 86 HD22 LEU 53 -12.700 -16.225 -1.345 453 HD23 LEU 86 HD23 LEU 53 -13.797 -16.140 0.063 454 H ARG 87 H ARG 54 -12.026 -21.076 2.975 455 HA ARG 87 HA ARG 54 -13.058 -20.447 5.612 456 HB2 ARG 87 HB2 ARG 54 -11.387 -22.807 4.600 457 HB3 ARG 87 HB3 ARG 54 -11.695 -22.580 6.300 458 HG2 ARG 87 HG2 ARG 54 -13.228 -24.161 5.707 459 HG3 ARG 87 HG3 ARG 54 -14.173 -22.677 5.858 460 HD2 ARG 87 HD2 ARG 54 -14.395 -22.519 3.439 461 HD3 ARG 87 HD3 ARG 54 -13.054 -23.634 3.231 462 HE ARG 87 HE ARG 54 -14.499 -25.205 2.893 463 HH11 ARG 87 HH22 ARG 54 -15.860 -23.576 5.788 464 HH12 ARG 87 HH21 ARG 54 -17.227 -24.619 5.846 465 HH21 ARG 87 HH11 ARG 54 -16.338 -26.387 2.892 466 HH22 ARG 87 HH12 ARG 54 -17.463 -26.340 4.225 467 H SER 88 H SER 55 -9.770 -20.493 4.287 468 HA SER 88 HA SER 55 -8.474 -20.365 6.844 469 HB2 SER 88 HB2 SER 55 -7.378 -20.075 4.029 470 HB3 SER 88 HB3 SER 55 -6.441 -20.363 5.510 471 HG SER 88 HG SER 55 -8.292 -22.074 4.211 472 H VAL 89 H VAL 56 -10.207 -17.888 5.730 473 HA VAL 89 HA VAL 56 -8.296 -15.894 6.829 474 HB VAL 89 HB VAL 56 -8.155 -15.680 4.487 475 HG11 VAL 89 HG11 VAL 56 -10.221 -15.049 3.089 476 HG12 VAL 89 HG12 VAL 56 -9.967 -16.739 3.519 477 HG13 VAL 89 HG13 VAL 56 -11.167 -15.793 4.407 478 HG21 VAL 89 HG21 VAL 56 -8.622 -13.425 4.055 479 HG22 VAL 89 HG22 VAL 56 -9.956 -13.377 5.208 480 HG23 VAL 89 HG23 VAL 56 -8.282 -13.537 5.787 481 HA PRO 90 HA PRO 57 -12.723 -16.120 8.483 482 HB2 PRO 90 HB2 PRO 57 -12.486 -17.155 10.992 483 HB3 PRO 90 HB3 PRO 57 -12.492 -18.174 9.526 484 HG2 PRO 90 HG2 PRO 57 -10.098 -17.182 11.102 485 HG3 PRO 90 HG3 PRO 57 -10.436 -18.844 10.513 486 HD2 PRO 90 HD2 PRO 57 -8.821 -17.064 9.153 487 HD3 PRO 90 HD3 PRO 57 -9.803 -18.319 8.356 488 H ALA 91 H ALA 58 -9.800 -14.671 9.729 489 HA ALA 91 HA ALA 58 -11.160 -12.973 11.686 490 HB1 ALA 91 HB1 ALA 58 -8.318 -12.877 10.570 491 HB2 ALA 91 HB2 ALA 58 -8.923 -11.995 11.992 492 HB3 ALA 91 HB3 ALA 58 -8.834 -13.764 12.030 493 H VAL 92 H VAL 59 -10.920 -12.866 8.287 494 HA VAL 92 HA VAL 59 -11.401 -9.915 8.281 495 HB VAL 92 HB VAL 59 -9.693 -11.386 6.255 496 HG11 VAL 92 HG11 VAL 59 -10.011 -8.414 6.813 497 HG12 VAL 92 HG12 VAL 59 -8.948 -9.152 5.586 498 HG13 VAL 92 HG13 VAL 59 -10.702 -9.297 5.437 499 HG21 VAL 92 HG21 VAL 59 -8.730 -9.745 8.631 500 HG22 VAL 92 HG22 VAL 59 -8.419 -11.473 8.339 501 HG23 VAL 92 HG23 VAL 59 -7.717 -10.262 7.269 502 H VAL 93 H VAL 60 -12.273 -13.100 7.105 503 HA VAL 93 HA VAL 60 -14.360 -11.982 5.314 504 HB VAL 93 HB VAL 60 -12.157 -13.975 4.786 505 HG11 VAL 93 HG11 VAL 60 -14.094 -15.127 3.879 506 HG12 VAL 93 HG12 VAL 60 -14.587 -13.662 2.992 507 HG13 VAL 93 HG13 VAL 60 -13.089 -14.511 2.577 508 HG21 VAL 93 HG21 VAL 60 -13.015 -11.408 3.423 509 HG22 VAL 93 HG22 VAL 60 -11.489 -11.738 4.239 510 HG23 VAL 93 HG23 VAL 60 -11.841 -12.544 2.716 511 H ARG 94 H ARG 61 -15.961 -13.714 4.839 512 HA ARG 94 HA ARG 61 -16.450 -15.620 7.049 513 HB2 ARG 94 HB2 ARG 61 -17.357 -13.679 8.002 514 HB3 ARG 94 HB3 ARG 61 -17.963 -13.051 6.469 515 HG2 ARG 94 HG2 ARG 61 -19.801 -14.662 6.484 516 HG3 ARG 94 HG3 ARG 61 -19.118 -15.500 7.884 517 HD2 ARG 94 HD2 ARG 61 -21.040 -14.023 8.481 518 HD3 ARG 94 HD3 ARG 61 -19.536 -13.627 9.328 519 HE ARG 94 HE ARG 61 -19.957 -12.087 6.875 520 HH11 ARG 94 HH11 ARG 61 -21.156 -12.208 10.194 521 HH12 ARG 94 HH12 ARG 61 -21.135 -10.497 10.427 522 HH21 ARG 94 HH21 ARG 61 -19.573 -9.813 7.307 523 HH22 ARG 94 HH22 ARG 61 -20.385 -9.098 8.664 524 H ILE 95 H ILE 62 -18.140 -17.207 6.316 525 HA ILE 95 HA ILE 62 -19.050 -16.940 3.529 526 HB ILE 95 HB ILE 62 -18.284 -19.210 2.962 527 HG12 ILE 95 HG12 ILE 62 -16.699 -19.128 5.553 528 HG13 ILE 95 HG13 ILE 62 -18.091 -20.167 5.217 529 HG21 ILE 95 HG21 ILE 62 -15.952 -18.665 2.475 530 HG22 ILE 95 HG22 ILE 62 -16.873 -17.181 2.361 531 HG23 ILE 95 HG23 ILE 62 -15.883 -17.503 3.799 532 HD11 ILE 95 HD11 ILE 62 -16.111 -21.474 4.995 533 HD12 ILE 95 HD12 ILE 62 -16.781 -21.250 3.368 534 HD13 ILE 95 HD13 ILE 62 -15.357 -20.309 3.900 535 H GLU 96 H GLU 63 -20.861 -18.259 3.060 536 HA GLU 96 HA GLU 63 -22.021 -19.842 5.299 537 HB2 GLU 96 HB2 GLU 63 -23.495 -17.791 3.588 538 HB3 GLU 96 HB3 GLU 63 -24.268 -19.064 4.538 539 HG2 GLU 96 HG2 GLU 63 -23.049 -18.129 6.585 540 HG3 GLU 96 HG3 GLU 63 -22.625 -16.736 5.585 541 H ALA 97 H ALA 64 -21.565 -21.793 4.458 542 HA ALA 97 HA ALA 64 -22.016 -22.468 1.625 543 HB1 ALA 97 HB1 ALA 64 -20.243 -23.617 2.848 544 HB2 ALA 97 HB2 ALA 64 -21.430 -24.234 4.033 545 HB3 ALA 97 HB3 ALA 64 -21.512 -24.740 2.333 546 H SER 98 H SER 65 -24.025 -22.668 0.880 547 HA SER 98 HA SER 65 -26.347 -22.788 2.642 548 HB2 SER 98 HB2 SER 65 -26.372 -21.422 0.606 549 HB3 SER 98 HB3 SER 65 -25.974 -22.829 -0.394 550 HG SER 98 HG SER 65 -28.285 -22.188 -0.243 551 H ARG 99 H ARG 66 -27.865 -24.483 2.535 552 HA ARG 99 HA ARG 66 -26.856 -27.186 2.378 553 HB2 ARG 99 HB2 ARG 66 -29.275 -27.857 2.552 554 HB3 ARG 99 HB3 ARG 66 -28.610 -26.916 3.869 555 HG2 ARG 99 HG2 ARG 66 -30.894 -26.300 3.405 556 HG3 ARG 99 HG3 ARG 66 -29.826 -24.923 3.176 557 HD2 ARG 99 HD2 ARG 66 -30.075 -24.978 0.804 558 HD3 ARG 99 HD3 ARG 66 -30.788 -26.613 0.833 559 HE ARG 99 HE ARG 66 -32.440 -24.963 2.395 560 HH11 ARG 99 HH11 ARG 66 -31.396 -24.944 -1.020 561 HH12 ARG 99 HH12 ARG 66 -32.942 -24.469 -1.622 562 HH21 ARG 99 HH21 ARG 66 -34.457 -24.239 1.591 563 HH22 ARG 99 HH22 ARG 66 -34.693 -23.968 -0.096 564 H SER 100 H SER 67 -28.044 -24.999 -0.091 565 HA SER 100 HA SER 67 -28.698 -27.023 -2.019 566 HB2 SER 100 HB2 SER 67 -27.748 -24.174 -2.497 567 HB3 SER 100 HB3 SER 67 -28.725 -25.183 -3.578 568 HG SER 100 HG SER 67 -29.943 -23.622 -2.306 569 H GLY 101 H GLY 68 -25.624 -26.031 -0.707 570 HA2 GLY 101 HA2 GLY 68 -23.664 -27.212 -1.151 571 HA3 GLY 101 HA3 GLY 68 -24.188 -27.553 -2.807 572 H GLU 102 H GLU 69 -24.939 -24.360 -2.529 573 HA GLU 102 HA GLU 69 -22.434 -23.380 -3.720 574 HB2 GLU 102 HB2 GLU 69 -25.074 -22.053 -2.932 575 HB3 GLU 102 HB3 GLU 69 -23.711 -21.164 -3.587 576 HG2 GLU 102 HG2 GLU 69 -25.239 -23.396 -4.981 577 HG3 GLU 102 HG3 GLU 69 -25.348 -21.674 -5.335 578 H ILE 103 H ILE 70 -21.389 -21.440 -2.714 579 HA ILE 103 HA ILE 70 -21.724 -21.144 0.174 580 HB ILE 103 HB ILE 70 -20.044 -22.743 0.177 581 HG12 ILE 103 HG12 ILE 70 -19.577 -20.769 1.634 582 HG13 ILE 103 HG13 ILE 70 -18.225 -21.836 1.264 583 HG21 ILE 103 HG21 ILE 70 -17.855 -22.527 -1.008 584 HG22 ILE 103 HG22 ILE 70 -19.262 -23.043 -1.968 585 HG23 ILE 103 HG23 ILE 70 -18.670 -21.364 -2.085 586 HD11 ILE 103 HD11 ILE 70 -17.604 -20.066 -0.612 587 HD12 ILE 103 HD12 ILE 70 -18.649 -19.002 0.350 588 HD13 ILE 103 HD13 ILE 70 -17.222 -19.776 1.060 589 H VAL 104 H VAL 71 -22.230 -19.124 0.436 590 HA VAL 104 HA VAL 71 -21.344 -17.121 -1.568 591 HB VAL 104 HB VAL 71 -23.257 -16.693 0.760 592 HG11 VAL 104 HG11 VAL 71 -24.017 -14.797 -0.648 593 HG12 VAL 104 HG12 VAL 71 -22.291 -14.678 -0.315 594 HG13 VAL 104 HG13 VAL 71 -22.849 -15.236 -1.905 595 HG21 VAL 104 HG21 VAL 71 -25.133 -16.966 -0.818 596 HG22 VAL 104 HG22 VAL 71 -24.006 -17.512 -2.073 597 HG23 VAL 104 HG23 VAL 71 -24.269 -18.483 -0.608 598 H CYS 105 H CYS 72 -19.837 -15.648 -1.047 599 HA CYS 105 HA CYS 72 -18.436 -15.920 1.551 600 HB2 CYS 105 HB2 CYS 72 -17.548 -14.550 -1.013 601 HB3 CYS 105 HB3 CYS 72 -16.514 -15.160 0.301 602 HG CYS 105 HG CYS 72 -18.364 -16.757 -1.969 603 H TYR 106 H TYR 73 -17.845 -14.033 2.714 604 HA TYR 106 HA TYR 73 -19.109 -11.431 2.009 605 HB2 TYR 106 HB2 TYR 73 -19.461 -13.066 4.562 606 HB3 TYR 106 HB3 TYR 73 -19.957 -11.385 4.395 607 HD1 TYR 106 HD1 TYR 73 -21.666 -10.746 2.618 608 HD2 TYR 106 HD2 TYR 73 -20.894 -14.837 3.822 609 HE1 TYR 106 HE1 TYR 73 -23.926 -11.368 1.906 610 HE2 TYR 106 HE2 TYR 73 -23.114 -15.508 2.978 611 HH TYR 106 HH TYR 73 -25.460 -13.149 1.579 612 H ALA 107 H ALA 74 -18.374 -9.735 3.648 613 HA ALA 107 HA ALA 74 -15.485 -10.132 4.259 614 HB1 ALA 107 HB1 ALA 74 -16.245 -8.067 3.027 615 HB2 ALA 107 HB2 ALA 74 -17.193 -7.613 4.456 616 HB3 ALA 107 HB3 ALA 74 -15.414 -7.741 4.544 617 H VAL 108 H VAL 75 -14.732 -9.351 6.327 618 HA VAL 108 HA VAL 75 -16.714 -9.075 8.514 619 HB VAL 108 HB VAL 75 -15.064 -11.420 8.080 620 HG11 VAL 108 HG11 VAL 75 -14.165 -11.830 10.288 621 HG12 VAL 108 HG12 VAL 75 -13.400 -10.389 9.603 622 HG13 VAL 108 HG13 VAL 75 -14.659 -10.214 10.846 623 HG21 VAL 108 HG21 VAL 75 -17.453 -11.414 8.661 624 HG22 VAL 108 HG22 VAL 75 -16.514 -12.347 9.839 625 HG23 VAL 108 HG23 VAL 75 -17.076 -10.722 10.252 626 H ALA 109 H ALA 76 -13.497 -8.292 7.215 627 HA ALA 109 HA ALA 76 -13.453 -5.945 8.935 628 HB1 ALA 109 HB1 ALA 76 -11.199 -6.289 9.764 629 HB2 ALA 109 HB2 ALA 76 -12.178 -7.659 10.289 630 HB3 ALA 109 HB3 ALA 76 -11.044 -7.826 8.920
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